# 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_spkb39638 # _entry.id spkb39638 # 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 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=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" "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" "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 ASN 2 1 n MET 3 1 n ARG 4 1 n VAL 5 1 n PHE 6 1 n ILE 7 1 n PHE 8 1 n LEU 9 1 n ILE 10 1 n PHE 11 1 n ALA 12 1 n ALA 13 1 n ALA 14 1 n SER 15 1 n VAL 16 1 n SER 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 @ 2025-07-02 17:12:20)" _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 92.08 _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 79.85 1 1 A ASN 2 2 90.44 1 2 A MET 3 2 91.19 1 3 A ARG 4 2 88.60 1 4 A VAL 5 2 95.35 1 5 A PHE 6 2 93.75 1 6 A ILE 7 2 95.02 1 7 A PHE 8 2 93.09 1 8 A LEU 9 2 93.60 1 9 A ILE 10 2 94.51 1 10 A PHE 11 2 93.50 1 11 A ALA 12 2 96.79 1 12 A ALA 13 2 96.51 1 13 A ALA 14 2 96.97 1 14 A SER 15 2 94.52 1 15 A VAL 16 2 92.02 1 16 A SER 17 2 89.77 1 17 A ALA 18 2 85.90 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 ASN . 2 A 2 A 3 1 n MET . 3 A 3 A 4 1 n ARG . 4 A 4 A 5 1 n VAL . 5 A 5 A 6 1 n PHE . 6 A 6 A 7 1 n ILE . 7 A 7 A 8 1 n PHE . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n ILE . 10 A 10 A 11 1 n PHE . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n VAL . 16 A 16 A 17 1 n SER . 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 ? -12.998 -0.452 4.633 1.00 87.24 1 A 1 ATOM 2 C CA . MET A 1 1 ? -11.703 -0.478 3.923 1.00 88.85 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.131 -1.885 3.866 1.00 90.60 1 A 1 ATOM 4 O O . MET A 1 1 ? -11.193 -2.621 4.849 1.00 86.70 1 A 1 ATOM 5 C CB . MET A 1 1 ? -10.698 0.425 4.632 1.00 81.11 1 A 1 ATOM 6 C CG . MET A 1 1 ? -10.919 1.900 4.354 1.00 73.53 1 A 1 ATOM 7 S SD . MET A 1 1 ? -9.838 2.950 5.338 1.00 69.47 1 A 1 ATOM 8 C CE . MET A 1 1 ? -10.840 4.423 5.475 1.00 61.34 1 A 1 ATOM 9 N N . ASN A 1 2 ? -10.577 -2.242 2.733 1.00 93.82 2 A 1 ATOM 10 C CA . ASN A 1 2 ? -9.984 -3.558 2.553 1.00 95.30 2 A 1 ATOM 11 C C . ASN A 1 2 ? -8.489 -3.532 2.860 1.00 95.93 2 A 1 ATOM 12 O O . ASN A 1 2 ? -7.840 -2.488 2.756 1.00 94.90 2 A 1 ATOM 13 C CB . ASN A 1 2 ? -10.210 -4.037 1.125 1.00 93.00 2 A 1 ATOM 14 C CG . ASN A 1 2 ? -11.416 -4.948 1.025 1.00 87.00 2 A 1 ATOM 15 O OD1 . ASN A 1 2 ? -11.430 -6.032 1.579 1.00 82.97 2 A 1 ATOM 16 N ND2 . ASN A 1 2 ? -12.435 -4.503 0.310 1.00 80.56 2 A 1 ATOM 17 N N . MET A 1 3 ? -7.956 -4.690 3.224 1.00 96.28 3 A 1 ATOM 18 C CA . MET A 1 3 ? -6.526 -4.807 3.526 1.00 96.47 