# 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_spkb11195 # _entry.id spkb11195 # 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 H15 N4 O2" 175.209 ARG y ARGININE C(C[C@@H](C(=O)O)N)CNC(=[NH2+])N ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O ? "L-PEPTIDE LINKING" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[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" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE C([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" # _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 ARG 2 1 n PRO 3 1 n LEU 4 1 n ILE 5 1 n LEU 6 1 n LEU 7 1 n ALA 8 1 n ALA 9 1 n LEU 10 1 n LEU 11 1 n TRP 12 1 n LEU 13 1 n GLN 14 1 n ASP 15 1 n SER 16 1 n LEU 17 1 n ALA 18 # _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 21:31:59)" _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 94.54 _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 87.64 1 1 A ARG 2 2 84.98 1 2 A PRO 3 2 96.56 1 3 A LEU 4 2 95.61 1 4 A ILE 5 2 96.23 1 5 A LEU 6 2 96.20 1 6 A LEU 7 2 96.22 1 7 A ALA 8 2 98.49 1 8 A ALA 9 2 98.51 1 9 A LEU 10 2 96.76 1 10 A LEU 11 2 97.34 1 11 A TRP 12 2 95.28 1 12 A LEU 13 2 96.74 1 13 A GLN 14 2 93.48 1 14 A ASP 15 2 95.16 1 15 A SER 16 2 96.44 1 16 A LEU 17 2 94.52 1 17 A ALA 18 2 91.67 1 18 # _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 ARG . 2 A 2 A 3 1 n PRO . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n ALA . 8 A 8 A 9 1 n ALA . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n TRP . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n GLN . 14 A 14 A 15 1 n ASP . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n LEU . 17 A 17 A 18 1 n ALA . 18 A 18 # _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 ? -14.480 2.436 9.654 1.00 93.89 1 A 1 ATOM 2 C CA . MET A 1 1 ? -13.149 2.626 9.062 1.00 93.42 1 A 1 ATOM 3 C C . MET A 1 1 ? -12.796 1.458 8.143 1.00 93.88 1 A 1 ATOM 4 O O . MET A 1 1 ? -13.470 0.429 8.154 1.00 91.28 1 A 1 ATOM 5 C CB . MET A 1 1 ? -12.097 2.745 10.160 1.00 90.32 1 A 1 ATOM 6 C CG . MET A 1 1 ? -12.344 3.943 11.068 1.00 85.28 1 A 1 ATOM 7 S SD . MET A 1 1 ? -11.139 4.053 12.400 1.00 81.41 1 A 1 ATOM 8 C CE . MET A 1 1 ? -11.683 