# 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_spkb27094
#
_entry.id spkb27094
#
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 LEU y LEUCINE    CC(C)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 LEU 2  
1 n THR 3  
1 n VAL 4  
1 n LEU 5  
1 n ALA 6  
1 n ALA 7  
1 n LEU 8  
1 n SER 9  
1 n LEU 10 
1 n LEU 11 
1 n SER 12 
1 n LEU 13 
1 n LEU 14 
1 n THR 15 
1 n SER 16 
1 n ALA 17 
1 n THR 18 
1 n GLY 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 @ 2025-07-13 07:21:22)"
_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 91.87
_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 85.05 1 1  
A LEU 2  2 89.95 1 2  
A THR 3  2 94.74 1 3  
A VAL 4  2 95.13 1 4  
A LEU 5  2 90.53 1 5  
A ALA 6  2 96.09 1 6  
A ALA 7  2 96.55 1 7  
A LEU 8  2 93.90 1 8  
A SER 9  2 93.37 1 9  
A LEU 10 2 92.85 1 10 
A LEU 11 2 93.10 1 11 
A SER 12 2 95.04 1 12 
A LEU 13 2 93.43 1 13 
A LEU 14 2 92.82 1 14 
A THR 15 2 93.42 1 15 
A SER 16 2 91.89 1 16 
A ALA 17 2 92.78 1 17 
A THR 18 2 85.17 1 18 
A GLY 19 2 80.34 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 LEU . 2  A 2  
A 3  1 n THR . 3  A 3  
A 4  1 n VAL . 4  A 4  
A 5  1 n LEU . 5  A 5  
A 6  1 n ALA . 6  A 6  
A 7  1 n ALA . 7  A 7  
A 8  1 n LEU . 8  A 8  
A 9  1 n SER . 9  A 9  
A 10 1 n LEU . 10 A 10 
A 11 1 n LEU . 11 A 11 
A 12 1 n SER . 12 A 12 
A 13 1 n LEU . 13 A 13 
A 14 1 n LEU . 14 A 14 
A 15 1 n THR . 15 A 15 
A 16 1 n SER . 16 A 16 
A 17 1 n ALA . 17 A 17 
A 18 1 n THR . 18 A 18 
A 19 1 n GLY . 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  ? -9.216  9.007  6.111  1.00 91.67 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? -8.951  8.040  5.028  1.00 92.49 1  A 1 
ATOM 3   C C   . MET A 1 1  ? -7.761  7.147  5.368  1.00 93.37 1  A 1 
ATOM 4   O O   . MET A 1 1  ? -6.854  6.960  4.557  1.00 91.68 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? -8.685  8.786  3.723  1.00 86.80 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? -9.896  9.560  3.249  1.00 81.04 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? -9.683  10.210 1.584  1.00 76.98 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? -8.709  11.662 1.925  1.00 66.40 1  A 1 
ATOM 9   N N   . LEU A 1 2  ? -7.779  6.612  6.569  1.00 90.74 2  A 1 
ATOM 10  C CA  . LEU A 1 2  ? -6.700  5.738  7.030  1.00 93.89 2  A 1 
ATOM 11  C C   . LEU A 1 2  ? -6.749  4.387  6.315  1.00 95.95 2  A 1 
ATOM 12  O O   . LEU A 1 2  ? -5.713  3.808  5.990  1.00 94.99 2  A 1 
ATOM 13  C CB  . LEU A 1 2  ? -6.801  5.545  8.550  1.00 92.44 2  A 1 
ATOM 14  C CG  . LEU A 1 2  ? -8.094  4.870  9.013  1.00 87.46 2  A 1 
ATOM 15  C CD1 . LEU A 1 2  ? -7.845  4.156  10.335 1.00 83.41 2  A 1 
ATOM 16  C CD2 . LEU A 1 2  ? -9.205  5.895  9.193  1.00 80.76 2  A 1 
