# 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_spkb30391 # _entry.id spkb30391 # 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" "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" "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" # _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 PHE 2 1 n ALA 3 1 n LEU 4 1 n LYS 5 1 n PHE 6 1 n ILE 7 1 n LEU 8 1 n ILE 9 1 n THR 10 1 n SER 11 1 n PHE 12 1 n ILE 13 1 n ALA 14 1 n SER 15 1 n THR 16 1 n ALA 17 1 n LEU 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 @ 2025-07-12 18:00:46)" _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 95.17 _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 88.03 1 1 A PHE 2 2 92.37 1 2 A ALA 3 2 98.07 1 3 A LEU 4 2 96.33 1 4 A LYS 5 2 94.14 1 5 A PHE 6 2 95.51 1 6 A ILE 7 2 97.41 1 7 A LEU 8 2 96.43 1 8 A ILE 9 2 96.80 1 9 A THR 10 2 96.87 1 10 A SER 11 2 97.07 1 11 A PHE 12 2 95.79 1 12 A ILE 13 2 97.44 1 13 A ALA 14 2 98.23 1 14 A SER 15 2 96.38 1 15 A THR 16 2 96.77 1 16 A ALA 17 2 97.40 1 17 A LEU 18 2 92.61 1 18 A ALA 19 2 87.86 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 PHE . 2 A 2 A 3 1 n ALA . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n LYS . 5 A 5 A 6 1 n PHE . 6 A 6 A 7 1 n ILE . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n ILE . 9 A 9 A 10 1 n THR . 10 A 10 A 11 1 n SER . 11 A 11 A 12 1 n PHE . 12 A 12 A 13 1 n ILE . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n THR . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n LEU . 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 ? -13.513 -5.444 -3.756 1.00 92.27 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.722 -5.352 -2.514 1.00 94.16 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.882 -4.079 -2.479 1.00 94.38 1 A 1 ATOM 4 O O . MET A 1 1 ? -10.880 -3.970 -3.184 1.00 92.04 1 A 1 ATOM 5 C CB . MET A 1 1 ? -11.790 -6.554 -2.378 1.00 89.69 1 A 1 ATOM 6 C CG . MET A 1 1 ? -12.528 -7.821 -1.984 1.00 84.34 1 A 1 ATOM 7 S SD . MET A 1 1 ? -13.094 -7.730 -0.297 1.00 82.24 1 A 1 ATOM 8 C CE . MET A 1 1 ? -13.889 -9.324 -0.134 1.00 75.10 1 A 1 ATOM 9 N N . PHE A 1 2 ? -12.306 -3.129 -1.652 1.00 93.71 2 A 1 ATOM 10 C CA . PHE A 1 2 ? -11.592 -1.867 -1.508 1.00 96.24 2 A 1 ATOM 11 C C . PHE A 1 2 ? -10.487 -1.981 -0.458 1.00 97.55 2 A 1 ATOM 12 O O . PHE A 1 2 ? -9.487 -1.273 -0.517 1.00 97.07 2 A 1 ATOM 13 C CB . PHE A 1 2 ? -12.575 -0.768 -1.107 1.00 94.58 2 A 1 ATOM 14 C CG . PHE A 1 2 ? -11.900 0.557 -0.898 1.00 91.89 2 A 1 ATOM 15 C CD1 . PHE A 1 2 ? -11.480 1.309 -1.981 1.00 90.47 2 A 1 ATOM 16 C CD2 . PHE A 1 2 ? -11.681 1.033 0.375 1.00 89.92 2 A 1 ATOM 17 C CE1 . PHE A 1 2 ? -10.848 2.526 -1.804 1.00 88.70 2 A 1 ATOM 18 C CE2 . PHE A 1 2 ? -11.044 2.254 0.569 1.00 88.18 2 A 1 ATOM 19 C CZ . PHE A 1 2 ? -10.631 3.000 -0.524 1.00 87.72 2 A 1 ATOM 20 N N . ALA A 1 3 ? -10.675 -2.881 0.495 1.00 97.67 3 A 1 ATOM 21 C CA . ALA A 1 3 ? -9.699 -3.089 1.560 1.00 98.24 3 A 1 ATOM 22 C C . ALA A 1 3 ? -8.338 -3.487 1.001 1.00 98.48 3 A 1 ATOM 23 O O . ALA A 1 3 ? -7.301 -3.021 1.471 1.00 98.14 3 A 1 ATOM 24 C CB . ALA A 1 3 ? -10.203 -4.153 2.525 1.00 97.82 3 A 1 ATOM 25 N N . LEU A 1 4 ? -8.341 -4.339 0.001 1.00 98.16 4 A 1 ATOM 26 C CA . LEU A 1 4 ? -7.107 -4.787 -0.633 1.00 98.22 4 A 1 ATOM 27 C C . LEU A 1 4 ? -6.476 -3.671 -1.452 1.00 98.36 4 A 1 ATOM 28 O O . LEU A 1 4 ? -5.253 -3.517 -1.470 1.00 98.05 4 A 1 ATOM 29 C CB . LEU A 1 4 ? -7.387 -5.999 -1.527 1.00 97.97 4 A 1 ATOM 30 C CG . LEU A 1 4 ? -6.148 -6.575 -2.209 1.00 95.21 4 A 1 ATOM 31 C CD1 . LEU A 1 4 ? -5.163 -7.104 -1.177 1.00 92.46 4 A 1 ATOM 32 C CD2 . LEU A 1 4 ? -6.542 -7.680 -3.175 1.00 92.22 4 A 1 ATOM 33 N N . LYS A 1 5 ? -7.314 -2.885 -2.124 1.00 98.19 5 A 1 ATOM 34 C CA . LYS A 1 5 ? -6.842 -1.772 -2.942 1.00 98.21 5 A 1 ATOM 35 C C . LYS A 1 5 ? -6.210 -0.697 -2.076 1.00 98.26 5 A 1 ATOM 36 O O . LYS A 1 5 ? -5.178 -0.134 -2.428 1.00 98.17 5 A 1 ATOM 37 C CB . LYS A 1 5 ? -8.010 -1.196 -3.736 1.00 97.84 5 A 1 ATOM 38 C CG . LYS A 1 5 ? -7.590 -0.124 -4.725 1.00 94.27 5 A 1 ATOM 39 C CD . LYS A 1 5 ? -6.807 -0.720 -5.878 1.00 91.69 5 A 1 ATOM 40 C CE . LYS A 1 5 ? -6.504 0.332 -6.932 1.00 88.11 5 A 1 ATOM 41 N NZ . LYS A 1 5 ? -5.780 -0.257 -8.090 1.00 82.51 5 A 1 ATOM 42 N N . PHE A 1 6 ? -6.829 -0.418 -0.945 1.00 97.34 6 A 1 ATOM 43 C CA . PHE A 1 6 ? -6.349 0.600 -0.020 1.00 97.55 6 A 1 ATOM 44 C C . PHE A 1 6 ? -4.988 0.231 0.557 1.00 97.99 6 A 1 ATOM 45 O O . PHE A 1 6 ? -4.064 1.041 0.557 1.00 97.68 6 A 1 ATOM 46 C CB . PHE A 1 6 ? -7.359 0.792 1.110 1.00 97.14 6 A 1 ATOM 47 C CG . PHE A 1 6 ? -6.924 1.822 2.118 1.00 96.00 6 A 1 ATOM 48 C CD1 . PHE A 1 6 ? -6.983 3.168 1.814 1.00 93.64 6 A 1 ATOM 49 C CD2 . PHE A 1 6 ? -6.453 1.431 3.356 1.00 94.22 6 A 1 ATOM 50 C CE1 . PHE A 1 6 ? -6.577 4.121 2.728 1.00 92.67 6 A 1 ATOM 51 C CE2 . PHE A 1 6 ? -6.038 2.384 4.279 1.00 93.04 6 A 1 ATOM 52 C CZ . PHE A 1 6 ? -6.103 3.728 3.965 1.00 93.31 6 A 1 ATOM 53 N N . ILE A 1 7 ? -4.869 -0.979 1.046 1.00 98.26 7 A 1 ATOM 54 C CA . ILE A 1 7 ? -3.622 -1.452 1.633 1.00 98.22 7 A 1 ATOM 55 C C . ILE A 1 7 ? -2.522 -1.558 0.579 1.00 98.32 7 A 1 ATOM 56 O O . ILE A 1 7 ? -1.339 -1.352 0.878 1.00 98.05 7 A 1 ATOM 57 C CB . ILE A 1 7 ? -3.818 -2.809 2.340 1.00 98.17 7 A 1 ATOM 58 C CG1 . ILE A 1 7 ? -2.515 -3.260 2.999 1.00 97.13 7 A 1 ATOM 59 C CG2 . ILE A 1 7 ? -4.313 -3.861 1.367 1.00 96.74 7 A 1 ATOM 60 C CD1 . ILE A 1 7 ? -2.656 -4.497 3.845 1.00 94.40 7 A 1 ATOM 61 N N . LEU A 1 8 ? -2.903 -1.847 -0.635 1.00 98.20 8 A 1 ATOM 62 C CA . LEU A 1 8 ? -1.950 -1.975 -1.733 1.00 98.12 8 A 1 ATOM 63 C C . LEU A 1 8 ? -1.304 -0.636 -2.061 1.00 98.26 8 A 1 ATOM 64 O O . LEU A 1 8 ? -0.082 -0.542 -2.184 1.00 98.20 8 A 1 ATOM 65 C CB . LEU A 1 8 ? -2.654 -2.531 -2.971 1.00 98.00 8 A 1 ATOM 66 C CG . LEU A 1 8 ? -1.723 -2.793 -4.152 1.00 94.45 8 A 1 ATOM 67 C CD1 . LEU A 1 8 ? -0.767 -3.935 -3.838 1.00 92.57 8 A 1 ATOM 68 C CD2 . LEU A 1 8 ? -2.525 -3.111 -5.402 1.00 93.61 8 A 1 ATOM 69 N N . ILE A 1 9 ? -2.118 0.395 -2.203 1.00 98.15 9 A 1 ATOM 70 C CA . ILE A 1 9 ? -1.627 1.735 -2.526 1.00 97.98 9 A 1 ATOM 71 C C . ILE A 1 9 ? -0.786 2.295 -1.389 1.00 98.14 9 A 1 ATOM 72 O O . ILE A 1 9 ? 0.278 2.870 -1.608 1.00 97.95 9 A 1 ATOM 73 C CB . ILE A 1 9 ? -2.799 2.682 -2.826 1.00 97.72 9 A 1 ATOM 74 C CG1 . ILE A 1 9 ? -3.626 2.160 -4.007 1.00 96.10 9 A 1 ATOM 75 C CG2 . ILE A 1 9 ? -2.277 4.086 -3.121 1.00 96.28 9 A 1 ATOM 76 C CD1 . ILE A 1 9 ? -2.829 2.039 -5.295 1.00 92.04 9 A 1 ATOM 77 N N . THR A 1 10 ? -1.273 2.138 -0.187 1.00 98.20 10 A 1 ATOM 78 C CA . THR A 1 10 ? -0.577 2.644 0.992 1.00 98.04 10 A 1 ATOM 79 C C . THR A 1 10 ? 