# 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_spkb13285 # _entry.id spkb13285 # 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" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[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 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" "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" "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" "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 GLU 2 1 n LYS 3 1 n SER 4 1 n ILE 5 1 n TRP 6 1 n LEU 7 1 n LEU 8 1 n ALA 9 1 n CYS 10 1 n LEU 11 1 n ALA 12 1 n TRP 13 1 n VAL 14 1 n LEU 15 1 n PRO 16 1 n THR 17 1 n GLY 18 1 n SER 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 @ 2025-07-08 14:49:26)" _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 89.93 _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 85.59 1 1 A GLU 2 2 84.50 1 2 A LYS 3 2 89.53 1 3 A SER 4 2 92.94 1 4 A ILE 5 2 93.20 1 5 A TRP 6 2 90.74 1 6 A LEU 7 2 93.03 1 7 A LEU 8 2 92.75 1 8 A ALA 9 2 96.05 1 9 A CYS 10 2 95.61 1 10 A LEU 11 2 93.63 1 11 A ALA 12 2 96.05 1 12 A TRP 13 2 90.52 1 13 A VAL 14 2 94.59 1 14 A LEU 15 2 91.04 1 15 A PRO 16 2 92.24 1 16 A THR 17 2 83.59 1 17 A GLY 18 2 82.47 1 18 A SER 19 2 70.97 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 GLU . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n SER . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n TRP . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n ALA . 9 A 9 A 10 1 n CYS . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n TRP . 13 A 13 A 14 1 n VAL . 14 A 14 A 15 1 n LEU . 15 A 15 A 16 1 n PRO . 16 A 16 A 17 1 n THR . 17 A 17 A 18 1 n GLY . 18 A 18 A 19 1 n SER . 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 ? -13.417 3.691 -2.218 1.00 92.95 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.579 2.473 -2.202 1.00 94.46 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.556 2.546 -1.074 1.00 94.81 1 A 1 ATOM 4 O O . MET A 1 1 ? -10.516 3.175 -1.221 1.00 92.40 1 A 1 ATOM 5 C CB . MET A 1 1 ? -11.838 2.321 -3.530 1.00 89.91 1 A 1 ATOM 6 C CG . MET A 1 1 ? -12.780 2.072 -4.687 1.00 79.79 1 A 1 ATOM 7 S SD . MET A 1 1 ? -11.873 1.912 -6.235 1.00 73.66 1 A 1 ATOM 8 C CE . MET A 1 1 ? -13.218 1.738 -7.374 1.00 66.78 1 A 1 ATOM 