# By using this file you agree to the legally binding terms of use found at
# https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
# To request access to the AlphaFold 3 model parameters, follow the process set
# out at https://github.com/google-deepmind/alphafold3. You may only use these if
# received directly from Google. Use is subject to terms of use available at
# https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
data_spkb38435
#
_entry.id spkb38435
#
loop_
_atom_type.symbol
C 
N 
O 
S 
#
loop_
_audit_author.name
_audit_author.pdbx_ordinal
"Google DeepMind" 1 
"Isomorphic Labs" 2 
#
_audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic
_audit_conform.dict_name     mmcif_ma.dic
_audit_conform.dict_version  1.4.5
#
loop_
_chem_comp.formula
_chem_comp.formula_weight
_chem_comp.id
_chem_comp.mon_nstd_flag
_chem_comp.name
_chem_comp.pdbx_smiles
_chem_comp.pdbx_synonyms
_chem_comp.type
"C3 H7 N O2"    89.093  ALA y ALANINE    C[C@@H](C(=O)O)N            ? "L-PEPTIDE LINKING" 
"C2 H5 N O2"    75.067  GLY y GLYCINE    C(C(=O)O)N                  ? "PEPTIDE LINKING"   
"C6 H13 N O2"   131.173 ILE y ISOLEUCINE CC[C@H](C)[C@@H](C(=O)O)N   ? "L-PEPTIDE LINKING" 
"C6 H13 N O2"   131.173 LEU y LEUCINE    CC(C)C[C@@H](C(=O)O)N       ? "L-PEPTIDE LINKING" 
"C6 H15 N2 O2"  147.195 LYS y LYSINE     C(CC[NH3+])C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" 
"C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@@H](C(=O)O)N         ? "L-PEPTIDE LINKING" 
"C3 H7 N O3"    105.093 SER y SERINE     C([C@@H](C(=O)O)N)O         ? "L-PEPTIDE LINKING" 
"C4 H9 N O3"    119.119 THR y THREONINE  C[C@H]([C@@H](C(=O)O)N)O    ? "L-PEPTIDE LINKING" 
"C5 H11 N O2"   117.146 VAL y VALINE     CC(C)[C@@H](C(=O)O)N        ? "L-PEPTIDE LINKING" 
#
_citation.book_publisher          ?
_citation.country                 UK
_citation.id                      primary
_citation.journal_full            Nature
_citation.journal_id_ASTM         NATUAS
_citation.journal_id_CSD          0006
_citation.journal_id_ISSN         0028-0836
_citation.journal_volume          630
_citation.page_first              493
_citation.page_last               500
_citation.pdbx_database_id_DOI    10.1038/s41586-024-07487-w
_citation.pdbx_database_id_PubMed 38718835
_citation.title                   "Accurate structure prediction of biomolecular interactions with AlphaFold 3"
_citation.year                    2024
#
loop_
_citation_author.citation_id
_citation_author.name
_citation_author.ordinal
primary "Google DeepMind" 1 
primary "Isomorphic Labs" 2 
#
_entity.id               1
_entity.pdbx_description .