5.556 13.187 1.00 71.61 1 A 1 ATOM 9 N N . ARG A 1 2 ? -11.729 1.602 7.348 1.00 94.06 2 A 1 ATOM 10 C CA . ARG A 1 2 ? -11.311 0.562 6.412 1.00 95.38 2 A 1 ATOM 11 C C . ARG A 1 2 ? -9.812 0.273 6.580 1.00 96.01 2 A 1 ATOM 12 O O . ARG A 1 2 ? -8.990 0.825 5.845 1.00 94.47 2 A 1 ATOM 13 C CB . ARG A 1 2 ? -11.625 1.006 4.980 1.00 93.15 2 A 1 ATOM 14 C CG . ARG A 1 2 ? -13.055 1.483 4.818 1.00 85.51 2 A 1 ATOM 15 C CD . ARG A 1 2 ? -13.295 2.044 3.426 1.00 83.22 2 A 1 ATOM 16 N NE . ARG A 1 2 ? -13.817 1.036 2.514 1.00 78.00 2 A 1 ATOM 17 C CZ . ARG A 1 2 ? -14.239 1.310 1.279 1.00 76.20 2 A 1 ATOM 18 N NH1 . ARG A 1 2 ? -14.159 2.539 0.793 1.00 69.45 2 A 1 ATOM 19 N NH2 . ARG A 1 2 ? -14.755 0.352 0.529 1.00 69.34 2 A 1 ATOM 20 N N . PRO A 1 3 ? -9.451 -0.580 7.540 1.00 97.36 3 A 1 ATOM 21 C CA . PRO A 1 3 ? -8.045 -0.907 7.818 1.00 97.38 3 A 1 ATOM 22 C C . PRO A 1 3 ? -7.364 -1.655 6.676 1.00 97.97 3 A 1 ATOM 23 O O . PRO A 1 3 ? -6.156 -1.522 6.479 1.00 97.24 3 A 1 ATOM 24 C CB . PRO A 1 3 ? -8.117 -1.776 9.082 1.00 95.96 3 A 1 ATOM 25 C CG . PRO A 1 3 ? -9.484 -2.374 9.042 1.00 94.01 3 A 1 ATOM 26 C CD . PRO A 1 3 ? -10.365 -1.330 8.407 1.00 96.01 3 A 1 ATOM 27 N N . LEU A 1 4 ? -8.125 -2.432 5.912 1.00 97.29 4 A 1 ATOM 28 C CA . LEU A 1 4 ? -7.564 -3.201 4.799 1.00 97.74 4 A 1 ATOM 29 C C . LEU A 1 4 ? -6.927 -2.277 3.762 1.00 98.14 4 A 1 ATOM 30 O O . LEU A 1 4 ? -5.862 -2.572 3.223 1.00 97.96 4 A 1 ATOM 31 C CB . LEU A 1 4 ? -8.657 -4.050 4.142 1.00 97.42 4 A 1 ATOM 32 C CG . LEU A 1 4 ? -9.259 -5.109 5.061 1.00 94.53 4 A 1 ATOM 33 C CD1 . LEU A 1 4 ? -10.392 -5.831 4.344 1.00 90.81 4 A 1 ATOM 34 C CD2 . LEU A 1 4 ? -8.192 -6.107 5.498 1.00 90.96 4 A 1 ATOM 35 N N . ILE A 1 5 ? -7.568 -1.152 3.494 1.00 98.09 5 A 1 ATOM 36 C CA . ILE A 1 5 ? -7.050 -0.188 2.528 1.00 98.07 5 A 1 ATOM 37 C C . ILE A 1 5 ? -5.740 0.414 3.032 1.00 98.32 5 A 1 ATOM 38 O O . ILE A 1 5 ? -4.789 0.596 2.269 1.00 98.23 5 A 1 ATOM 39 C CB . ILE A 1 5 ? -8.078 0.926 2.251 1.00 97.75 5 A 1 ATOM 40 C CG1 . ILE A 1 5 ? -9.348 0.323 1.636 1.00 94.90 5 A 1 ATOM 41 C CG2 . ILE A 1 5 ? -7.482 1.975 1.316 1.00 94.55 5 A 1 ATOM 42 C CD1 . ILE A 1 5 ? -10.463 1.332 1.450 1.00 89.89 