# 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_spkb14044 # _entry.id spkb14044 # 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 "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" "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" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[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 SER 2 1 n LEU 3 1 n PHE 4 1 n PHE 5 1 n LEU 6 1 n TRP 7 1 n LEU 8 1 n VAL 9 1 n SER 10 1 n TYR 11 1 n TYR 12 1 n VAL 13 1 n GLY 14 1 n THR 15 1 n LEU 16 1 n GLY 17 # _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 @ 2025-07-05 08:12:32)" _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 92.11 _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 75.25 1 1 A SER 2 2 84.62 1 2 A LEU 3 2 92.55 1 3 A PHE 4 2 94.44 1 4 A PHE 5 2 93.33 1 5 A LEU 6 2 94.37 1 6 A TRP 7 2 94.38 1 7 A LEU 8 2 94.95 1 8 A VAL 9 2 96.10 1 9 A SER 10 2 95.81 1 10 A TYR 11 2 94.02 1 11 A TYR 12 2 94.08 1 12 A VAL 13 2 95.94 1 13 A GLY 14 2 96.19 1 14 A THR 15 2 92.37 1 15 A LEU 16 2 89.82 1 16 A GLY 17 2 80.39 1 17 # _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 SER . 2 A 2 A 3 1 n LEU . 3 A 3 A 4 1 n PHE . 4 A 4 A 5 1 n PHE . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n TRP . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n SER . 10 A 10 A 11 1 n TYR . 11 A 11 A 12 1 n TYR . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n GLY . 14 A 14 A 15 1 n THR . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n GLY . 17 A 17 # _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 ? 1.374 6.145 10.971 1.00 82.14 1 A 1 ATOM 2 C CA . MET A 1 1 ? 0.888 5.447 9.770 1.00 83.80 1 A 1 ATOM 3 C C . MET A 1 1 ? -0.430 4.737 10.045 1.00 84.12 1 A 1 ATOM 4 O O . MET A 1 1 ? -0.672 4.284 11.160 1.00 79.46 1 A 1 ATOM 5 C CB . MET A 1 1 ? 1.906 4.409 9.296 1.00 75.78 1 A 1 ATOM 6 C CG . MET A 1 1 ? 3.274 4.997 9.030 1.00 70.26 1 A 1 ATOM 7 S SD . MET A 1 1 ? 4.452 3.739 8.515 1.00 67.24 1 A 1 ATOM 8 C CE . MET A 1 1 ? 