# 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_spkb29724
#
_entry.id spkb29724
#
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" 
"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" 
"C9 H11 N O2"   165.189 PHE y PHENYLALANINE c1ccc(cc1)C[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 ALA 3  
1 n ALA 4  
1 n LEU 5  
1 n PHE 6  
1 n LEU 7  
1 n SER 8  
1 n ALA 9  
1 n LEU 10 
1 n ALA 11 
1 n SER 12 
1 n THR 13 
1 n ALA 14 
1 n VAL 15 
1 n GLY 16 
1 n VAL 17 
1 n VAL 18 
1 n ALA 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 @ 2025-07-03 15:23:26)"
_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 90.76
_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 80.95 1 1  
A LYS 2  2 84.83 1 2  
A ALA 3  2 92.99 1 3  
A ALA 4  2 95.04 1 4  
A LEU 5  2 91.58 1 5  
A PHE 6  2 89.86 1 6  
A LEU 7  2 92.41 1 7  
A SER 8  2 92.22 1 8  
A ALA 9  2 95.74 1 9  
A LEU 10 2 91.94 1 10 
A ALA 11 2 95.04 1 11 
A SER 12 2 92.36 1 12 
A THR 13 2 91.92 1 13 
A ALA 14 2 94.95 1 14 
A VAL 15 2 93.66 1 15 
A GLY 16 2 93.85 1 16 
A VAL 17 2 91.53 1 17 
A VAL 18 2 90.98 1 18 
A ALA 19 2 81.97 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 ALA . 3  A 3  
A 4  1 n ALA . 4  A 4  
A 5  1 n LEU . 5  A 5  
A 6  1 n PHE . 6  A 6  
A 7  1 n LEU . 7  A 7  
A 8  1 n SER . 8  A 8  
A 9  1 n ALA . 9  A 9  
A 10 1 n LEU . 10 A 10 
A 11 1 n ALA . 11 A 11 
A 12 1 n SER . 12 A 12 
A 13 1 n THR . 13 A 13 
A 14 1 n ALA . 14 A 14 
A 15 1 n VAL . 15 A 15 
A 16 1 n GLY . 16 A 16 
A 17 1 n VAL . 17 A 17 
A 18 1 n VAL . 18 A 18 
A 19 1 n ALA . 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  ? -12.570 5.525  -4.709 1.00 85.40 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? -11.941 4.266  -4.263 1.00 86.31 1  A 1 
ATOM 3   C C   . MET A 1 1  ? -10.820 4.554  -3.267 1.00 88.51 1  A 1 
ATOM 4   O O   . MET A 1 1  ? -9.646  4.500  -3.605 1.00 85.67 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? -11.355 3.511  -5.454 1.00 80.59 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? -12.396 3.231  -6.514 1.00 80.59 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? -11.701 2.319  -7.905 1.00 75.46 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? -13.007 2.516  -9.091 1.00 65.10 1  A 1 
ATOM 9   N N   . LYS A 1 2  ? -11.201 4.875  -2.050 1.00 89.43 2  A 1 
ATOM 10  C CA  . LYS A 1 2  ? -10.214 5.188  -1.016 1.00 91.71 2  A 1 
ATOM 11  C C   . LYS A 1 2  ? -9.571  3.916  -0.483 1.00 92.65 2  A 1 
ATOM 12  O O   . LYS A 1 2  ? -8.362  3.857  -0.289 1.00 91.76 2  A 1 
ATOM 13  C CB  . LYS A 1 2  ? -10.894 5.949  0.121  1.00 88.37 2  A 1 
ATOM 14  C CG  . LYS A 1 2  ? -11.445 7.288  -0.344 1.00 83.49 2  A 1 