5 A 1 ATOM 43 N N . LEU A 1 6 ? -5.685 0.722 4.330 1.00 97.95 6 A 1 ATOM 44 C CA . LEU A 1 6 ? -4.483 1.294 4.926 1.00 98.11 6 A 1 ATOM 45 C C . LEU A 1 6 ? -3.316 0.315 4.835 1.00 98.29 6 A 1 ATOM 46 O O . LEU A 1 6 ? -2.190 0.700 4.514 1.00 98.34 6 A 1 ATOM 47 C CB . LEU A 1 6 ? -4.744 1.668 6.390 1.00 98.08 6 A 1 ATOM 48 C CG . LEU A 1 6 ? -5.775 2.777 6.582 1.00 94.57 6 A 1 ATOM 49 C CD1 . LEU A 1 6 ? -6.056 2.977 8.070 1.00 91.79 6 A 1 ATOM 50 C CD2 . LEU A 1 6 ? -5.288 4.076 5.962 1.00 92.49 6 A 1 ATOM 51 N N . LEU A 1 7 ? -3.586 -0.956 5.107 1.00 98.32 7 A 1 ATOM 52 C CA . LEU A 1 7 ? -2.553 -1.987 5.037 1.00 98.35 7 A 1 ATOM 53 C C . LEU A 1 7 ? -2.031 -2.129 3.611 1.00 98.51 7 A 1 ATOM 54 O O . LEU A 1 7 ? -0.822 -2.223 3.388 1.00 98.50 7 A 1 ATOM 55 C CB . LEU A 1 7 ? -3.120 -3.325 5.521 1.00 98.16 7 A 1 ATOM 56 C CG . LEU A 1 7 ? -3.443 -3.365 7.012 1.00 93.88 7 A 1 ATOM 57 C CD1 . LEU A 1 7 ? -4.168 -4.662 7.358 1.00 91.58 7 A 1 ATOM 58 C CD2 . LEU A 1 7 ? -2.170 -3.242 7.840 1.00 92.47 7 A 1 ATOM 59 N N . ALA A 1 8 ? -2.939 -2.144 2.645 1.00 98.52 8 A 1 ATOM 60 C CA . ALA A 1 8 ? -2.562 -2.261 1.241 1.00 98.53 8 A 1 ATOM 61 C C . ALA A 1 8 ? -1.736 -1.057 0.795 1.00 98.61 8 A 1 ATOM 62 O O . ALA A 1 8 ? -0.743 -1.207 0.078 1.00 98.47 8 A 1 ATOM 63 C CB . ALA A 1 8 ? -3.817 -2.381 0.381 1.00 98.32 8 A 1 ATOM 64 N N . ALA A 1 9 ? -2.136 0.130 1.231 1.00 98.58 9 A 1 ATOM 65 C CA . ALA A 1 9 ? -1.424 1.351 0.873 1.00 98.54 9 A 1 ATOM 66 C C . ALA A 1 9 ? -0.016 1.353 1.462 1.00 98.63 9 A 1 ATOM 67 O O . ALA A 1 9 ? 0.947 1.722 0.788 1.00 98.43 9 A 1 ATOM 68 C CB . ALA A 1 9 ? -2.203 2.568 1.365 1.00 98.35 9 A 1 ATOM 69 N N . LEU A 1 10 ? 0.114 0.929 2.719 1.00 98.42 10 A 1 ATOM 70 C CA . LEU A 1 10 ? 1.415 0.869 3.378 1.00 98.28 10 A 1 ATOM 71 C C . LEU A 1 10 ? 2.325 -0.131 2.681 1.00 98.34 10 A 1 ATOM 72 O O . LEU A 1 10 ? 3.510 0.139 2.466 1.00 98.13 10 A 1 ATOM 73 C CB . LEU A 1 10 ? 1.238 0.481 4.847 1.00 98.11 10 A 1 ATOM 74 C CG . LEU A 1 10 ? 2.543 0.454 5.644 1.00 95.88 10 A 1 ATOM 75 C CD1 . LEU A 1 10 ? 3.172 1.839 5.702 1.00 93.14 10 A 1 ATOM 76 C CD2 . LEU A 1 10 ? 2.289 -0.070 7.049 1.00 93.79 10 A 1 ATOM 77 N N . LEU A 1 11 ? 