5.967 4.682 8.573 1.00 59.24 1 A 1 ATOM 9 N N . SER A 1 2 ? -1.257 4.637 9.031 1.00 84.73 2 A 1 ATOM 10 C CA . SER A 1 2 ? -2.546 3.975 9.156 1.00 89.47 2 A 1 ATOM 11 C C . SER A 1 2 ? -2.464 2.547 8.620 1.00 91.42 2 A 1 ATOM 12 O O . SER A 1 2 ? -1.607 2.233 7.792 1.00 87.30 2 A 1 ATOM 13 C CB . SER A 1 2 ? -3.616 4.753 8.398 1.00 82.75 2 A 1 ATOM 14 O OG . SER A 1 2 ? -4.890 4.198 8.620 1.00 72.08 2 A 1 ATOM 15 N N . LEU A 1 3 ? -3.364 1.702 9.090 1.00 94.77 3 A 1 ATOM 16 C CA . LEU A 1 3 ? -3.399 0.312 8.644 1.00 95.68 3 A 1 ATOM 17 C C . LEU A 1 3 ? -3.747 0.235 7.159 1.00 96.60 3 A 1 ATOM 18 O O . LEU A 1 3 ? -3.192 -0.579 6.420 1.00 95.71 3 A 1 ATOM 19 C CB . LEU A 1 3 ? -4.430 -0.470 9.464 1.00 94.18 3 A 1 ATOM 20 C CG . LEU A 1 3 ? -4.266 -1.980 9.362 1.00 90.70 3 A 1 ATOM 21 C CD1 . LEU A 1 3 ? -3.032 -2.432 10.141 1.00 87.29 3 A 1 ATOM 22 C CD2 . LEU A 1 3 ? -5.502 -2.687 9.887 1.00 85.46 3 A 1 ATOM 23 N N . PHE A 1 4 ? -4.653 1.093 6.734 1.00 96.12 4 A 1 ATOM 24 C CA . PHE A 1 4 ? -5.069 1.155 5.336 1.00 96.56 4 A 1 ATOM 25 C C . PHE A 1 4 ? -3.901 1.535 4.434 1.00 97.26 4 A 1 ATOM 26 O O . PHE A 1 4 ? -3.776 1.036 3.316 1.00 96.94 4 A 1 ATOM 27 C CB . PHE A 1 4 ? -6.192 2.178 5.180 1.00 96.04 4 A 1 ATOM 28 C CG . PHE A 1 4 ? -6.748 2.216 3.784 1.00 95.21 4 A 1 ATOM 29 C CD1 . PHE A 1 4 ? -7.640 1.246 3.359 1.00 92.81 4 A 1 ATOM 30 C CD2 . PHE A 1 4 ? -6.371 3.214 2.908 1.00 92.62 4 A 1 ATOM 31 C CE1 . PHE A 1 4 ? -8.151 1.269 2.075 1.00 91.67 4 A 1 ATOM 32 C CE2 . PHE A 1 4 ? -6.877 3.242 1.616 1.00 91.53 4 A 1 ATOM 33 C CZ . PHE A 1 4 ? -7.767 2.268 1.202 1.00 92.11 4 A 1 ATOM 34 N N . PHE A 1 5 ? -3.048 2.419 4.925 1.00 96.22 5 A 1 ATOM 35 C CA . PHE A 1 5 ? -1.873 2.863 4.177 1.00 96.43 5 A 1 ATOM 36 C C . PHE A 1 5 ? -0.942 1.689 3.891 1.00 96.96 5 A 1 ATOM 37 O O . PHE A 1 5 ? -0.406 1.562 2.791 1.00 96.60 5 A 1 ATOM 38 C CB . PHE A 1 5 ? -1.136 3.936 4.976 1.00 95.97 5 A 1 ATOM 39 C CG . PHE A 1 5 ? 0.039 4.513 4.236 1.00 93.98 5 A 1 ATOM 40 C CD1 . PHE A 1 5 ? 1.298 3.956 4.366 1.00 91.00 5 A 1 ATOM 41 C CD2 . PHE A 1 5 ? -0.132 5.610 3.407 1.00 90.80 5 A 1 ATOM 42 C CE1 . PHE A 1 5 ? 2.382 4.480 3.675 1.00 89.68 5 A 1 ATOM 43 C CE2 . PHE A 1 5 ? 0.947 6.140 2.713 1.00 89.17 5 A 1 ATOM 44 C CZ . PHE A 1 5 ? 