0.773 1.953 1.171 1.00 98.14 10 A 1 ATOM 80 O O . THR A 1 10 ? 1.782 2.601 1.449 1.00 97.62 10 A 1 ATOM 81 C CB . THR A 1 10 ? -1.426 2.433 2.254 1.00 97.60 10 A 1 ATOM 82 O OG1 . THR A 1 10 ? -2.707 3.033 2.081 1.00 94.86 10 A 1 ATOM 83 C CG2 . THR A 1 10 ? -0.753 3.059 3.465 1.00 93.64 10 A 1 ATOM 84 N N . SER A 1 11 ? 0.795 0.658 1.006 1.00 98.09 11 A 1 ATOM 85 C CA . SER A 1 11 ? 2.016 -0.124 1.159 1.00 98.03 11 A 1 ATOM 86 C C . SER A 1 11 ? 3.021 0.194 0.058 1.00 98.22 11 A 1 ATOM 87 O O . SER A 1 11 ? 4.223 0.265 0.306 1.00 97.67 11 A 1 ATOM 88 C CB . SER A 1 11 ? 1.693 -1.615 1.139 1.00 97.59 11 A 1 ATOM 89 O OG . SER A 1 11 ? 2.858 -2.375 1.348 1.00 92.81 11 A 1 ATOM 90 N N . PHE A 1 12 ? 2.540 0.397 -1.148 1.00 98.18 12 A 1 ATOM 91 C CA . PHE A 1 12 ? 3.395 0.701 -2.291 1.00 98.19 12 A 1 ATOM 92 C C . PHE A 1 12 ? 4.119 2.026 -2.104 1.00 98.38 12 A 1 ATOM 93 O O . PHE A 1 12 ? 5.336 2.112 -2.286 1.00 98.12 12 A 1 ATOM 94 C CB . PHE A 1 12 ? 2.559 0.741 -3.568 1.00 97.91 12 A 1 ATOM 95 C CG . PHE A 1 12 ? 3.393 0.937 -4.808 1.00 96.35 12 A 1 ATOM 96 C CD1 . PHE A 1 12 ? 4.112 -0.114 -5.345 1.00 93.66 12 A 1 ATOM 97 C CD2 . PHE A 1 12 ? 3.452 2.172 -5.420 1.00 94.35 12 A 1 ATOM 98 C CE1 . PHE A 1 12 ? 4.886 0.056 -6.481 1.00 92.55 12 A 1 ATOM 99 C CE2 . PHE A 1 12 ? 4.231 2.356 -6.560 1.00 92.96 12 A 1 ATOM 100 C CZ . PHE A 1 12 ? 4.945 1.297 -7.087 1.00 93.04 12 A 1 ATOM 101 N N . ILE A 1 13 ? 3.377 3.052 -1.749 1.00 98.49 13 A 1 ATOM 102 C CA . ILE A 1 13 ? 3.948 4.380 -1.547 1.00 98.37 13 A 1 ATOM 103 C C . ILE A 1 13 ? 4.830 4.416 -0.307 1.00 98.44 13 A 1 ATOM 104 O O . ILE A 1 13 ? 5.909 5.007 -0.313 1.00 98.26 13 A 1 ATOM 105 C CB . ILE A 1 13 ? 2.838 5.438 -1.427 1.00 98.05 13 A 1 ATOM 106 C CG1 . ILE A 1 13 ? 2.004 5.479 -2.707 1.00 96.86 13 A 1 ATOM 107 C CG2 . ILE A 1 13 ? 3.444 6.811 -1.150 1.00 96.81 13 A 1 ATOM 108 C CD1 . ILE A 1 13 ? 0.780 6.351 -2.606 1.00 94.28 13 A 1 ATOM 109 N N . ALA A 1 14 ? 4.364 3.796 0.759 1.00 98.51 14 A 1 ATOM 110 C CA . ALA A 1 14 ? 5.103 3.771 2.017 1.00 98.35 14 A 1 ATOM 111 C C . ALA A 1 14 ? 6.430 3.033 1.878 1.00 98.41 14 A 1 ATOM 112 O O . ALA A 1 14 ? 