ATOM 15  C CD  . LYS A 1 2  ? -12.130 8.018  0.789  1.00 80.99 2  A 1 
ATOM 16  C CE  . LYS A 1 2  ? -12.709 9.340  0.300  1.00 75.55 2  A 1 
ATOM 17  N NZ  . LYS A 1 2  ? -13.409 10.050 1.403  1.00 69.53 2  A 1 
ATOM 18  N N   . ALA A 1 3  ? -10.395 2.893  -0.254 1.00 92.23 3  A 1 
ATOM 19  C CA  . ALA A 1 3  ? -9.900  1.615  0.250  1.00 93.53 3  A 1 
ATOM 20  C C   . ALA A 1 3  ? -8.889  1.007  -0.710 1.00 94.72 3  A 1 
ATOM 21  O O   . ALA A 1 3  ? -7.941  0.340  -0.296 1.00 93.04 3  A 1 
ATOM 22  C CB  . ALA A 1 3  ? -11.061 0.656  0.459  1.00 91.42 3  A 1 
ATOM 23  N N   . ALA A 1 4  ? -9.096  1.242  -1.992 1.00 95.08 4  A 1 
ATOM 24  C CA  . ALA A 1 4  ? -8.195  0.719  -3.015 1.00 95.37 4  A 1 
ATOM 25  C C   . ALA A 1 4  ? -6.780  1.237  -2.801 1.00 96.04 4  A 1 
ATOM 26  O O   . ALA A 1 4  ? -5.801  0.512  -2.971 1.00 94.33 4  A 1 
ATOM 27  C CB  . ALA A 1 4  ? -8.692  1.119  -4.397 1.00 94.40 4  A 1 
ATOM 28  N N   . LEU A 1 5  ? -6.672  2.502  -2.414 1.00 93.95 5  A 1 
ATOM 29  C CA  . LEU A 1 5  ? -5.371  3.117  -2.175 1.00 94.06 5  A 1 
ATOM 30  C C   . LEU A 1 5  ? -4.687  2.464  -0.982 1.00 95.15 5  A 1 
ATOM 31  O O   . LEU A 1 5  ? -3.478  2.245  -0.990 1.00 94.24 5  A 1 
ATOM 32  C CB  . LEU A 1 5  ? -5.550  4.609  -1.913 1.00 93.55 5  A 1 
ATOM 33  C CG  . LEU A 1 5  ? -6.083  5.365  -3.131 1.00 89.20 5  A 1 
ATOM 34  C CD1 . LEU A 1 5  ? -6.384  6.807  -2.756 1.00 86.71 5  A 1 
ATOM 35  C CD2 . LEU A 1 5  ? -5.082  5.316  -4.271 1.00 85.79 5  A 1 
ATOM 36  N N   . PHE A 1 6  ? -5.477  2.172  0.042  1.00 93.00 6  A 1 
ATOM 37  C CA  . PHE A 1 6  ? -4.945  1.533  1.242  1.00 92.81 6  A 1 
ATOM 38  C C   . PHE A 1 6  ? -4.442  0.137  0.922  1.00 94.34 6  A 1 
ATOM 39  O O   . PHE A 1 6  ? -3.363  -0.262 1.357  1.00 94.01 6  A 1 
ATOM 40  C CB  . PHE A 1 6  ? -6.021  1.456  2.317  1.00 92.71 6  A 1 
ATOM 41  C CG  . PHE A 1 6  ? -6.302  2.808  2.927  1.00 89.89 6  A 1 
ATOM 42  C CD1 . PHE A 1 6  ? -7.267  3.636  2.391  1.00 87.10 6  A 1 
ATOM 43  C CD2 . PHE A 1 6  ? -5.582  3.237  4.029  1.00 87.15 6  A 1 
ATOM 44  C CE1 . PHE A 1 6  ? -7.515  4.884  2.941  1.00 86.41 6  A 1 
ATOM 45  C CE2 . PHE A 1 6  ? -5.826  4.485  4.586  1.00 85.98 6  A 1 
ATOM 46  C CZ  . PHE A 1 6  ? -6.794  5.310  4.043  1.00 85.06 6  A 1 
ATOM 47  N N   . LEU A 1 7  ? -5.230  -0.600 0.156  1.00 95.17 7  A 1 
ATOM 48  C CA  . LEU A 1 7  ? -4.851  -1.956 -0.220 1.00 94.72 7  A 1 
ATOM 49  C C   . LEU A 1 7  ? -3.589  -1.933 -1.069 1.00 95.64 7  A 1 
ATOM 50  O O   . LEU A 1 7  ? -2.680  -2.741 -0.879 1.00 95.35 7  A 1 
ATOM 51  C CB  . LEU A 1 7  ? -5.993  -2.609 -0.999 1.00 94.15 7  A 1 
ATOM 52  C CG  . LEU A 1 7  ? -7.258  -2.799 -0.164 1.00 89.50 7  A 1 