_entity.type             polymer
#
_entity_poly.entity_id      1
_entity_poly.pdbx_strand_id A
_entity_poly.type           polypeptide(L)
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.hetero
_entity_poly_seq.mon_id
_entity_poly_seq.num
1 n MET 1  
1 n LYS 2  
1 n LEU 3  
1 n SER 4  
1 n VAL 5  
1 n LYS 6  
1 n ILE 7  
1 n ALA 8  
1 n GLY 9  
1 n VAL 10 
1 n LEU 11 
1 n THR 12 
1 n VAL 13 
1 n ALA 14 
1 n ALA 15 
1 n ALA 16 
1 n ALA 17 
1 n MET 18 
1 n THR 19 
#
_ma_data.content_type "model coordinates"
_ma_data.id           1
_ma_data.name         Model
#
_ma_model_list.data_id          1
_ma_model_list.model_group_id   1
_ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.0 @ 2025-07-07 22:20:53)"
_ma_model_list.model_id         1
_ma_model_list.model_name       "Top ranked model"
_ma_model_list.model_type       "Ab initio model"
_ma_model_list.ordinal_id       1
#
loop_
_ma_protocol_step.method_type
_ma_protocol_step.ordinal_id
_ma_protocol_step.protocol_id
_ma_protocol_step.step_id
"coevolution MSA" 1 1 1 
"template search" 2 1 2 
modeling          3 1 3 
#
loop_
_ma_qa_metric.id
_ma_qa_metric.mode
_ma_qa_metric.name
_ma_qa_metric.software_group_id
_ma_qa_metric.type
1 global pLDDT 1 pLDDT 
2 local  pLDDT 1 pLDDT 
#
_ma_qa_metric_global.metric_id    1
_ma_qa_metric_global.metric_value 94.27
_ma_qa_metric_global.model_id     1
_ma_qa_metric_global.ordinal_id   1
#
loop_
_ma_qa_metric_local.label_asym_id
_ma_qa_metric_local.label_comp_id
_ma_qa_metric_local.label_seq_id
_ma_qa_metric_local.metric_id
_ma_qa_metric_local.metric_value
_ma_qa_metric_local.model_id
_ma_qa_metric_local.ordinal_id
A MET 1  2 84.19 1 1  
A LYS 2  2 86.85 1 2  
A LEU 3  2 92.19 1 3  
A SER 4  2 95.37 1 4  
A VAL 5  2 96.77 1 5  
A LYS 6  2 92.86 1 6  
A ILE 7  2 95.80 1 7  
A ALA 8  2 97.91 1 8  
A GLY 9  2 97.56 1 9  
A VAL 10 2 97.35 1 10 
A LEU 11 2 96.19 1 11 
A THR 12 2 97.03 1 12 
A VAL 13 2 97.84 1 13 
A ALA 14 2 98.09 1 14 
A ALA 15 2 98.19 1 15 
A ALA 16 2 98.32 1 16 
A ALA 17 2 98.02 1 17 
A MET 18 2 91.50 1 18 
A THR 19 2 90.75 1 19 
#
_ma_software_group.group_id    1
_ma_software_group.ordinal_id  1
_ma_software_group.software_id 1
#
_ma_target_entity.data_id   1
_ma_target_entity.entity_id 1
_ma_target_entity.origin    .
#
_ma_target_entity_instance.asym_id   A
_ma_target_entity_instance.details   .
_ma_target_entity_instance.entity_id 1
#
loop_
_pdbx_data_usage.details
_pdbx_data_usage.id
_pdbx_data_usage.type
_pdbx_data_usage.url
;Non-commercial use only, by using this file you agree to the terms of use found
at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
To request access to the AlphaFold 3 model parameters, follow the process set
out at https://github.com/google-deepmind/alphafold3. You may only use these if
received directly from Google. Use is subject to terms of use available at
https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
;
1 license    https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md 
;AlphaFold 3 and its output are not intended for, have not been validated for,
and are not approved for clinical use. They are provided "as-is" without any
warranty of any kind, whether expressed or implied. No warranty is given that
use shall not infringe the rights of any third party.
;
2 disclaimer ?                                                                              
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.hetero
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.seq_id
A 1  1 n MET . 1  A 1  
A 2  1 n LYS . 2  A 2  
A 3  1 n LEU . 3  A 3  
A 4  1 n SER . 4  A 4  
A 5  1 n VAL . 5  A 5  
A 6  1 n LYS . 6  A 6  
A 7  1 n ILE . 7  A 7  
A 8  1 n ALA . 8  A 8  
A 9  1 n GLY . 9  A 9  
A 10 1 n VAL . 10 A 10 
A 11 1 n LEU . 11 A 11 
A 12 1 n THR . 12 A 12 
A 13 1 n VAL . 13 A 13 
A 14 1 n ALA . 14 A 14 
A 15 1 n ALA . 15 A 15 
A 16 1 n ALA . 16 A 16 
A 17 1 n ALA . 17 A 17 
A 18 1 n MET . 18 A 18 
A 19 1 n THR . 19 A 19 
#
_software.classification other
_software.date           ?