ATOM 17  N N   . THR A 1 3  ? -7.970  3.900  6.068  1.00 96.50 3  A 1 
ATOM 18  C CA  . THR A 1 3  ? -8.155  2.616  5.392  1.00 97.00 3  A 1 
ATOM 19  C C   . THR A 1 3  ? -7.643  2.677  3.955  1.00 97.31 3  A 1 
ATOM 20  O O   . THR A 1 3  ? -7.047  1.720  3.454  1.00 96.38 3  A 1 
ATOM 21  C CB  . THR A 1 3  ? -9.638  2.220  5.395  1.00 95.99 3  A 1 
ATOM 22  O OG1 . THR A 1 3  ? -10.195 2.447  6.684  1.00 90.96 3  A 1 
ATOM 23  C CG2 . THR A 1 3  ? -9.800  0.751  5.041  1.00 89.01 3  A 1 
ATOM 24  N N   . VAL A 1 4  ? -7.871  3.794  3.307  1.00 96.44 4  A 1 
ATOM 25  C CA  . VAL A 1 4  ? -7.425  3.990  1.925  1.00 96.68 4  A 1 
ATOM 26  C C   . VAL A 1 4  ? -5.903  3.910  1.853  1.00 97.13 4  A 1 
ATOM 27  O O   . VAL A 1 4  ? -5.340  3.256  0.970  1.00 96.50 4  A 1 
ATOM 28  C CB  . VAL A 1 4  ? -7.921  5.345  1.382  1.00 95.65 4  A 1 
ATOM 29  C CG1 . VAL A 1 4  ? -7.463  5.551  -0.053 1.00 91.66 4  A 1 
ATOM 30  C CG2 . VAL A 1 4  ? -9.443  5.421  1.457  1.00 91.84 4  A 1 
ATOM 31  N N   . LEU A 1 5  ? -5.251  4.554  2.785  1.00 92.94 5  A 1 
ATOM 32  C CA  . LEU A 1 5  ? -3.790  4.539  2.836  1.00 93.97 5  A 1 
ATOM 33  C C   . LEU A 1 5  ? -3.278  3.131  3.121  1.00 95.52 5  A 1 
ATOM 34  O O   . LEU A 1 5  ? -2.264  2.706  2.568  1.00 95.53 5  A 1 
ATOM 35  C CB  . LEU A 1 5  ? -3.324  5.505  3.922  1.00 92.95 5  A 1 
ATOM 36  C CG  . LEU A 1 5  ? -3.467  6.971  3.508  1.00 86.23 5  A 1 
ATOM 37  C CD1 . LEU A 1 5  ? -3.447  7.874  4.721  1.00 83.46 5  A 1 
ATOM 38  C CD2 . LEU A 1 5  ? -2.332  7.352  2.557  1.00 83.65 5  A 1 
ATOM 39  N N   . ALA A 1 6  ? -3.988  2.423  3.981  1.00 96.28 6  A 1 
ATOM 40  C CA  . ALA A 1 6  ? -3.615  1.052  4.325  1.00 96.00 6  A 1 
ATOM 41  C C   . ALA A 1 6  ? -3.694  0.148  3.097  1.00 96.72 6  A 1 
ATOM 42  O O   . ALA A 1 6  ? -2.815  -0.687 2.873  1.00 96.33 6  A 1 
ATOM 43  C CB  . ALA A 1 6  ? -4.536  0.535  5.424  1.00 95.14 6  A 1 
ATOM 44  N N   . ALA A 1 7  ? -4.743  0.324  2.314  1.00 96.59 7  A 1 
ATOM 45  C CA  . ALA A 1 7  ? -4.931  -0.475 1.103  1.00 96.65 7  A 1 
ATOM 46  C C   . ALA A 1 7  ? -3.798  -0.218 0.111  1.00 97.20 7  A 1 
ATOM 47  O O   . ALA A 1 7  ? -3.261  -1.152 -0.493 1.00 96.37 7  A 1 
ATOM 48  C CB  . ALA A 1 7  ? -6.282  -0.140 0.477  1.00 95.94 7  A 1 
ATOM 49  N N   . LEU A 1 8  ? -3.426  1.034  -0.026 1.00 96.98 8  A 1 
ATOM 50  C CA  . LEU A 1 8  ? -2.340  1.411  -0.931 1.00 96.71 8  A 1 
ATOM 51  C C   . LEU A 1 8  ? -1.016  0.846  -0.429 1.00 97.21 8  A 1 
ATOM 52  O O   . LEU A 1 8  ? -0.168  0.421  -1.216 1.00 96.87 8  A 1 
ATOM 53  C CB  . LEU A 1 8  ? -2.278  2.936  -1.028 1.00 96.03 8  A 1 
ATOM 54  C CG  . LEU A 1 8  ? -1.756  3.403  -2.384 1.00 90.85 8  A 1 