1.784 -1.290 2.326 1.00 98.45 11 A 1 ATOM 78 C CA . LEU A 1 11 ? 2.545 -2.328 1.635 1.00 98.39 11 A 1 ATOM 79 C C . LEU A 1 11 ? 3.034 -1.813 0.285 1.00 98.45 11 A 1 ATOM 80 O O . LEU A 1 11 ? 4.186 -2.031 -0.101 1.00 98.30 11 A 1 ATOM 81 C CB . LEU A 1 11 ? 1.664 -3.574 1.449 1.00 98.30 11 A 1 ATOM 82 C CG . LEU A 1 11 ? 2.431 -4.874 1.196 1.00 96.81 11 A 1 ATOM 83 C CD1 . LEU A 1 11 ? 3.137 -4.848 -0.150 1.00 94.78 11 A 1 ATOM 84 C CD2 . LEU A 1 11 ? 3.434 -5.116 2.314 1.00 95.25 11 A 1 ATOM 85 N N . TRP A 1 12 ? 2.159 -1.128 -0.434 1.00 98.45 12 A 1 ATOM 86 C CA . TRP A 1 12 ? 2.518 -0.576 -1.741 1.00 98.44 12 A 1 ATOM 87 C C . TRP A 1 12 ? 3.609 0.479 -1.597 1.00 98.54 12 A 1 ATOM 88 O O . TRP A 1 12 ? 4.541 0.544 -2.403 1.00 98.32 12 A 1 ATOM 89 C CB . TRP A 1 12 ? 1.282 0.038 -2.402 1.00 98.25 12 A 1 ATOM 90 C CG . TRP A 1 12 ? 1.514 0.378 -3.841 1.00 96.94 12 A 1 ATOM 91 C CD1 . TRP A 1 12 ? 1.338 -0.459 -4.900 1.00 93.87 12 A 1 ATOM 92 C CD2 . TRP A 1 12 ? 1.964 1.624 -4.387 1.00 95.39 12 A 1 ATOM 93 N NE1 . TRP A 1 12 ? 1.663 0.191 -6.070 1.00 92.64 12 A 1 ATOM 94 C CE2 . TRP A 1 12 ? 2.050 1.475 -5.791 1.00 94.89 12 A 1 ATOM 95 C CE3 . TRP A 1 12 ? 2.316 2.860 -3.825 1.00 93.28 12 A 1 ATOM 96 C CZ2 . TRP A 1 12 ? 2.467 2.516 -6.628 1.00 94.07 12 A 1 ATOM 97 C CZ3 . TRP A 1 12 ? 2.729 3.899 -4.661 1.00 90.37 12 A 1 ATOM 98 C CH2 . TRP A 1 12 ? 2.802 3.717 -6.046 1.00 90.52 12 A 1 ATOM 99 N N . LEU A 1 13 ? 3.511 1.298 -0.546 1.00 98.55 13 A 1 ATOM 100 C CA . LEU A 1 13 ? 4.508 2.338 -0.301 1.00 98.45 13 A 1 ATOM 101 C C . LEU A 1 13 ? 5.877 1.718 -0.051 1.00 98.44 13 A 1 ATOM 102 O O . LEU A 1 13 ? 6.885 2.168 -0.600 1.00 98.07 13 A 1 ATOM 103 C CB . LEU A 1 13 ? 4.096 3.190 0.898 1.00 98.30 13 A 1 ATOM 104 C CG . LEU A 1 13 ? 5.058 4.344 1.202 1.00 96.27 13 A 1 ATOM 105 C CD1 . LEU A 1 13 ? 5.068 5.351 0.059 1.00 92.57 13 A 1 ATOM 106 C CD2 . LEU A 1 13 ? 4.662 5.028 2.502 1.00 93.29 13 A 1 ATOM 107 N N . GLN A 1 14 ? 5.929 0.683 0.780 1.00 98.42 14 A 1 ATOM 108 C CA . GLN A 1 14 ? 7.187 0.002 1.086 1.00 98.33 14 A 1 ATOM 109 C C . GLN A 1 14 ? 7.754 -0.679 -0.154 1.00 98.41 14 A 1 ATOM 110 O O . GLN A 1 14 ? 8.963 -0.666 -0.382 1.00 97.71 14 A 1 ATOM 111 C CB . GLN A 1 14 ? 