9 N N . GLU A 1 2 ? -11.863 1.922 0.030 1.00 93.53 2 A 1 ATOM 10 C CA . GLU A 1 2 ? -10.948 1.919 1.174 1.00 95.02 2 A 1 ATOM 11 C C . GLU A 1 2 ? -9.980 0.739 1.102 1.00 95.38 2 A 1 ATOM 12 O O . GLU A 1 2 ? -8.832 0.835 1.533 1.00 93.15 2 A 1 ATOM 13 C CB . GLU A 1 2 ? -11.756 1.851 2.469 1.00 92.10 2 A 1 ATOM 14 C CG . GLU A 1 2 ? -12.572 3.112 2.694 1.00 78.49 2 A 1 ATOM 15 C CD . GLU A 1 2 ? -13.385 3.026 3.960 1.00 75.64 2 A 1 ATOM 16 O OE1 . GLU A 1 2 ? -13.899 1.939 4.252 1.00 66.90 2 A 1 ATOM 17 O OE2 . GLU A 1 2 ? -13.512 4.045 4.648 1.00 70.28 2 A 1 ATOM 18 N N . LYS A 1 3 ? -10.443 -0.365 0.543 1.00 95.76 3 A 1 ATOM 19 C CA . LYS A 1 3 ? -9.601 -1.556 0.405 1.00 96.63 3 A 1 ATOM 20 C C . LYS A 1 3 ? -8.465 -1.314 -0.583 1.00 97.03 3 A 1 ATOM 21 O O . LYS A 1 3 ? -7.387 -1.882 -0.445 1.00 96.37 3 A 1 ATOM 22 C CB . LYS A 1 3 ? -10.447 -2.743 -0.055 1.00 95.67 3 A 1 ATOM 23 C CG . LYS A 1 3 ? -11.303 -3.304 1.068 1.00 89.56 3 A 1 ATOM 24 C CD . LYS A 1 3 ? -11.971 -4.596 0.645 1.00 85.19 3 A 1 ATOM 25 C CE . LYS A 1 3 ? -12.743 -5.211 1.790 1.00 78.80 3 A 1 ATOM 26 N NZ . LYS A 1 3 ? -13.350 -6.510 1.388 1.00 70.73 3 A 1 ATOM 27 N N . SER A 1 4 ? -8.716 -0.490 -1.562 1.00 94.93 4 A 1 ATOM 28 C CA . SER A 1 4 ? -7.708 -0.169 -2.572 1.00 96.02 4 A 1 ATOM 29 C C . SER A 1 4 ? -6.491 0.483 -1.927 1.00 96.36 4 A 1 ATOM 30 O O . SER A 1 4 ? -5.349 0.148 -2.237 1.00 95.16 4 A 1 ATOM 31 C CB . SER A 1 4 ? -8.300 0.762 -3.623 1.00 94.52 4 A 1 ATOM 32 O OG . SER A 1 4 ? -7.366 0.988 -4.651 1.00 80.67 4 A 1 ATOM 33 N N . ILE A 1 5 ? -6.741 1.396 -1.020 1.00 96.62 5 A 1 ATOM 34 C CA . ILE A 1 5 ? -5.665 2.096 -0.319 1.00 96.39 5 A 1 ATOM 35 C C . ILE A 1 5 ? -4.919 1.131 0.598 1.00 96.64 5 A 1 ATOM 36 O O . ILE A 1 5 ? -3.699 1.197 0.736 1.00 96.08 5 A 1 ATOM 37 C CB . ILE A 1 5 ? -6.227 3.270 0.495 1.00 95.87 5 A 1 ATOM 38 C CG1 . ILE A 1 5 ? -7.058 4.195 -0.395 1.00 91.18 5 A 1 ATOM 39 C CG2 . ILE A 1 5 ? -5.083 4.055 1.139 1.00 89.68 5 A 1 ATOM 40 C CD1 . ILE A 1 5 ? -7.971 5.104 0.405 1.00 83.15 5 A 1 ATOM 41 N N . TRP A 1 6 ? -5.677 0.232 1.214 1.00 95.69 6 A 1 ATOM 42 C CA . TRP A 1 6 ? -5.083 -0.746 2.118 1.00 95.81 6 A 1 ATOM 43 C C . TRP A 1 6 ? -4.169 -1.696 1.358 1.00 96.31 6 A 1 ATOM 44 O O . TRP A 1 6 ? -3.069 -2.003 1.808 