3 A 1 ATOM 19 C C . MET A 1 3 ? -5.684 -4.591 2.270 1.00 96.96 3 A 1 ATOM 20 O O . MET A 1 3 ? -4.572 -4.065 2.339 1.00 95.39 3 A 1 ATOM 21 C CB . MET A 1 3 ? -6.236 -6.188 4.117 1.00 94.91 3 A 1 ATOM 22 C CG . MET A 1 3 ? -6.693 -6.323 5.550 1.00 90.43 3 A 1 ATOM 23 S SD . MET A 1 3 ? -6.610 -8.018 6.148 1.00 84.85 3 A 1 ATOM 24 C CE . MET A 1 3 ? -5.240 -7.887 7.288 1.00 74.25 3 A 1 ATOM 25 N N . ARG A 1 4 ? -6.219 -4.982 1.134 1.00 96.69 4 A 1 ATOM 26 C CA . ARG A 1 4 ? -5.516 -4.837 -0.142 1.00 97.18 4 A 1 ATOM 27 C C . ARG A 1 4 ? -5.316 -3.365 -0.492 1.00 97.52 4 A 1 ATOM 28 O O . ARG A 1 4 ? -4.258 -2.972 -0.975 1.00 96.69 4 A 1 ATOM 29 C CB . ARG A 1 4 ? -6.297 -5.540 -1.249 1.00 96.40 4 A 1 ATOM 30 C CG . ARG A 1 4 ? -5.435 -5.787 -2.469 1.00 91.10 4 A 1 ATOM 31 C CD . ARG A 1 4 ? -6.279 -6.076 -3.697 1.00 87.87 4 A 1 ATOM 32 N NE . ARG A 1 4 ? -6.922 -7.390 -3.631 1.00 82.66 4 A 1 ATOM 33 C CZ . ARG A 1 4 ? -7.743 -7.852 -4.560 1.00 79.73 4 A 1 ATOM 34 N NH1 . ARG A 1 4 ? -8.043 -7.119 -5.621 1.00 75.50 4 A 1 ATOM 35 N NH2 . ARG A 1 4 ? -8.277 -9.054 -4.427 1.00 73.28 4 A 1 ATOM 36 N N . VAL A 1 5 ? -6.327 -2.560 -0.228 1.00 96.56 5 A 1 ATOM 37 C CA . VAL A 1 5 ? -6.256 -1.124 -0.505 1.00 96.72 5 A 1 ATOM 38 C C . VAL A 1 5 ? -5.180 -0.468 0.355 1.00 97.27 5 A 1 ATOM 39 O O . VAL A 1 5 ? -4.464 0.428 -0.092 1.00 96.75 5 A 1 ATOM 40 C CB . VAL A 1 5 ? -7.612 -0.447 -0.247 1.00 95.94 5 A 1 ATOM 41 C CG1 . VAL A 1 5 ? -7.529 1.051 -0.520 1.00 92.12 5 A 1 ATOM 42 C CG2 . VAL A 1 5 ? -8.695 -1.081 -1.104 1.00 92.11 5 A 1 ATOM 43 N N . PHE A 1 6 ? -5.078 -0.919 1.598 1.00 96.17 6 A 1 ATOM 44 C CA . PHE A 1 6 ? -4.086 -0.390 2.529 1.00 96.40 6 A 1 ATOM 45 C C . PHE A 1 6 ? -2.674 -0.661 2.022 1.00 96.97 6 A 1 ATOM 46 O O . PHE A 1 6 ? -1.821 0.229 2.014 1.00 96.72 6 A 1 ATOM 47 C CB . PHE A 1 6 ? -4.287 -1.029 3.904 1.00 96.08 6 A 1 ATOM 48 C CG . PHE A 1 6 ? -3.794 -0.153 5.030 1.00 94.38 6 A 1 ATOM 49 C CD1 . PHE A 1 6 ? -4.552 0.924 5.467 1.00 91.47 6 A 1 ATOM 50 C CD2 . PHE A 1 6 ? -2.581 -0.419 5.645 1.00 91.54 6 A 1 ATOM 51 C CE1 . PHE A 1 6 ? -4.102 1.732 6.501 1.00 90.40 6 A 1 ATOM 52 C CE2 . PHE A 1 6 ? -2.125 0.391 6.679 1.00 90.70 6 A 1 ATOM 53 C CZ . PHE A 1 6 ? -2.885 1.467 7.109 1.00 90.38 6 A 1 ATOM 54 N N . ILE A 1 7 ? -2.433 -1.890 1.599 1.00 96.58 7 A 1 ATOM 55 C CA . ILE A 1 7 ? -1.125 -2.285 1.079 1.00 96.72 7 A 1 ATOM 56 C C . ILE A 1 7 ? -0.820 -1.545 -0.221 1.00 97.15 7 A 1 ATOM 57 O O . ILE A 1 7 ? 0.322 -1.149 -0.473 1.00 96.82 7 A 1 ATOM 58 C CB . ILE A 1 7 ? -1.072 -3.808 0.852 1.00 96.42 7 A 1 ATOM 59 C CG1 . ILE A 1 7 ? -1.266 -4.554 2.175 1.00 94.17 7 A 1 ATOM 60 C CG2 . ILE A 1 7 ? 