# 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_325 # _entry.id 325 # 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" "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" "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" "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 ALA 2 1 n LEU 3 1 n THR 4 1 n PHE 5 1 n ALA 6 1 n LEU 7 1 n LEU 8 1 n VAL 9 1 n ALA 10 1 n LEU 11 1 n LEU 12 1 n VAL 13 1 n LEU 14 1 n SER 15 1 n CYS 16 1 n LYS 17 1 n SER 18 1 n SER 19 1 n CYS 20 1 n SER 21 1 n VAL 22 1 n GLY 23 # _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 @ 2025-06-02 04:30:15)" _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 93.11 _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 92.54 1 1 A ALA 2 2 98.01 1 2 A LEU 3 2 95.84 1 3 A THR 4 2 97.12 1 4 A PHE 5 2 96.20 1 5 A ALA 6 2 98.46 1 6 A LEU 7 2 95.58 1 7 A LEU 8 2 95.08 1 8 A VAL 9 2 96.72 1 9 A ALA 10 2 97.43 1 10 A LEU 11 2 94.15 1 11 A LEU 12 2 94.52 1 12 A VAL 13 2 96.44 1 13 A LEU 14 2 94.11 1 14 A SER 15 2 96.10 1 15 A CYS 16 2 94.64 1 16 A LYS 17 2 87.76 1 17 A SER 18 2 93.00 1 18 A SER 19 2 92.34 1 19 A CYS 20 2 89.83 1 20 A SER 21 2 88.15 1 21 A VAL 22 2 82.92 1 22 A GLY 23 2 69.63 1 23 # _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 ALA . 2 A 2 A 3 1 n LEU . 3 A 3 A 4 1 n THR . 4 A 4 A 5 1 n PHE . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n CYS . 16 A 16 A 17 1 n LYS . 17 A 17 A 18 1 n SER . 18 A 18 A 19 1 n SER . 19 A 19 A 20 1 n CYS . 20 A 20 A 21 1 n SER . 21 A 21 A 22 1 n VAL . 22 A 22 A 23 1 n GLY . 23 A 23 # _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 ? -13.919 -4.639 2.478 1.00 97.91 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.777 -4.630 3.407 1.00 98.06 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.454 -4.599 2.647 1.00 98.29 1 A 1 ATOM 4 O O . MET A 1 1 ? -10.482 -4.008 3.101 1.00 97.84 1 A 1 ATOM 5 C CB . MET A 1 1 ? -12.827 -5.861 4.315 1.00 96.55 1 A 1 ATOM 6 C CG . MET A 1 1 ? -11.887 -5.742 5.496 1.00 90.03 1 A 1 ATOM 7 S SD . MET A 1 1 ? -12.083 -7.100 6.641 1.00 86.20 1 A 1 ATOM 8 C CE . MET A 1 1 ? -12.442 -6.187 8.139 1.00 75.41 1 A 1 ATOM 9 N N . ALA A 1 2 ? -11.428 -5.243 1.495 1.00 97.97 2 A 1 ATOM 10 C CA . ALA A 1 2 ? -10.219 -5.272 0.673 1.00 98.18 2 A 1 ATOM 11 C C . ALA A 1 2 ? -9.811 -3.869 0.231 1.00 98.41 2 A 1 ATOM 12 O O . ALA A 1 2 ? -8.635 -3.505 0.289 1.00 97.86 2 A 1 ATOM 13 C CB . ALA A 1 2 ? -10.434 -6.164 -0.546 1.00 97.61 2 A 1 ATOM 14 N N . LEU A 1 3 ? -10.786 -3.079 -0.205 1.00 98.54 3 A 1 ATOM 15 C CA . LEU A 1 3 ? -10.509 -1.717 -0.658 1.00 98.45 3 A 1 ATOM 16 C C . LEU A 1 3 ? -10.003 -0.860 0.495 1.00 98.60 3 A 1 ATOM 17 O O . LEU A 1 3 ? -9.061 -0.078 0.340 1.00 98.33 3 A 1 ATOM 18 C CB . LEU A 1 3 ? -11.773 -1.099 -1.260 1.00 98.19 3 A 1 ATOM 19 C CG . LEU A 1 3 ? -12.257 -1.781 -2.539 1.00 93.89 3 A 1 ATOM 20 C CD1 . LEU A 1 3 ? -13.586 -1.180 -2.979 1.00 90.37 3 A 1 ATOM 21 C CD2 . LEU A 1 3 ? -11.227 -1.640 -3.651 1.00 90.34 3 A 1 ATOM 22 N N . THR A 1 4 ? -10.616 -1.017 1.656 1.00 98.36 4 A 1 ATOM 23 C CA . THR A 1 4 ? -10.210 -0.265 2.840 1.00 98.42 4 A 1 ATOM 24 C C . THR A 1 4 ? -8.786 -0.637 3.243 1.00 98.57 4 A 1 ATOM 25 O O . THR A 1 4 ? -7.974 0.224 3.583 1.00 98.31 4 A 1 ATOM 26 C CB . THR A 1 4 ? -11.153 -0.546 4.009 1.00 98.04 4 A 1 ATOM 27 O OG1 . THR A 1 4 ? -12.502 -0.307 3.617 1.00 94.14 4 A 1 ATOM 28 C CG2 . THR A 1 4 ? -10.810 0.363 5.183 1.00 94.03 4 A 1 ATOM 29 N N . PHE A 1 5 ? -8.479 -1.933 3.189 1.00 98.49 5 A 1 ATOM 30 C CA . PHE A 1 5 ? -7.143 -2.418 3.530 1.00 98.41 5 A 1 ATOM 31 C C . PHE A 1 5 ? -6.112 -1.841 2.567 1.00 98.50 5 A 1 ATOM 32 O O . PHE A 1 5 ? -5.035 -1.406 2.976 1.00 98.18 5 A 1 ATOM 33 C CB . PHE A 1 5 ? -7.111 -3.944 3.472 1.00 98.19 5 A 1 ATOM 34 C CG . PHE A 1 5 ? -5.761 -4.500 3.839 1.00 96.70 5 A 1 ATOM 35 C CD1 . PHE A 1 5 ? -5.313 -4.455 5.152 1.00 94.81 5 A 1 ATOM 36 C CD2 . PHE A 1 5 ? -4.948 -5.063 2.869 1.00 94.76 5 A 1 ATOM 37 C CE1 . PHE A 1 5 ? -4.067 -4.963 5.493 1.00 93.37 5 A 1 ATOM 38 C CE2 . PHE A 1 5 ? -3.698 -5.573 3.204 1.00 93.23 5 A 1 ATOM 39 C CZ . PHE A 1 5 ? -3.257 -5.521 4.516 1.00 93.53 5 A 1 ATOM 40 N N . ALA A 1 6 ? -6.452 -1.838 1.286 1.00 98.59 6 A 1 ATOM 41 C CA . ALA A 1 6 ? -5.557 -1.303 0.262 1.00 98.50 6 A 1 ATOM 42 C C . ALA A 1 6 ? -5.266 0.176 0.511 1.00 98.56 6 A 1 ATOM 43 O O . ALA A 1 6 ? -4.142 0.638 0.297 1.00 98.26 6 A 1 ATOM 44 C CB . ALA A 1 6 ? -6.181 -1.492 -1.118 1.00 98.38 6 A 1 ATOM 45 N N . LEU A 1 7 ? -6.270 0.901 0.969 1.00 98.32 7 A 1 ATOM 46 C CA . LEU A 1 7 ? -6.115 2.323 1.265 1.00 98.18 7 A 1 ATOM 47 C C . LEU A 1 7 ? -5.107 2.533 2.391 1.00 98.29 7 A 1 ATOM 48 O O . LEU A 1 7 ? -4.248 3.413 2.315 1.00 98.08 7 A 1 ATOM 49 C CB . LEU A 1 7 ? -7.468 2.921 1.652 1.00 98.08 7 A 1 ATOM 50 C CG . LEU A 1 7 ? -7.422 4.425 1.921 1.00 