1.00 95.73 6 A 1 ATOM 45 C CB . TRP A 1 6 ? -6.184 -1.525 2.826 1.00 95.25 6 A 1 ATOM 46 C CG . TRP A 1 6 ? -6.533 -0.921 4.146 1.00 92.71 6 A 1 ATOM 47 C CD1 . TRP A 1 6 ? -7.605 -0.144 4.426 1.00 87.92 6 A 1 ATOM 48 C CD2 . TRP A 1 6 ? -5.799 -1.041 5.377 1.00 90.50 6 A 1 ATOM 49 N NE1 . TRP A 1 6 ? -7.585 0.227 5.746 1.00 86.84 6 A 1 ATOM 50 C CE2 . TRP A 1 6 ? -6.487 -0.306 6.366 1.00 90.19 6 A 1 ATOM 51 C CE3 . TRP A 1 6 ? -4.618 -1.707 5.739 1.00 86.87 6 A 1 ATOM 52 C CZ2 . TRP A 1 6 ? -6.028 -0.227 7.679 1.00 88.03 6 A 1 ATOM 53 C CZ3 . TRP A 1 6 ? -4.165 -1.628 7.048 1.00 84.08 6 A 1 ATOM 54 C CH2 . TRP A 1 6 ? -4.864 -0.888 8.003 1.00 84.46 6 A 1 ATOM 55 N N . LEU A 1 7 ? -4.622 -2.141 0.205 1.00 96.11 7 A 1 ATOM 56 C CA . LEU A 1 7 ? -3.833 -3.054 -0.619 1.00 96.09 7 A 1 ATOM 57 C C . LEU A 1 7 ? -2.539 -2.390 -1.067 1.00 96.34 7 A 1 ATOM 58 O O . LEU A 1 7 ? -1.480 -3.016 -1.064 1.00 96.11 7 A 1 ATOM 59 C CB . LEU A 1 7 ? -4.653 -3.482 -1.838 1.00 95.96 7 A 1 ATOM 60 C CG . LEU A 1 7 ? -5.737 -4.505 -1.515 1.00 89.79 7 A 1 ATOM 61 C CD1 . LEU A 1 7 ? -6.766 -4.557 -2.637 1.00 86.80 7 A 1 ATOM 62 C CD2 . LEU A 1 7 ? -5.119 -5.883 -1.322 1.00 87.04 7 A 1 ATOM 63 N N . LEU A 1 8 ? -2.633 -1.137 -1.441 1.00 96.23 8 A 1 ATOM 64 C CA . LEU A 1 8 ? -1.457 -0.393 -1.885 1.00 95.81 8 A 1 ATOM 65 C C . LEU A 1 8 ? -0.480 -0.203 -0.734 1.00 96.10 8 A 1 ATOM 66 O O . LEU A 1 8 ? 0.729 -0.366 -0.897 1.00 95.75 8 A 1 ATOM 67 C CB . LEU A 1 8 ? -1.877 0.969 -2.433 1.00 95.15 8 A 1 ATOM 68 C CG . LEU A 1 8 ? -1.038 1.397 -3.632 1.00 89.17 8 A 1 ATOM 69 C CD1 . LEU A 1 8 ? -1.688 0.932 -4.927 1.00 87.08 8 A 1 ATOM 70 C CD2 . LEU A 1 8 ? -0.867 2.905 -3.650 1.00 86.73 8 A 1 ATOM 71 N N . ALA A 1 9 ? -1.008 0.131 0.419 1.00 96.17 9 A 1 ATOM 72 C CA . ALA A 1 9 ? -0.176 0.339 1.600 1.00 96.14 9 A 1 ATOM 73 C C . ALA A 1 9 ? 0.508 -0.960 2.015 1.00 96.49 9 A 1 ATOM 74 O O . ALA A 1 9 ? 1.682 -0.962 2.385 1.00 95.67 9 A 1 ATOM 75 C CB . ALA A 1 9 ? -1.035 0.870 2.741 1.00 95.79 9 A 1 ATOM 76 N N . CYS A 1 10 ? -0.229 -2.056 1.937 1.00 96.24 10 A 1 ATOM 77 C CA . CYS A 1 10 ? 0.309 -3.365 2.303 1.00 96.30 10 A 1 ATOM 78 C C . CYS A 1 10 ? 1.424 -3.768 1.340 1.00 96.47 10 A 1 ATOM 79 O O . CYS A 1 10 ? 