_software.description    "Structure prediction"
_software.name           AlphaFold
_software.pdbx_ordinal   1
_software.type           package
_software.version        "AlphaFold-beta-20231127 (9ceee3b5f7825b611ab42eaad843248507ced2da1e745fa3b3d93c6c4ad3ca74)"
#
_struct_asym.entity_id 1
_struct_asym.id        A
#
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.auth_seq_id
_atom_site.auth_asym_id
_atom_site.pdbx_PDB_model_num
ATOM 1   N N   . MET A 1 1  ? -10.796 -2.194 1.761  1.00 88.01 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? -11.998 -1.414 2.053  1.00 90.37 1  A 1 
ATOM 3   C C   . MET A 1 1  ? -11.645 -0.163 2.842  1.00 91.85 1  A 1 
ATOM 4   O O   . MET A 1 1  ? -11.997 0.951  2.458  1.00 88.44 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? -12.994 -2.257 2.849  1.00 84.79 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? -13.497 -3.466 2.056  1.00 81.13 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? -14.367 -2.983 0.558  1.00 79.24 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? -14.764 -4.589 -0.106 1.00 69.72 1  A 1 
ATOM 9   N N   . LYS A 1 2  ? -10.950 -0.367 3.959  1.00 89.80 2  A 1 
ATOM 10  C CA  . LYS A 1 2  ? -10.569 0.757  4.811  1.00 93.32 2  A 1 
ATOM 11  C C   . LYS A 1 2  ? -9.512  1.610  4.134  1.00 95.04 2  A 1 
ATOM 12  O O   . LYS A 1 2  ? -8.618  1.092  3.460  1.00 93.60 2  A 1 
ATOM 13  C CB  . LYS A 1 2  ? -10.045 0.257  6.153  1.00 90.72 2  A 1 
ATOM 14  C CG  . LYS A 1 2  ? -11.106 -0.466 6.965  1.00 85.07 2  A 1 
ATOM 15  C CD  . LYS A 1 2  ? -10.600 -0.811 8.354  1.00 84.35 2  A 1 
ATOM 16  C CE  . LYS A 1 2  ? -9.480  -1.835 8.299  1.00 77.14 2  A 1 
ATOM 17  N NZ  . LYS A 1 2  ? -9.053  -2.248 9.650  1.00 72.61 2  A 1 
ATOM 18  N N   . LEU A 1 3  ? -9.590  2.918  4.336  1.00 94.26 3  A 1 
ATOM 19  C CA  . LEU A 1 3  ? -8.629  3.850  3.750  1.00 95.43 3  A 1 
ATOM 20  C C   . LEU A 1 3  ? -7.223  3.584  4.277  1.00 96.97 3  A 1 
ATOM 21  O O   . LEU A 1 3  ? -6.240  3.734  3.548  1.00 95.78 3  A 1 
ATOM 22  C CB  . LEU A 1 3  ? -9.042  5.286  4.066  1.00 94.64 3  A 1 
ATOM 23  C CG  . LEU A 1 3  ? -10.375 5.704  3.437  1.00 88.80 3  A 1 
ATOM 24  C CD1 . LEU A 1 3  ? -10.773 7.083  3.935  1.00 86.16 3  A 1 
ATOM 25  C CD2 . LEU A 1 3  ? -10.286 5.695  1.918  1.00 85.52 3  A 1 
ATOM 26  N N   . SER A 1 4  ? -7.127  3.188  5.543  1.00 97.12 4  A 1 
ATOM 27  C CA  . SER A 1 4  ? -5.840  2.901  6.174  1.00 97.34 4  A 1 