ATOM 55  C CD1 . LEU A 1 8  ? -2.576  4.581  -2.894 1.00 88.65 8  A 1 
ATOM 56  C CD2 . LEU A 1 8  ? -0.293  3.796  -2.293 1.00 87.89 8  A 1 
ATOM 57  N N   . SER A 1 9  ? -0.851  0.832  0.869  1.00 95.64 9  A 1 
ATOM 58  C CA  . SER A 1 9  ? 0.359   0.299  1.490  1.00 95.54 9  A 1 
ATOM 59  C C   . SER A 1 9  ? 0.512   -1.188 1.183  1.00 96.01 9  A 1 
ATOM 60  O O   . SER A 1 9  ? 1.610   -1.662 0.886  1.00 94.97 9  A 1 
ATOM 61  C CB  . SER A 1 9  ? 0.306   0.529  3.000  1.00 94.58 9  A 1 
ATOM 62  O OG  . SER A 1 9  ? 1.526   0.167  3.594  1.00 83.48 9  A 1 
ATOM 63  N N   . LEU A 1 10 ? -0.596  -1.906 1.251  1.00 96.19 10 A 1 
ATOM 64  C CA  . LEU A 1 10 ? -0.586  -3.341 0.966  1.00 95.97 10 A 1 
ATOM 65  C C   . LEU A 1 10 ? -0.145  -3.596 -0.468 1.00 96.64 10 A 1 
ATOM 66  O O   . LEU A 1 10 ? 0.673   -4.484 -0.730 1.00 95.91 10 A 1 
ATOM 67  C CB  . LEU A 1 10 ? -1.988  -3.911 1.200  1.00 95.20 10 A 1 
ATOM 68  C CG  . LEU A 1 10 ? -2.262  -4.232 2.667  1.00 89.67 10 A 1 
ATOM 69  C CD1 . LEU A 1 10 ? -3.758  -4.283 2.935  1.00 87.06 10 A 1 
ATOM 70  C CD2 . LEU A 1 10 ? -1.630  -5.576 3.029  1.00 86.15 10 A 1 
ATOM 71  N N   . LEU A 1 11 ? -0.681  -2.813 -1.386 1.00 96.93 11 A 1 
ATOM 72  C CA  . LEU A 1 11 ? -0.315  -2.942 -2.795 1.00 96.47 11 A 1 
ATOM 73  C C   . LEU A 1 11 ? 1.152   -2.587 -2.998 1.00 96.95 11 A 1 
ATOM 74  O O   . LEU A 1 11 ? 1.846   -3.225 -3.794 1.00 96.32 11 A 1 
ATOM 75  C CB  . LEU A 1 11 ? -1.206  -2.024 -3.630 1.00 95.76 11 A 1 
ATOM 76  C CG  . LEU A 1 11 ? -2.548  -2.661 -3.980 1.00 89.93 11 A 1 
ATOM 77  C CD1 . LEU A 1 11 ? -3.573  -1.591 -4.327 1.00 86.41 11 A 1 
ATOM 78  C CD2 . LEU A 1 11 ? -2.368  -3.607 -5.169 1.00 86.05 11 A 1 
ATOM 79  N N   . SER A 1 12 ? 1.605   -1.604 -2.277 1.00 96.93 12 A 1 
ATOM 80  C CA  . SER A 1 12 ? 2.996   -1.171 -2.356 1.00 96.75 12 A 1 
ATOM 81  C C   . SER A 1 12 ? 3.932   -2.295 -1.932 1.00 97.02 12 A 1 
ATOM 82  O O   . SER A 1 12 ? 4.961   -2.532 -2.564 1.00 95.52 12 A 1 
ATOM 83  C CB  . SER A 1 12 ? 3.204   0.049  -1.466 1.00 96.00 12 A 1 
ATOM 84  O OG  . SER A 1 12 ? 4.498   0.559  -1.644 1.00 88.00 12 A 1 
ATOM 85  N N   . LEU A 1 13 ? 3.559   -3.001 -0.875 1.00 97.00 13 A 1 
ATOM 86  C CA  . LEU A 1 13 ? 4.364   -4.116 -0.381 1.00 96.41 13 A 1 
ATOM 87  C C   . LEU A 1 13 ? 4.430   -5.221 -1.425 1.00 96.77 13 A 1 
ATOM 88  O O   . LEU A 1 13 ? 5.482   -5.826 -1.639 1.00 95.42 13 A 1 
ATOM 89  C CB  . LEU A 1 13 ? 3.756   -4.646 0.914  1.00 95.63 13 A 1 
ATOM 90  C CG  . LEU A 1 13 ? 4.075   -3.769 2.126  1.00 91.70 13 A 1 
ATOM 91  C CD1 . LEU A 1 13 ? 3.117   -4.052 3.266  1.00 87.98 13 A 1 
ATOM 92  C CD2 . LEU A 1 13 ? 5.514   -4.022 2.585  1.00 86.54 13 A 1 