2.202 5.572 2.847 1.00 89.81 5 A 1 ATOM 45 N N . LEU A 1 6 ? -0.754 0.843 4.881 1.00 96.92 6 A 1 ATOM 46 C CA . LEU A 1 6 ? 0.116 -0.321 4.743 1.00 96.88 6 A 1 ATOM 47 C C . LEU A 1 6 ? -0.420 -1.272 3.679 1.00 97.22 6 A 1 ATOM 48 O O . LEU A 1 6 ? 0.327 -1.774 2.840 1.00 96.99 6 A 1 ATOM 49 C CB . LEU A 1 6 ? 0.231 -1.051 6.087 1.00 96.52 6 A 1 ATOM 50 C CG . LEU A 1 6 ? 1.651 -1.466 6.476 1.00 92.00 6 A 1 ATOM 51 C CD1 . LEU A 1 6 ? 2.270 -2.367 5.426 1.00 89.27 6 A 1 ATOM 52 C CD2 . LEU A 1 6 ? 2.507 -0.229 6.690 1.00 89.16 6 A 1 ATOM 53 N N . TRP A 1 7 ? -1.709 -1.523 3.728 1.00 96.19 7 A 1 ATOM 54 C CA . TRP A 1 7 ? -2.354 -2.418 2.775 1.00 96.46 7 A 1 ATOM 55 C C . TRP A 1 7 ? -2.269 -1.866 1.348 1.00 96.87 7 A 1 ATOM 56 O O . TRP A 1 7 ? -2.050 -2.608 0.395 1.00 96.28 7 A 1 ATOM 57 C CB . TRP A 1 7 ? -3.811 -2.641 3.200 1.00 96.44 7 A 1 ATOM 58 C CG . TRP A 1 7 ? -4.813 -2.388 2.120 1.00 95.91 7 A 1 ATOM 59 C CD1 . TRP A 1 7 ? -5.704 -1.365 2.057 1.00 93.58 7 A 1 ATOM 60 C CD2 . TRP A 1 7 ? -5.021 -3.165 0.938 1.00 94.71 7 A 1 ATOM 61 N NE1 . TRP A 1 7 ? -6.449 -1.458 0.907 1.00 92.29 7 A 1 ATOM 62 C CE2 . TRP A 1 7 ? -6.055 -2.557 0.191 1.00 94.02 7 A 1 ATOM 63 C CE3 . TRP A 1 7 ? -4.427 -4.324 0.422 1.00 93.41 7 A 1 ATOM 64 C CZ2 . TRP A 1 7 ? -6.501 -3.070 -1.023 1.00 93.63 7 A 1 ATOM 65 C CZ3 . TRP A 1 7 ? -4.875 -4.838 -0.784 1.00 90.65 7 A 1 ATOM 66 C CH2 . TRP A 1 7 ? -5.903 -4.212 -1.499 1.00 90.92 7 A 1 ATOM 67 N N . LEU A 1 8 ? -2.437 -0.564 1.214 1.00 96.73 8 A 1 ATOM 68 C CA . LEU A 1 8 ? -2.391 0.080 -0.096 1.00 96.85 8 A 1 ATOM 69 C C . LEU A 1 8 ? -0.999 -0.031 -0.707 1.00 96.96 8 A 1 ATOM 70 O O . LEU A 1 8 ? -0.842 -0.390 -1.874 1.00 96.69 8 A 1 ATOM 71 C CB . LEU A 1 8 ? -2.805 1.551 0.040 1.00 96.75 8 A 1 ATOM 72 C CG . LEU A 1 8 ? -3.597 2.091 -1.148 1.00 93.50 8 A 1 ATOM 73 C CD1 . LEU A 1 8 ? -4.254 3.418 -0.800 1.00 90.76 8 A 1 ATOM 74 C CD2 . LEU A 1 8 ? -2.716 2.259 -2.371 1.00 91.40 8 A 1 ATOM 75 N N . VAL A 1 9 ? 0.018 0.285 0.074 1.00 97.07 9 A 1 ATOM 76 C CA . VAL A 1 9 ? 1.404 0.219 -0.390 1.00 96.77 9 A 1 ATOM 77 C C . VAL A 1 9 ? 1.787 -1.212 -0.747 1.00 96.96 9 A 1 ATOM 78 O O . VAL A 1 9 ? 