2.468 -4.267 1.753 1.00 95.24 10 A 1 ATOM 80 C CB . CYS A 1 10 ? -0.812 -4.406 2.287 1.00 95.95 10 A 1 ATOM 81 S SG . CYS A 1 10 ? -0.639 -5.598 3.621 1.00 93.45 10 A 1 ATOM 82 N N . LEU A 1 11 ? 1.196 -3.548 0.064 1.00 96.17 11 A 1 ATOM 83 C CA . LEU A 1 11 ? 2.188 -3.879 -0.958 1.00 95.93 11 A 1 ATOM 84 C C . LEU A 1 11 ? 3.430 -3.012 -0.801 1.00 96.21 11 A 1 ATOM 85 O O . LEU A 1 11 ? 4.552 -3.490 -0.949 1.00 95.42 11 A 1 ATOM 86 C CB . LEU A 1 11 ? 1.591 -3.675 -2.351 1.00 95.44 11 A 1 ATOM 87 C CG . LEU A 1 11 ? 2.221 -4.582 -3.405 1.00 92.51 11 A 1 ATOM 88 C CD1 . LEU A 1 11 ? 1.451 -5.897 -3.492 1.00 88.61 11 A 1 ATOM 89 C CD2 . LEU A 1 11 ? 2.235 -3.902 -4.762 1.00 88.72 11 A 1 ATOM 90 N N . ALA A 1 12 ? 3.225 -1.757 -0.495 1.00 96.50 12 A 1 ATOM 91 C CA . ALA A 1 12 ? 4.335 -0.822 -0.308 1.00 96.40 12 A 1 ATOM 92 C C . ALA A 1 12 ? 5.232 -1.265 0.840 1.00 96.55 12 A 1 ATOM 93 O O . ALA A 1 12 ? 6.442 -1.049 0.810 1.00 95.10 12 A 1 ATOM 94 C CB . ALA A 1 12 ? 3.792 0.574 -0.040 1.00 95.68 12 A 1 ATOM 95 N N . TRP A 1 13 ? 4.636 -1.880 1.838 1.00 95.68 13 A 1 ATOM 96 C CA . TRP A 1 13 ? 5.394 -2.355 2.995 1.00 95.50 13 A 1 ATOM 97 C C . TRP A 1 13 ? 6.176 -3.616 2.653 1.00 96.08 13 A 1 ATOM 98 O O . TRP A 1 13 ? 7.338 -3.754 3.030 1.00 94.30 13 A 1 ATOM 99 C CB . TRP A 1 13 ? 4.446 -2.620 4.159 1.00 94.69 13 A 1 ATOM 100 C CG . TRP A 1 13 ? 5.142 -2.545 5.477 1.00 92.59 13 A 1 ATOM 101 C CD1 . TRP A 1 13 ? 5.680 -3.587 6.167 1.00 88.25 13 A 1 ATOM 102 C CD2 . TRP A 1 13 ? 5.395 -1.367 6.261 1.00 90.49 13 A 1 ATOM 103 N NE1 . TRP A 1 13 ? 6.257 -3.128 7.327 1.00 86.84 13 A 1 ATOM 104 C CE2 . TRP A 1 13 ? 6.097 -1.769 7.417 1.00 90.31 13 A 1 ATOM 105 C CE3 . TRP A 1 13 ? 5.096 -0.011 6.094 1.00 87.76 13 A 1 ATOM 106 C CZ2 . TRP A 1 13 ? 6.494 -0.849 8.391 1.00 87.89 13 A 1 ATOM 107 C CZ3 . TRP A 1 13 ? 5.490 0.898 7.066 1.00 83.37 13 A 1 ATOM 108 C CH2 . TRP A 1 13 ? 6.187 0.479 8.202 1.00 83.49 13 A 1 ATOM 109 N N . VAL A 1 14 ? 5.543 -4.530 1.951 1.00 96.40 14 A 1 ATOM 110 C CA . VAL A 1 14 ? 6.185 -5.785 1.558 1.00 96.16 14 A 1 ATOM 111 C C . VAL A 1 14 ? 7.138 -5.565 0.391 1.00 96.36 14 A 1 ATOM 112 O O . VAL A 1 14 ? 8.255 -6.091 0.381 1.00 95.08 14 A 1 ATOM 113 C CB . VAL A 1 14 ? 5.136 -6.840 1.177 1.00 95.02 14 A 1 ATOM 114 C CG1 . VAL A 1 14 ? 