ATOM 93  N N   . LEU A 1 14 ? 3.309   -5.483 -2.066 1.00 96.57 14 A 1 
ATOM 94  C CA  . LEU A 1 14 ? 3.243   -6.509 -3.101 1.00 95.96 14 A 1 
ATOM 95  C C   . LEU A 1 14 ? 4.138   -6.129 -4.271 1.00 96.12 14 A 1 
ATOM 96  O O   . LEU A 1 14 ? 4.841   -6.979 -4.824 1.00 94.49 14 A 1 
ATOM 97  C CB  . LEU A 1 14 ? 1.796   -6.678 -3.561 1.00 95.07 14 A 1 
ATOM 98  C CG  . LEU A 1 14 ? 1.515   -8.058 -4.151 1.00 91.84 14 A 1 
ATOM 99  C CD1 . LEU A 1 14 ? 0.126   -8.531 -3.755 1.00 87.09 14 A 1 
ATOM 100 C CD2 . LEU A 1 14 ? 1.633   -8.033 -5.667 1.00 85.39 14 A 1 
ATOM 101 N N   . THR A 1 15 ? 4.114   -4.872 -4.631 1.00 96.77 15 A 1 
ATOM 102 C CA  . THR A 1 15 ? 4.942   -4.371 -5.728 1.00 96.04 15 A 1 
ATOM 103 C C   . THR A 1 15 ? 6.417   -4.520 -5.386 1.00 95.86 15 A 1 
ATOM 104 O O   . THR A 1 15 ? 7.223   -4.911 -6.233 1.00 93.93 15 A 1 
ATOM 105 C CB  . THR A 1 15 ? 4.618   -2.902 -6.006 1.00 94.47 15 A 1 
ATOM 106 O OG1 . THR A 1 15 ? 3.220   -2.756 -6.215 1.00 89.67 15 A 1 
ATOM 107 C CG2 . THR A 1 15 ? 5.342   -2.419 -7.250 1.00 87.18 15 A 1 
ATOM 108 N N   . SER A 1 16 ? 6.765   -4.240 -4.148 1.00 96.19 16 A 1 
ATOM 109 C CA  . SER A 1 16 ? 8.143   -4.365 -3.690 1.00 95.19 16 A 1 
ATOM 110 C C   . SER A 1 16 ? 8.606   -5.810 -3.769 1.00 94.76 16 A 1 
ATOM 111 O O   . SER A 1 16 ? 9.747   -6.087 -4.135 1.00 90.76 16 A 1 
ATOM 112 C CB  . SER A 1 16 ? 8.270   -3.864 -2.255 1.00 93.05 16 A 1 
ATOM 113 O OG  . SER A 1 16 ? 8.075   -2.469 -2.200 1.00 81.38 16 A 1 
ATOM 114 N N   . ALA A 1 17 ? 7.713   -6.734 -3.415 1.00 94.57 17 A 1 
ATOM 115 C CA  . ALA A 1 17 ? 8.029   -8.160 -3.460 1.00 93.27 17 A 1 
ATOM 116 C C   . ALA A 1 17 ? 8.250   -8.619 -4.895 1.00 93.62 17 A 1 
ATOM 117 O O   . ALA A 1 17 ? 9.114   -9.458 -5.162 1.00 91.44 17 A 1 
ATOM 118 C CB  . ALA A 1 17 ? 6.903   -8.960 -2.814 1.00 91.02 17 A 1 
ATOM 119 N N   . THR A 1 18 ? 7.468   -8.069 -5.803 1.00 91.87 18 A 1 
ATOM 120 C CA  . THR A 1 18 ? 7.580   -8.423 -7.219 1.00 90.29 18 A 1 
ATOM 121 C C   . THR A 1 18 ? 8.899   -7.937 -7.794 1.00 88.86 18 A 1 
ATOM 122 O O   . THR A 1 18 ? 9.581   -8.672 -8.513 1.00 83.34 18 A 1 
ATOM 123 C CB  . THR A 1 18 ? 6.416   -7.816 -8.008 1.00 85.86 18 A 1 
ATOM 124 O OG1 . THR A 1 18 ? 5.186   -8.261 -7.436 1.00 79.04 18 A 1 
ATOM 125 C CG2 . THR A 1 18 ? 6.462   -8.252 -9.458 1.00 76.92 18 A 1 
ATOM 126 N N   . GLY A 1 19 ? 9.253   -6.714 -7.449 1.00 89.21 19 A 1 
ATOM 127 C CA  . GLY A 1 19 ? 10.494  -6.133 -7.938 1.00 83.69 19 A 1 
ATOM 128 C C   . GLY A 1 19 ? 10.479  -4.624 -7.896 1.00 79.33 19 A 1 
ATOM 129 O O   . GLY A 1 19 ? 9.693   -4.044 -7.128 1.00 72.71 19 A 1 
ATOM 130 O OXT . GLY A 1 19 ? 11.267  -3.992 -8.627 1.00 76.75 19 A 1 
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