2.466 -1.456 -1.745 1.00 96.63 9 A 1 ATOM 79 C CB . VAL A 1 9 ? 2.366 0.764 0.682 1.00 96.20 9 A 1 ATOM 80 C CG1 . VAL A 1 9 ? 3.816 0.572 0.256 1.00 94.61 9 A 1 ATOM 81 C CG2 . VAL A 1 9 ? 2.092 2.236 0.940 1.00 94.46 9 A 1 ATOM 82 N N . SER A 1 10 ? 1.358 -2.142 0.059 1.00 96.91 10 A 1 ATOM 83 C CA . SER A 1 10 ? 1.662 -3.549 -0.171 1.00 96.95 10 A 1 ATOM 84 C C . SER A 1 10 ? 1.102 -4.015 -1.510 1.00 97.14 10 A 1 ATOM 85 O O . SER A 1 10 ? 1.759 -4.751 -2.248 1.00 96.43 10 A 1 ATOM 86 C CB . SER A 1 10 ? 1.084 -4.399 0.956 1.00 96.25 10 A 1 ATOM 87 O OG . SER A 1 10 ? 1.597 -5.703 0.896 1.00 91.20 10 A 1 ATOM 88 N N . TYR A 1 11 ? -0.102 -3.585 -1.821 1.00 97.02 11 A 1 ATOM 89 C CA . TYR A 1 11 ? -0.742 -3.934 -3.085 1.00 96.86 11 A 1 ATOM 90 C C . TYR A 1 11 ? -0.018 -3.283 -4.259 1.00 97.00 11 A 1 ATOM 91 O O . TYR A 1 11 ? 0.174 -3.905 -5.306 1.00 96.11 11 A 1 ATOM 92 C CB . TYR A 1 11 ? -2.201 -3.488 -3.064 1.00 96.35 11 A 1 ATOM 93 C CG . TYR A 1 11 ? -2.938 -3.847 -4.332 1.00 95.07 11 A 1 ATOM 94 C CD1 . TYR A 1 11 ? -3.411 -5.139 -4.536 1.00 91.11 11 A 1 ATOM 95 C CD2 . TYR A 1 11 ? -3.149 -2.901 -5.318 1.00 91.98 11 A 1 ATOM 96 C CE1 . TYR A 1 11 ? -4.082 -5.475 -5.696 1.00 91.21 11 A 1 ATOM 97 C CE2 . TYR A 1 11 ? -3.816 -3.234 -6.487 1.00 91.73 11 A 1 ATOM 98 C CZ . TYR A 1 11 ? -4.281 -4.520 -6.666 1.00 92.58 11 A 1 ATOM 99 O OH . TYR A 1 11 ? -4.943 -4.850 -7.823 1.00 91.27 11 A 1 ATOM 100 N N . TYR A 1 12 ? 0.385 -2.041 -4.079 1.00 97.01 12 A 1 ATOM 101 C CA . TYR A 1 12 ? 1.081 -1.289 -5.120 1.00 96.97 12 A 1 ATOM 102 C C . TYR A 1 12 ? 2.393 -1.969 -5.497 1.00 97.11 12 A 1 ATOM 103 O O . TYR A 1 12 ? 2.709 -2.133 -6.677 1.00 96.29 12 A 1 ATOM 104 C CB . TYR A 1 12 ? 1.351 0.136 -4.634 1.00 96.63 12 A 1 ATOM 105 C CG . TYR A 1 12 ? 1.562 1.118 -5.768 1.00 94.98 12 A 1 ATOM 106 C CD1 . TYR A 1 12 ? 0.484 1.592 -6.501 1.00 91.32 12 A 1 ATOM 107 C CD2 . TYR A 1 12 ? 2.835 1.565 -6.090 1.00 92.07 12 A 1 ATOM 108 C CE1 . TYR A 1 12 ? 0.671 2.490 -7.539 1.00 91.33 12 A 1 ATOM 109 C CE2 . TYR A 1 12 ? 3.030 2.462 -7.131 1.00 91.97 12 A 1 ATOM 110 C CZ . TYR A 1 12 ? 