6.964 -1.025 2.195 1.00 97.74 14 A 1 ATOM 112 C CG . GLN A 1 14 ? 6.634 -0.375 3.529 1.00 93.27 14 A 1 ATOM 113 C CD . GLN A 1 14 ? 6.439 -1.402 4.630 1.00 90.20 14 A 1 ATOM 114 O OE1 . GLN A 1 14 ? 6.558 -1.085 5.808 1.00 84.66 14 A 1 ATOM 115 N NE2 . GLN A 1 14 ? 6.142 -2.643 4.281 1.00 82.57 14 A 1 ATOM 116 N N . ASP A 1 15 ? 6.879 -1.264 -0.964 1.00 98.27 15 A 1 ATOM 117 C CA . ASP A 1 15 ? 7.302 -1.921 -2.200 1.00 98.21 15 A 1 ATOM 118 C C . ASP A 1 15 ? 7.943 -0.915 -3.148 1.00 98.38 15 A 1 ATOM 119 O O . ASP A 1 15 ? 8.945 -1.212 -3.802 1.00 97.77 15 A 1 ATOM 120 C CB . ASP A 1 15 ? 6.100 -2.582 -2.884 1.00 97.49 15 A 1 ATOM 121 C CG . ASP A 1 15 ? 6.536 -3.404 -4.079 1.00 92.81 15 A 1 ATOM 122 O OD1 . ASP A 1 15 ? 6.670 -2.836 -5.170 1.00 89.48 15 A 1 ATOM 123 O OD2 . ASP A 1 15 ? 6.746 -4.620 -3.923 1.00 88.88 15 A 1 ATOM 124 N N . SER A 1 16 ? 7.384 0.285 -3.222 1.00 98.14 16 A 1 ATOM 125 C CA . SER A 1 16 ? 7.917 1.339 -4.085 1.00 97.91 16 A 1 ATOM 126 C C . SER A 1 16 ? 9.212 1.906 -3.511 1.00 97.91 16 A 1 ATOM 127 O O . SER A 1 16 ? 10.109 2.309 -4.255 1.00 96.46 16 A 1 ATOM 128 C CB . SER A 1 16 ? 6.889 2.461 -4.251 1.00 97.23 16 A 1 ATOM 129 O OG . SER A 1 16 ? 7.386 3.465 -5.116 1.00 90.98 16 A 1 ATOM 130 N N . LEU A 1 17 ? 9.316 1.947 -2.180 1.00 97.55 17 A 1 ATOM 131 C CA . LEU A 1 17 ? 10.498 2.472 -1.498 1.00 97.10 17 A 1 ATOM 132 C C . LEU A 1 17 ? 11.700 1.560 -1.705 1.00 97.02 17 A 1 ATOM 133 O O . LEU A 1 17 ? 12.814 2.029 -1.968 1.00 95.54 17 A 1 ATOM 134 C CB . LEU A 1 17 ? 10.196 2.638 -0.003 1.00 96.56 17 A 1 ATOM 135 C CG . LEU A 1 17 ? 11.241 3.401 0.812 1.00 94.51 17 A 1 ATOM 136 C CD1 . LEU A 1 17 ? 12.500 2.574 1.019 1.00 89.64 17 A 1 ATOM 137 C CD2 . LEU A 1 17 ? 11.588 4.711 0.116 1.00 88.23 17 A 1 ATOM 138 N N . ALA A 1 18 ? 11.476 0.256 -1.603 1.00 96.27 18 A 1 ATOM 139 C CA . ALA A 1 18 ? 12.556 -0.725 -1.745 1.00 94.97 18 A 1 ATOM 140 C C . ALA A 1 18 ? 12.530 -1.368 -3.132 1.00 92.89 18 A 1 ATOM 141 O O . ALA A 1 18 ? 12.800 -2.574 -3.252 1.00 88.78 18 A 1 ATOM 142 C CB . ALA A 1 18 ? 12.443 -1.779 -0.647 1.00 92.36 18 A 1 ATOM 143 O OXT . ALA A 1 18 ? 12.264 -0.657 -4.135 1.00 84.75 18 A 1 #