ATOM 53  C CD1 . LEU A 1 7  ? -8.389  -3.312 -1.042 1.00 87.45 7  A 1 
ATOM 54  C CD2 . LEU A 1 7  ? -6.999  -3.755 0.989  1.00 87.29 7  A 1 
ATOM 55  N N   . SER A 1 8  ? -3.538  -1.001 -1.995 1.00 94.61 8  A 1 
ATOM 56  C CA  . SER A 1 8  ? -2.377  -0.860 -2.867 1.00 93.89 8  A 1 
ATOM 57  C C   . SER A 1 8  ? -1.145  -0.486 -2.055 1.00 94.55 8  A 1 
ATOM 58  O O   . SER A 1 8  ? -0.055  -1.015 -2.273 1.00 93.65 8  A 1 
ATOM 59  C CB  . SER A 1 8  ? -2.638  0.208  -3.918 1.00 93.00 8  A 1 
ATOM 60  O OG  . SER A 1 8  ? -1.517  0.338  -4.764 1.00 83.59 8  A 1 
ATOM 61  N N   . ALA A 1 9  ? -1.330  0.423  -1.110 1.00 95.62 9  A 1 
ATOM 62  C CA  . ALA A 1 9  ? -0.233  0.864  -0.257 1.00 95.62 9  A 1 
ATOM 63  C C   . ALA A 1 9  ? 0.278   -0.288 0.597  1.00 96.48 9  A 1 
ATOM 64  O O   . ALA A 1 9  ? 1.480   -0.413 0.831  1.00 95.67 9  A 1 
ATOM 65  C CB  . ALA A 1 9  ? -0.699  2.004  0.638  1.00 95.29 9  A 1 
ATOM 66  N N   . LEU A 1 10 ? -0.641  -1.117 1.060  1.00 95.56 10 A 1 
ATOM 67  C CA  . LEU A 1 10 ? -0.275  -2.263 1.886  1.00 94.81 10 A 1 
ATOM 68  C C   . LEU A 1 10 ? 0.657   -3.192 1.127  1.00 95.61 10 A 1 
ATOM 69  O O   . LEU A 1 10 ? 1.708   -3.592 1.630  1.00 95.07 10 A 1 
ATOM 70  C CB  . LEU A 1 10 ? -1.533  -3.030 2.295  1.00 94.04 10 A 1 
ATOM 71  C CG  . LEU A 1 10 ? -1.236  -4.215 3.211  1.00 87.66 10 A 1 
ATOM 72  C CD1 . LEU A 1 10 ? -0.695  -3.723 4.542  1.00 86.21 10 A 1 
ATOM 73  C CD2 . LEU A 1 10 ? -2.494  -5.043 3.426  1.00 86.59 10 A 1 
ATOM 74  N N   . ALA A 1 11 ? 0.263   -3.544 -0.080 1.00 95.06 11 A 1 
ATOM 75  C CA  . ALA A 1 11 ? 1.072   -4.425 -0.913 1.00 94.99 11 A 1 
ATOM 76  C C   . ALA A 1 11 ? 2.397   -3.764 -1.260 1.00 95.85 11 A 1 
ATOM 77  O O   . ALA A 1 11 ? 3.451   -4.399 -1.232 1.00 94.97 11 A 1 
ATOM 78  C CB  . ALA A 1 11 ? 0.311   -4.774 -2.184 1.00 94.33 11 A 1 
ATOM 79  N N   . SER A 1 12 ? 2.342   -2.486 -1.573 1.00 94.98 12 A 1 
ATOM 80  C CA  . SER A 1 12 ? 3.539   -1.730 -1.926 1.00 94.63 12 A 1 
ATOM 81  C C   . SER A 1 12 ? 4.514   -1.694 -0.761 1.00 95.88 12 A 1 
ATOM 82  O O   . SER A 1 12 ? 5.723   -1.816 -0.942 1.00 94.44 12 A 1 
ATOM 83  C CB  . SER A 1 12 ? 3.173   -0.308 -2.318 1.00 92.72 12 A 1 
ATOM 84  O OG  . SER A 1 12 ? 4.337   0.408  -2.674 1.00 81.49 12 A 1 
ATOM 85  N N   . THR A 1 13 ? 3.980   -1.539 0.441  1.00 94.42 13 A 1 
ATOM 86  C CA  . THR A 1 13 ? 4.809   -1.491 1.642  1.00 94.24 13 A 1 
ATOM 87  C C   . THR A 1 13 ? 5.555   -2.802 1.826  1.00 95.51 13 A 1 
ATOM 88  O O   . THR A 1 13 ? 6.760   -2.812 2.076  1.00 93.62 13 A 1 
ATOM 89  C CB  . THR A 1 13 ? 3.959   -1.232 2.884  1.00 92.54 13 A 1 
ATOM 90  O OG1 . THR A 1 13 ? 3.306   0.030  2.757  1.00 86.84 13 A 1 