1.943 2.922 -7.850 1.00 92.33 12 A 1 ATOM 111 O OH . TYR A 1 12 ? 2.129 3.813 -8.879 1.00 90.94 12 A 1 ATOM 112 N N . VAL A 1 13 ? 3.161 -2.355 -4.507 1.00 97.37 13 A 1 ATOM 113 C CA . VAL A 1 13 ? 4.439 -3.027 -4.736 1.00 97.15 13 A 1 ATOM 114 C C . VAL A 1 13 ? 4.227 -4.411 -5.333 1.00 97.21 13 A 1 ATOM 115 O O . VAL A 1 13 ? 5.002 -4.860 -6.181 1.00 96.16 13 A 1 ATOM 116 C CB . VAL A 1 13 ? 5.240 -3.141 -3.429 1.00 96.20 13 A 1 ATOM 117 C CG1 . VAL A 1 13 ? 6.544 -3.889 -3.662 1.00 93.71 13 A 1 ATOM 118 C CG2 . VAL A 1 13 ? 5.520 -1.763 -2.860 1.00 93.79 13 A 1 ATOM 119 N N . GLY A 1 14 ? 3.196 -5.078 -4.894 1.00 96.68 14 A 1 ATOM 120 C CA . GLY A 1 14 ? 2.894 -6.414 -5.384 1.00 96.28 14 A 1 ATOM 121 C C . GLY A 1 14 ? 2.523 -6.432 -6.851 1.00 96.73 14 A 1 ATOM 122 O O . GLY A 1 14 ? 2.859 -7.372 -7.574 1.00 95.05 14 A 1 ATOM 123 N N . THR A 1 15 ? 1.834 -5.399 -7.308 1.00 96.17 15 A 1 ATOM 124 C CA . THR A 1 15 ? 1.412 -5.315 -8.703 1.00 95.86 15 A 1 ATOM 125 C C . THR A 1 15 ? 2.575 -4.987 -9.626 1.00 95.81 15 A 1 ATOM 126 O O . THR A 1 15 ? 2.748 -5.626 -10.663 1.00 92.37 15 A 1 ATOM 127 C CB . THR A 1 15 ? 0.319 -4.254 -8.887 1.00 93.61 15 A 1 ATOM 128 O OG1 . THR A 1 15 ? 0.752 -3.009 -8.358 1.00 87.07 15 A 1 ATOM 129 C CG2 . THR A 1 15 ? -0.961 -4.680 -8.216 1.00 85.68 15 A 1 ATOM 130 N N . LEU A 1 16 ? 3.371 -3.990 -9.241 1.00 94.57 16 A 1 ATOM 131 C CA . LEU A 1 16 ? 4.502 -3.558 -10.054 1.00 93.68 16 A 1 ATOM 132 C C . LEU A 1 16 ? 5.687 -4.505 -9.939 1.00 93.07 16 A 1 ATOM 133 O O . LEU A 1 16 ? 6.197 -4.999 -10.947 1.00 90.12 16 A 1 ATOM 134 C CB . LEU A 1 16 ? 4.933 -2.146 -9.637 1.00 92.03 16 A 1 ATOM 135 C CG . LEU A 1 16 ? 3.869 -1.072 -9.809 1.00 89.29 16 A 1 ATOM 136 C CD1 . LEU A 1 16 ? 4.365 0.251 -9.244 1.00 84.68 16 A 1 ATOM 137 C CD2 . LEU A 1 16 ? 3.505 -0.908 -11.275 1.00 81.10 16 A 1 ATOM 138 N N . GLY A 1 17 ? 6.145 -4.711 -8.718 1.00 88.40 17 A 1 ATOM 139 C CA . GLY A 1 17 ? 7.296 -5.578 -8.444 1.00 83.54 17 A 1 ATOM 140 C C . GLY A 1 17 ? 6.873 -6.950 -8.008 1.00 79.57 17 A 1 ATOM 141 O O . GLY A 1 17 ? 7.592 -7.927 -8.329 1.00 73.81 17 A 1 ATOM 142 O OXT . GLY A 1 17 ? 5.870 -7.042 -7.299 1.00 76.63 17 A 1 #