0.264 -4.206 0.221 1.00 93.88 7 A 1 ATOM 61 C CD1 . ILE A 1 7 ? -1.561 -6.024 1.989 1.00 88.40 7 A 1 ATOM 62 N N . PHE A 1 8 ? -1.841 -1.351 -1.031 1.00 96.45 8 A 1 ATOM 63 C CA . PHE A 1 8 ? -1.693 -0.660 -2.308 1.00 96.43 8 A 1 ATOM 64 C C . PHE A 1 8 ? -1.226 0.774 -2.095 1.00 96.77 8 A 1 ATOM 65 O O . PHE A 1 8 ? -0.361 1.273 -2.819 1.00 96.24 8 A 1 ATOM 66 C CB . PHE A 1 8 ? -3.028 -0.679 -3.051 1.00 96.04 8 A 1 ATOM 67 C CG . PHE A 1 8 ? -2.861 -0.646 -4.547 1.00 93.89 8 A 1 ATOM 68 C CD1 . PHE A 1 8 ? -2.279 -1.714 -5.212 1.00 90.70 8 A 1 ATOM 69 C CD2 . PHE A 1 8 ? -3.298 0.448 -5.276 1.00 90.86 8 A 1 ATOM 70 C CE1 . PHE A 1 8 ? -2.123 -1.689 -6.589 1.00 89.07 8 A 1 ATOM 71 C CE2 . PHE A 1 8 ? -3.145 0.477 -6.656 1.00 89.13 8 A 1 ATOM 72 C CZ . PHE A 1 8 ? -2.558 -0.590 -7.314 1.00 88.44 8 A 1 ATOM 73 N N . LEU A 1 9 ? -1.798 1.430 -1.096 1.00 96.09 9 A 1 ATOM 74 C CA . LEU A 1 9 ? -1.433 2.808 -0.784 1.00 96.20 9 A 1 ATOM 75 C C . LEU A 1 9 ? 0.001 2.899 -0.272 1.00 96.75 9 A 1 ATOM 76 O O . LEU A 1 9 ? 0.737 3.822 -0.625 1.00 96.79 9 A 1 ATOM 77 C CB . LEU A 1 9 ? -2.396 3.372 0.266 1.00 95.69 9 A 1 ATOM 78 C CG . LEU A 1 9 ? -3.787 3.706 -0.269 1.00 90.13 9 A 1 ATOM 79 C CD1 . LEU A 1 9 ? -4.771 3.904 0.873 1.00 88.54 9 A 1 ATOM 80 C CD2 . LEU A 1 9 ? -3.735 4.962 -1.135 1.00 88.60 9 A 1 ATOM 81 N N . ILE A 1 10 ? 0.391 1.949 0.561 1.00 96.12 10 A 1 ATOM 82 C CA . ILE A 1 10 ? 1.740 1.922 1.116 1.00 96.07 10 A 1 ATOM 83 C C . ILE A 1 10 ? 2.768 1.664 0.022 1.00 96.47 10 A 1 ATOM 84 O O . ILE A 1 10 ? 3.823 2.305 -0.024 1.00 96.22 10 A 1 ATOM 85 C CB . ILE A 1 10 ? 1.854 0.851 2.217 1.00 95.58 10 A 1 ATOM 86 C CG1 . ILE A 1 10 ? 0.872 1.144 3.366 1.00 93.75 10 A 1 ATOM 87 C CG2 . ILE A 1 10 ? 3.286 0.784 2.753 1.00 93.21 10 A 1 ATOM 88 C CD1 . ILE A 1 10 ? 1.140 2.465 4.062 1.00 88.69 10 A 1 ATOM 89 N N . PHE A 1 11 ? 2.469 0.724 -0.854 1.00 96.82 11 A 1 ATOM 90 C CA . PHE A 1 11 ? 3.367 0.379 -1.950 1.00 96.73 11 A 1 ATOM 91 C C . PHE A 1 11 ? 3.523 1.549 -2.911 1.00 97.11 11 A 1 ATOM 92 O O . PHE A 1 11 ? 4.629 1.850 -3.365 1.00 96.66 11 A 1 ATOM 93 C CB . PHE A 1 11 ? 2.833 -0.844 -2.699 1.00 96.04 11 A 1 ATOM 94 C CG . PHE A 1 11 ? 3.811 -1.997 -2.699 1.00 93.16 11 A 1 ATOM 95 C CD1 . PHE A 1 11 ? 4.903 -1.991 -3.549 1.00 90.98 11 A 1 ATOM 96 C CD2 . PHE A 1 11 ? 3.625 -3.073 -1.843 1.00 91.21 11 A 1 ATOM 97 C CE1 . PHE A 1 11 ? 5.804 -3.044 -3.549 1.00 90.27 11 A 1 ATOM 98 C CE2 . PHE A 1 11 ? 4.524 -4.128 -1.839 1.00 90.02 11 A 1 ATOM 99 C CZ . PHE A 1 11 ? 5.615 -4.117 -2.692 1.00 89.50 11 A 1 ATOM 100 N N . ALA A 1 12 ? 