ATOM 91  C CG2 . THR A 1 13 ? 4.832   -1.211 4.127  1.00 86.24 13 A 1 
ATOM 92  N N   . ALA A 1 14 ? 4.833   -3.909 1.711  1.00 95.35 14 A 1 
ATOM 93  C CA  . ALA A 1 14 ? 5.437   -5.226 1.871  1.00 95.05 14 A 1 
ATOM 94  C C   . ALA A 1 14 ? 6.537   -5.439 0.843  1.00 95.96 14 A 1 
ATOM 95  O O   . ALA A 1 14 ? 7.618   -5.927 1.167  1.00 94.71 14 A 1 
ATOM 96  C CB  . ALA A 1 14 ? 4.377   -6.308 1.731  1.00 93.67 14 A 1 
ATOM 97  N N   . VAL A 1 15 ? 6.258   -5.072 -0.391 1.00 95.61 15 A 1 
ATOM 98  C CA  . VAL A 1 15 ? 7.235   -5.220 -1.465 1.00 95.67 15 A 1 
ATOM 99  C C   . VAL A 1 15 ? 8.457   -4.358 -1.202 1.00 96.23 15 A 1 
ATOM 100 O O   . VAL A 1 15 ? 9.596   -4.797 -1.378 1.00 94.97 15 A 1 
ATOM 101 C CB  . VAL A 1 15 ? 6.613   -4.841 -2.812 1.00 93.98 15 A 1 
ATOM 102 C CG1 . VAL A 1 15 ? 7.670   -4.874 -3.907 1.00 89.16 15 A 1 
ATOM 103 C CG2 . VAL A 1 15 ? 5.476   -5.791 -3.141 1.00 89.97 15 A 1 
ATOM 104 N N   . GLY A 1 16 ? 8.224   -3.136 -0.781 1.00 93.66 16 A 1 
ATOM 105 C CA  . GLY A 1 16 ? 9.319   -2.215 -0.502 1.00 93.35 16 A 1 
ATOM 106 C C   . GLY A 1 16 ? 10.189  -2.697 0.638  1.00 94.65 16 A 1 
ATOM 107 O O   . GLY A 1 16 ? 11.413  -2.611 0.578  1.00 93.74 16 A 1 
ATOM 108 N N   . VAL A 1 17 ? 9.566   -3.215 1.687  1.00 93.48 17 A 1 
ATOM 109 C CA  . VAL A 1 17 ? 10.303  -3.721 2.844  1.00 93.93 17 A 1 
ATOM 110 C C   . VAL A 1 17 ? 11.159  -4.916 2.457  1.00 95.00 17 A 1 
ATOM 111 O O   . VAL A 1 17 ? 12.320  -5.022 2.861  1.00 93.48 17 A 1 
ATOM 112 C CB  . VAL A 1 17 ? 9.341   -4.126 3.966  1.00 91.56 17 A 1 
ATOM 113 C CG1 . VAL A 1 17 ? 10.106  -4.794 5.101  1.00 86.42 17 A 1 
ATOM 114 C CG2 . VAL A 1 17 ? 8.604   -2.906 4.479  1.00 86.81 17 A 1 
ATOM 115 N N   . VAL A 1 18 ? 10.580  -5.821 1.691  1.00 93.57 18 A 1 
ATOM 116 C CA  . VAL A 1 18 ? 11.304  -7.011 1.246  1.00 93.64 18 A 1 
ATOM 117 C C   . VAL A 1 18 ? 12.463  -6.628 0.344  1.00 94.24 18 A 1 
ATOM 118 O O   . VAL A 1 18 ? 13.553  -7.209 0.420  1.00 92.70 18 A 1 
ATOM 119 C CB  . VAL A 1 18 ? 10.370  -7.971 0.501  1.00 90.87 18 A 1 
ATOM 120 C CG1 . VAL A 1 18 ? 11.157  -9.134 -0.083 1.00 85.28 18 A 1 
ATOM 121 C CG2 . VAL A 1 18 ? 9.295   -8.483 1.446  1.00 86.54 18 A 1 
ATOM 122 N N   . ALA A 1 19 ? 12.224  -5.653 -0.517 1.00 88.55 19 A 1 
ATOM 123 C CA  . ALA A 1 19 ? 13.239  -5.212 -1.464 1.00 86.31 19 A 1 
ATOM 124 C C   . ALA A 1 19 ? 14.363  -4.456 -0.757 1.00 83.72 19 A 1 
ATOM 125 O O   . ALA A 1 19 ? 14.109  -3.839 0.288  1.00 79.29 19 A 1 
ATOM 126 C CB  . ALA A 1 19 ? 12.606  -4.338 -2.539 1.00 80.60 19 A 1 
ATOM 127 O OXT . ALA A 1 19 ? 15.492  -4.464 -1.261 1.00 73.35 19 A 1 
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