ATOM 28  C C   . SER A 1 4  ? -5.090  1.796  5.439  1.00 97.69 4  A 1 
ATOM 29  O O   . SER A 1 4  ? -3.865  1.833  5.329  1.00 97.05 4  A 1 
ATOM 30  C CB  . SER A 1 4  ? -6.051  2.494  7.629  1.00 96.42 4  A 1 
ATOM 31  O OG  . SER A 1 4  ? -6.832  1.324  7.709  1.00 86.61 4  A 1 
ATOM 32  N N   . VAL A 1 5  ? -5.825  0.818  4.923  1.00 97.60 5  A 1 
ATOM 33  C CA  . VAL A 1 5  ? -5.218  -0.292 4.194  1.00 97.70 5  A 1 
ATOM 34  C C   . VAL A 1 5  ? -4.564  0.211  2.911  1.00 97.97 5  A 1 
ATOM 35  O O   . VAL A 1 5  ? -3.423  -0.143 2.590  1.00 97.34 5  A 1 
ATOM 36  C CB  . VAL A 1 5  ? -6.259  -1.375 3.864  1.00 97.20 5  A 1 
ATOM 37  C CG1 . VAL A 1 5  ? -5.642  -2.484 3.023  1.00 94.83 5  A 1 
ATOM 38  C CG2 . VAL A 1 5  ? -6.828  -1.953 5.152  1.00 94.72 5  A 1 
ATOM 39  N N   . LYS A 1 6  ? -5.289  1.039  2.179  1.00 97.63 6  A 1 
ATOM 40  C CA  . LYS A 1 6  ? -4.780  1.581  0.922  1.00 97.80 6  A 1 
ATOM 41  C C   . LYS A 1 6  ? -3.617  2.533  1.175  1.00 97.99 6  A 1 
ATOM 42  O O   . LYS A 1 6  ? -2.601  2.481  0.480  1.00 97.79 6  A 1 
ATOM 43  C CB  . LYS A 1 6  ? -5.896  2.299  0.166  1.00 97.61 6  A 1 
ATOM 44  C CG  . LYS A 1 6  ? -6.987  1.345  -0.297 1.00 93.44 6  A 1 
ATOM 45  C CD  . LYS A 1 6  ? -8.081  2.091  -1.039 1.00 90.22 6  A 1 
ATOM 46  C CE  . LYS A 1 6  ? -9.174  1.138  -1.501 1.00 84.63 6  A 1 
ATOM 47  N NZ  . LYS A 1 6  ? -10.266 1.865  -2.202 1.00 78.66 6  A 1 
ATOM 48  N N   . ILE A 1 7  ? -3.766  3.385  2.170  1.00 97.92 7  A 1 
ATOM 49  C CA  . ILE A 1 7  ? -2.730  4.352  2.516  1.00 97.94 7  A 1 
ATOM 50  C C   . ILE A 1 7  ? -1.459  3.634  2.959  1.00 98.12 7  A 1 
ATOM 51  O O   . ILE A 1 7  ? -0.358  3.962  2.508  1.00 97.87 7  A 1 
ATOM 52  C CB  . ILE A 1 7  ? -3.220  5.299  3.621  1.00 97.68 7  A 1 
ATOM 53  C CG1 . ILE A 1 7  ? -4.402  6.138  3.110  1.00 94.64 7  A 1 
ATOM 54  C CG2 . ILE A 1 7  ? -2.084  6.215  4.073  1.00 94.09 7  A 1 
ATOM 55  C CD1 . ILE A 1 7  ? -5.109  6.902  4.212  1.00 88.14 7  A 1 
ATOM 56  N N   . ALA A 1 8  ? -1.618  2.650  3.835  1.00 98.21 8  A 1 
ATOM 57  C CA  . ALA A 1 8  ? -0.476  1.892  4.336  1.00 98.04 8  A 1 
ATOM 58  C C   . ALA A 1 8  ? 0.211   1.123  3.214  1.00 98.18 8  A 1 
ATOM 59  O O   . ALA A 1 8  ? 1.440   1.073  3.147  1.00 97.60 8  A 1 
ATOM 60  C CB  . ALA A 1 8  ? -0.931  0.926  5.424  1.00 97.51 8  A 1 
ATOM 61  N N   . GLY A 1 9  ? -0.592  0.529  2.331  1.00 97.58 9  A 1 