2.412 2.209 -3.210 1.00 97.20 12 A 1 ATOM 101 C CA . ALA A 1 12 ? 2.429 3.354 -4.113 1.00 96.98 12 A 1 ATOM 102 C C . ALA A 1 12 ? 3.205 4.516 -3.505 1.00 97.21 12 A 1 ATOM 103 O O . ALA A 1 12 ? 3.993 5.172 -4.189 1.00 96.36 12 A 1 ATOM 104 C CB . ALA A 1 12 ? 1.002 3.782 -4.431 1.00 96.22 12 A 1 ATOM 105 N N . ALA A 1 13 ? 2.984 4.765 -2.224 1.00 97.15 13 A 1 ATOM 106 C CA . ALA A 1 13 ? 3.665 5.850 -1.529 1.00 96.78 13 A 1 ATOM 107 C C . ALA A 1 13 ? 5.164 5.598 -1.441 1.00 96.89 13 A 1 ATOM 108 O O . ALA A 1 13 ? 5.968 6.514 -1.608 1.00 95.82 13 A 1 ATOM 109 C CB . ALA A 1 13 ? 3.081 6.017 -0.133 1.00 95.89 13 A 1 ATOM 110 N N . ALA A 1 14 ? 5.540 4.357 -1.168 1.00 97.54 14 A 1 ATOM 111 C CA . ALA A 1 14 ? 6.949 3.987 -1.064 1.00 97.31 14 A 1 ATOM 112 C C . ALA A 1 14 ? 7.656 4.106 -2.410 1.00 97.53 14 A 1 ATOM 113 O O . ALA A 1 14 ? 8.818 4.508 -2.473 1.00 96.17 14 A 1 ATOM 114 C CB . ALA A 1 14 ? 7.070 2.566 -0.528 1.00 96.28 14 A 1 ATOM 115 N N . SER A 1 15 ? 6.961 3.764 -3.473 1.00 97.34 15 A 1 ATOM 116 C CA . SER A 1 15 ? 7.516 3.819 -4.820 1.00 97.18 15 A 1 ATOM 117 C C . SER A 1 15 ? 7.693 5.255 -5.295 1.00 96.95 15 A 1 ATOM 118 O O . SER A 1 15 ? 8.694 5.593 -5.932 1.00 94.12 15 A 1 ATOM 119 C CB . SER A 1 15 ? 6.616 3.059 -5.791 1.00 95.62 15 A 1 ATOM 120 O OG . SER A 1 15 ? 7.245 2.911 -7.036 1.00 85.91 15 A 1 ATOM 121 N N . VAL A 1 16 ? 6.726 6.102 -4.988 1.00 96.18 16 A 1 ATOM 122 C CA . VAL A 1 16 ? 6.766 7.507 -5.391 1.00 95.34 16 A 1 ATOM 123 C C . VAL A 1 16 ? 7.730 8.307 -4.523 1.00 95.51 16 A 1 ATOM 124 O O . VAL A 1 16 ? 8.430 9.199 -5.011 1.00 92.27 16 A 1 ATOM 125 C CB . VAL A 1 16 ? 5.360 8.131 -5.328 1.00 92.86 16 A 1 ATOM 126 C CG1 . VAL A 1 16 ? 5.412 9.619 -5.641 1.00 85.48 16 A 1 ATOM 127 C CG2 . VAL A 1 16 ? 4.427 7.432 -6.300 1.00 86.52 16 A 1 ATOM 128 N N . SER A 1 17 ? 7.758 7.995 -3.238 1.00 94.17 17 A 1 ATOM 129 C CA . SER A 1 17 ? 8.625 8.695 -2.295 1.00 93.60 17 A 1 ATOM 130 C C . SER A 1 17 ? 10.094 8.380 -2.544 1.00 93.23 17 A 1 ATOM 131 O O . SER A 1 17 ? 10.967 9.216 -2.300 1.00 88.19 17 A 1 ATOM 132 C CB . SER A 1 17 ? 8.252 8.328 -0.859 1.00 90.56 17 A 1 ATOM 133 O OG . SER A 1 17 ? 7.024 8.928 -0.493 1.00 78.89 17 A 1 ATOM 134 N N . ALA A 1 18 ? 10.364 7.176 -3.008 1.00 91.99 18 A 1 ATOM 135 C CA . ALA A 1 18 ? 11.731 6.732 -3.275 1.00 90.07 18 A 1 ATOM 136 C C . ALA A 1 18 ? 12.217 7.285 -4.609 1.00 88.80 18 A 1 ATOM 137 O O . ALA A 1 18 ? 13.293 7.913 -4.642 1.00 83.03 18 A 1 ATOM 138 C CB . ALA A 1 18 ? 11.797 5.210 -3.267 1.00 85.03 18 A 1 ATOM 139 O OXT . ALA A 1 18 ? 11.546 7.057 -5.618 1.00 76.50 18 A 1 #