5.805 -8.156 0.823 1.00 91.46 14 A 1 ATOM 115 C CG2 . VAL A 1 14 ? 4.155 -7.053 2.319 1.00 91.68 14 A 1 ATOM 116 N N . LEU A 1 15 ? 6.690 -4.802 -0.582 1.00 95.42 15 A 1 ATOM 117 C CA . LEU A 1 15 ? 7.487 -4.534 -1.780 1.00 94.77 15 A 1 ATOM 118 C C . LEU A 1 15 ? 7.661 -3.033 -1.975 1.00 94.59 15 A 1 ATOM 119 O O . LEU A 1 15 ? 6.858 -2.390 -2.645 1.00 92.86 15 A 1 ATOM 120 C CB . LEU A 1 15 ? 6.798 -5.163 -2.992 1.00 93.45 15 A 1 ATOM 121 C CG . LEU A 1 15 ? 7.716 -6.048 -3.820 1.00 89.01 15 A 1 ATOM 122 C CD1 . LEU A 1 15 ? 6.919 -7.176 -4.469 1.00 84.22 15 A 1 ATOM 123 C CD2 . LEU A 1 15 ? 8.429 -5.229 -4.882 1.00 84.03 15 A 1 ATOM 124 N N . PRO A 1 16 ? 8.703 -2.470 -1.396 1.00 94.93 16 A 1 ATOM 125 C CA . PRO A 1 16 ? 8.957 -1.032 -1.510 1.00 94.12 16 A 1 ATOM 126 C C . PRO A 1 16 ? 9.265 -0.635 -2.947 1.00 93.64 16 A 1 ATOM 127 O O . PRO A 1 16 ? 10.047 -1.298 -3.633 1.00 88.88 16 A 1 ATOM 128 C CB . PRO A 1 16 ? 10.171 -0.799 -0.605 1.00 91.49 16 A 1 ATOM 129 C CG . PRO A 1 16 ? 10.843 -2.124 -0.503 1.00 89.30 16 A 1 ATOM 130 C CD . PRO A 1 16 ? 9.742 -3.152 -0.611 1.00 93.30 16 A 1 ATOM 131 N N . THR A 1 17 ? 8.657 0.442 -3.374 1.00 90.93 17 A 1 ATOM 132 C CA . THR A 1 17 ? 8.862 0.930 -4.733 1.00 88.65 17 A 1 ATOM 133 C C . THR A 1 17 ? 9.888 2.052 -4.749 1.00 86.18 17 A 1 ATOM 134 O O . THR A 1 17 ? 9.822 2.975 -3.936 1.00 78.58 17 A 1 ATOM 135 C CB . THR A 1 17 ? 7.541 1.426 -5.327 1.00 85.85 17 A 1 ATOM 136 O OG1 . THR A 1 17 ? 6.958 2.393 -4.471 1.00 78.52 17 A 1 ATOM 137 C CG2 . THR A 1 17 ? 6.577 0.270 -5.508 1.00 76.41 17 A 1 ATOM 138 N N . GLY A 1 18 ? 10.833 1.962 -5.654 1.00 86.43 18 A 1 ATOM 139 C CA . GLY A 1 18 ? 11.870 2.981 -5.768 1.00 83.52 18 A 1 ATOM 140 C C . GLY A 1 18 ? 12.042 3.430 -7.204 1.00 82.39 18 A 1 ATOM 141 O O . GLY A 1 18 ? 12.858 2.883 -7.934 1.00 77.53 18 A 1 ATOM 142 N N . SER A 1 19 ? 11.263 4.418 -7.576 1.00 82.27 19 A 1 ATOM 143 C CA . SER A 1 19 ? 11.318 4.955 -8.933 1.00 78.19 19 A 1 ATOM 144 C C . SER A 1 19 ? 11.356 6.480 -8.908 1.00 72.76 19 A 1 ATOM 145 O O . SER A 1 19 ? 10.683 7.066 -8.054 1.00 65.32 19 A 1 ATOM 146 C CB . SER A 1 19 ? 10.116 4.485 -9.744 1.00 70.44 19 A 1 ATOM 147 O OG . SER A 1 19 ? 10.160 3.093 -9.939 1.00 63.72 19 A 1 ATOM 148 O OXT . SER A 1 19 ? 12.047 7.083 -9.760 1.00 64.12 19 A 1 #