ATOM 62  C CA  . GLY A 1 9  ? -0.047  -0.229 1.213  1.00 97.26 9  A 1 
ATOM 63  C C   . GLY A 1 9  ? 0.770   0.641  0.276  1.00 97.79 9  A 1 
ATOM 64  O O   . GLY A 1 9  ? 1.898   0.302  -0.083 1.00 97.62 9  A 1 
ATOM 65  N N   . VAL A 1 10 ? 0.201   1.775  -0.123 1.00 98.08 10 A 1 
ATOM 66  C CA  . VAL A 1 10 ? 0.882   2.700  -1.030 1.00 98.17 10 A 1 
ATOM 67  C C   . VAL A 1 10 ? 2.141   3.263  -0.383 1.00 98.38 10 A 1 
ATOM 68  O O   . VAL A 1 10 ? 3.203   3.321  -1.011 1.00 98.06 10 A 1 
ATOM 69  C CB  . VAL A 1 10 ? -0.049  3.848  -1.442 1.00 97.74 10 A 1 
ATOM 70  C CG1 . VAL A 1 10 ? 0.704   4.886  -2.266 1.00 95.62 10 A 1 
ATOM 71  C CG2 . VAL A 1 10 ? -1.223  3.299  -2.235 1.00 95.40 10 A 1 
ATOM 72  N N   . LEU A 1 11 ? 2.018   3.671  0.872  1.00 98.06 11 A 1 
ATOM 73  C CA  . LEU A 1 11 ? 3.148   4.245  1.593  1.00 98.02 11 A 1 
ATOM 74  C C   . LEU A 1 11 ? 4.257   3.222  1.783  1.00 98.22 11 A 1 
ATOM 75  O O   . LEU A 1 11 ? 5.440   3.553  1.680  1.00 97.84 11 A 1 
ATOM 76  C CB  . LEU A 1 11 ? 2.687   4.767  2.953  1.00 97.67 11 A 1 
ATOM 77  C CG  . LEU A 1 11 ? 3.792   5.468  3.739  1.00 94.80 11 A 1 
ATOM 78  C CD1 . LEU A 1 11 ? 4.287   6.692  2.995  1.00 92.43 11 A 1 
ATOM 79  C CD2 . LEU A 1 11 ? 3.283   5.856  5.122  1.00 92.51 11 A 1 
ATOM 80  N N   . THR A 1 12 ? 3.879   1.978  2.058  1.00 98.07 12 A 1 
ATOM 81  C CA  . THR A 1 12 ? 4.854   0.910  2.263  1.00 98.06 12 A 1 
ATOM 82  C C   . THR A 1 12 ? 5.673   0.678  0.999  1.00 98.39 12 A 1 
ATOM 83  O O   . THR A 1 12 ? 6.901   0.574  1.053  1.00 98.09 12 A 1 
ATOM 84  C CB  . THR A 1 12 ? 4.156   -0.397 2.653  1.00 97.52 12 A 1 
ATOM 85  O OG1 . THR A 1 12 ? 3.443   -0.218 3.867  1.00 95.01 12 A 1 
ATOM 86  C CG2 . THR A 1 12 ? 5.179   -1.513 2.845  1.00 94.10 12 A 1 
ATOM 87  N N   . VAL A 1 13 ? 4.994   0.607  -0.140 1.00 98.40 13 A 1 
ATOM 88  C CA  . VAL A 1 13 ? 5.670   0.400  -1.415 1.00 98.44 13 A 1 
ATOM 89  C C   . VAL A 1 13 ? 6.593   1.572  -1.722 1.00 98.61 13 A 1 
ATOM 90  O O   . VAL A 1 13 ? 7.745   1.383  -2.128 1.00 98.42 13 A 1 
ATOM 91  C CB  . VAL A 1 13 ? 4.655   0.222  -2.554 1.00 98.05 13 A 1 
ATOM 92  C CG1 . VAL A 1 13 ? 5.364   0.128  -3.900 1.00 96.31 13 A 1 
ATOM 93  C CG2 . VAL A 1 13 ? 3.822   -1.028 -2.316 1.00 96.67 13 A 1 
ATOM 94  N N   . ALA A 1 14 ? 6.084   2.779  -1.525 1.00 98.21 14 A 1 
ATOM 95  C CA  . ALA A 1 14 ? 6.865   3.982  -1.781 1.00 98.11 14 A 1 