7.412 3.378 2.531 1.00 97.93 14 A 1 ATOM 113 C CB . ALA A 1 14 ? 4.254 3.120 3.100 1.00 97.93 14 A 1 ATOM 114 N N . SER A 1 15 ? 6.470 2.029 1.035 1.00 98.31 15 A 1 ATOM 115 C CA . SER A 1 15 ? 7.680 1.239 0.832 1.00 98.15 15 A 1 ATOM 116 C C . SER A 1 15 ? 8.669 1.943 -0.088 1.00 98.24 15 A 1 ATOM 117 O O . SER A 1 15 ? 9.872 1.952 0.165 1.00 97.31 15 A 1 ATOM 118 C CB . SER A 1 15 ? 7.326 -0.125 0.251 1.00 97.37 15 A 1 ATOM 119 O OG . SER A 1 15 ? 6.531 -0.858 1.153 1.00 88.90 15 A 1 ATOM 120 N N . THR A 1 16 ? 8.160 2.542 -1.150 1.00 98.28 16 A 1 ATOM 121 C CA . THR A 1 16 ? 9.000 3.227 -2.129 1.00 98.09 16 A 1 ATOM 122 C C . THR A 1 16 ? 9.468 4.588 -1.637 1.00 98.19 16 A 1 ATOM 123 O O . THR A 1 16 ? 10.652 4.916 -1.724 1.00 97.45 16 A 1 ATOM 124 C CB . THR A 1 16 ? 8.246 3.408 -3.452 1.00 97.32 16 A 1 ATOM 125 O OG1 . THR A 1 16 ? 7.773 2.142 -3.914 1.00 94.46 16 A 1 ATOM 126 C CG2 . THR A 1 16 ? 9.152 4.012 -4.506 1.00 93.63 16 A 1 ATOM 127 N N . ALA A 1 17 ? 8.543 5.393 -1.141 1.00 97.84 17 A 1 ATOM 128 C CA . ALA A 1 17 ? 8.851 6.744 -0.680 1.00 97.63 17 A 1 ATOM 129 C C . ALA A 1 17 ? 9.618 6.750 0.638 1.00 97.83 17 A 1 ATOM 130 O O . ALA A 1 17 ? 10.389 7.668 0.911 1.00 96.92 17 A 1 ATOM 131 C CB . ALA A 1 17 ? 7.565 7.550 -0.533 1.00 96.76 17 A 1 ATOM 132 N N . LEU A 1 18 ? 9.403 5.742 1.447 1.00 96.84 18 A 1 ATOM 133 C CA . LEU A 1 18 ? 10.057 5.654 2.752 1.00 96.41 18 A 1 ATOM 134 C C . LEU A 1 18 ? 11.526 5.274 2.614 1.00 96.52 18 A 1 ATOM 135 O O . LEU A 1 18 ? 12.412 5.963 3.127 1.00 95.25 18 A 1 ATOM 136 C CB . LEU A 1 18 ? 9.333 4.640 3.633 1.00 94.95 18 A 1 ATOM 137 C CG . LEU A 1 18 ? 9.753 4.656 5.097 1.00 90.73 18 A 1 ATOM 138 C CD1 . LEU A 1 18 ? 9.269 5.925 5.772 1.00 85.99 18 A 1 ATOM 139 C CD2 . LEU A 1 18 ? 9.200 3.435 5.820 1.00 84.16 18 A 1 ATOM 140 N N . ALA A 1 19 ? 11.793 4.187 1.933 1.00 93.40 19 A 1 ATOM 141 C CA . ALA A 1 19 ? 13.151 3.680 1.756 1.00 91.27 19 A 1 ATOM 142 C C . ALA A 1 19 ? 13.802 4.246 0.496 1.00 90.16 19 A 1 ATOM 143 O O . ALA A 1 19 ? 13.434 3.839 -0.611 1.00 85.25 19 A 1 ATOM 144 C CB . ALA A 1 19 ? 13.131 2.165 1.706 1.00 86.97 19 A 1 ATOM 145 O OXT . ALA A 1 19 ? 14.711 5.080 0.617 1.00 80.12 19 A 1 #