ATOM 96  C C   . ALA A 1 14 ? 8.072   4.058  -0.853 1.00 98.35 14 A 1 
ATOM 97  O O   . ALA A 1 14 ? 9.173   4.403  -1.284 1.00 98.07 14 A 1 
ATOM 98  C CB  . ALA A 1 14 ? 5.992   5.219  -1.602 1.00 97.72 14 A 1 
ATOM 99  N N   . ALA A 1 15 ? 7.871   3.734  0.419  1.00 98.30 15 A 1 
ATOM 100 C CA  . ALA A 1 15 ? 8.948   3.772  1.402  1.00 98.25 15 A 1 
ATOM 101 C C   . ALA A 1 15 ? 10.028  2.755  1.071  1.00 98.45 15 A 1 
ATOM 102 O O   . ALA A 1 15 ? 11.220  3.049  1.172  1.00 98.14 15 A 1 
ATOM 103 C CB  . ALA A 1 15 ? 8.392   3.505  2.795  1.00 97.81 15 A 1 
ATOM 104 N N   . ALA A 1 16 ? 9.620   1.557  0.656  1.00 98.52 16 A 1 
ATOM 105 C CA  . ALA A 1 16 ? 10.563  0.502  0.302  1.00 98.42 16 A 1 
ATOM 106 C C   . ALA A 1 16 ? 11.404  0.905  -0.901 1.00 98.54 16 A 1 
ATOM 107 O O   . ALA A 1 16 ? 12.602  0.620  -0.956 1.00 98.09 16 A 1 
ATOM 108 C CB  . ALA A 1 16 ? 9.814   -0.793 0.004  1.00 98.01 16 A 1 
ATOM 109 N N   . ALA A 1 17 ? 10.776  1.563  -1.871 1.00 98.23 17 A 1 
ATOM 110 C CA  . ALA A 1 17 ? 11.474  2.008  -3.072 1.00 98.17 17 A 1 
ATOM 111 C C   . ALA A 1 17 ? 12.410  3.177  -2.779 1.00 98.28 17 A 1 
ATOM 112 O O   . ALA A 1 17 ? 13.513  3.254  -3.325 1.00 97.70 17 A 1 
ATOM 113 C CB  . ALA A 1 17 ? 10.463  2.405  -4.144 1.00 97.72 17 A 1 
ATOM 114 N N   . MET A 1 18 ? 11.963  4.091  -1.928 1.00 97.77 18 A 1 
ATOM 115 C CA  . MET A 1 18 ? 12.754  5.273  -1.575 1.00 97.44 18 A 1 
ATOM 116 C C   . MET A 1 18 ? 13.918  4.925  -0.656 1.00 97.36 18 A 1 
ATOM 117 O O   . MET A 1 18 ? 15.019  5.444  -0.808 1.00 95.64 18 A 1 
ATOM 118 C CB  . MET A 1 18 ? 11.867  6.315  -0.901 1.00 96.44 18 A 1 
ATOM 119 C CG  . MET A 1 18 ? 10.864  6.918  -1.862 1.00 90.86 18 A 1 
ATOM 120 S SD  . MET A 1 18 ? 9.781   8.109  -1.054 1.00 83.10 18 A 1 
ATOM 121 C CE  . MET A 1 18 ? 8.787   8.602  -2.456 1.00 73.43 18 A 1 
ATOM 122 N N   . THR A 1 19 ? 13.658  4.034  0.302  1.00 95.73 19 A 1 
ATOM 123 C CA  . THR A 1 19 ? 14.667  3.667  1.291  1.00 94.33 19 A 1 
ATOM 124 C C   . THR A 1 19 ? 15.233  2.289  1.004  1.00 92.38 19 A 1 
ATOM 125 O O   . THR A 1 19 ? 14.510  1.285  1.153  1.00 87.24 19 A 1 
ATOM 126 C CB  . THR A 1 19 ? 14.067  3.669  2.706  1.00 91.41 19 A 1 
ATOM 127 O OG1 . THR A 1 19 ? 12.980  2.761  2.785  1.00 88.27 19 A 1 
ATOM 128 C CG2 . THR A 1 19 ? 13.596  5.067  3.063  1.00 88.40 19 A 1 
ATOM 129 O OXT . THR A 1 19 ? 16.410  2.209  0.623  1.00 88.21 19 A 1 
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