92.40 7 A 1 ATOM 51 C CD1 . LEU A 1 7 ? -7.056 5.184 0.653 1.00 90.07 7 A 1 ATOM 52 C CD2 . LEU A 1 7 ? -8.762 4.908 2.447 1.00 91.18 7 A 1 ATOM 53 N N . LEU A 1 8 ? -5.214 1.719 3.431 1.00 98.06 8 A 1 ATOM 54 C CA . LEU A 1 8 ? -4.308 1.816 4.574 1.00 97.76 8 A 1 ATOM 55 C C . LEU A 1 8 ? -2.881 1.475 4.156 1.00 97.90 8 A 1 ATOM 56 O O . LEU A 1 8 ? -1.924 2.146 4.553 1.00 97.72 8 A 1 ATOM 57 C CB . LEU A 1 8 ? -4.770 0.862 5.680 1.00 97.62 8 A 1 ATOM 58 C CG . LEU A 1 8 ? -6.113 1.245 6.303 1.00 92.19 8 A 1 ATOM 59 C CD1 . LEU A 1 8 ? -6.580 0.158 7.261 1.00 89.17 8 A 1 ATOM 60 C CD2 . LEU A 1 8 ? -6.008 2.576 7.041 1.00 90.18 8 A 1 ATOM 61 N N . VAL A 1 9 ? -2.738 0.425 3.354 1.00 98.00 9 A 1 ATOM 62 C CA . VAL A 1 9 ? -1.423 0.002 2.871 1.00 97.64 9 A 1 ATOM 63 C C . VAL A 1 9 ? -0.804 1.092 2.002 1.00 97.61 9 A 1 ATOM 64 O O . VAL A 1 9 ? 0.383 1.404 2.125 1.00 97.23 9 A 1 ATOM 65 C CB . VAL A 1 9 ? -1.525 -1.305 2.068 1.00 97.10 9 A 1 ATOM 66 C CG1 . VAL A 1 9 ? -0.179 -1.668 1.445 1.00 94.62 9 A 1 ATOM 67 C CG2 . VAL A 1 9 ? -1.996 -2.434 2.974 1.00 94.85 9 A 1 ATOM 68 N N . ALA A 1 10 ? -1.616 1.669 1.128 1.00 97.73 10 A 1 ATOM 69 C CA . ALA A 1 10 ? -1.146 2.727 0.238 1.00 97.50 10 A 1 ATOM 70 C C . ALA A 1 10 ? -0.625 3.917 1.041 1.00 97.60 10 A 1 ATOM 71 O O . ALA A 1 10 ? 0.404 4.502 0.700 1.00 97.02 10 A 1 ATOM 72 C CB . ALA A 1 10 ? -2.280 3.170 -0.684 1.00 97.32 10 A 1 ATOM 73 N N . LEU A 1 11 ? -1.329 4.257 2.103 1.00 97.79 11 A 1 ATOM 74 C CA . LEU A 1 11 ? -0.927 5.368 2.962 1.00 97.54 11 A 1 ATOM 75 C C . LEU A 1 11 ? 0.417 5.076 3.619 1.00 97.57 11 A 1 ATOM 76 O O . LEU A 1 11 ? 1.281 5.948 3.713 1.00 97.01 11 A 1 ATOM 77 C CB . LEU A 1 11 ? -1.994 5.611 4.034 1.00 97.41 11 A 1 ATOM 78 C CG . LEU A 1 11 ? -1.708 6.826 4.921 1.00 90.41 11 A 1 ATOM 79 C CD1 . LEU A 1 11 ? -1.753 8.110 4.097 1.00 87.12 11 A 1 ATOM 80 C CD2 . LEU A 1 11 ? -2.722 6.906 6.055 1.00 88.33 11 A 1 ATOM 81 N N . LEU A 1 12 ? 0.591 3.844 4.076 1.00 97.73 12 A 1 ATOM 82 C CA . LEU A 1 12 ? 1.834 3.424 4.722 1.00 97.33 12 A 1 ATOM 83 C C . LEU A 1 12 ? 2.999 3.497 3.741 1.00 97.51 12 A 1 ATOM 84 O O . LEU A 1 12 ? 4.077 3.991 4.074 1.00 97.09 12 A 1 ATOM 85 C CB . LEU A 1 12 ? 1.691 1.996 5.251 1.00 97.09 12 A 1 ATOM 86 C CG . LEU A 1 12 ? 2.933 1.472 5.983 1.00 91.71 12 A 1 ATOM 87 C CD1 . LEU A 1 12 ? 3.196 2.287 7.248 1.00 88.09 12 A 1 ATOM 88 C CD2 . LEU A 1 12 ? 2.759 0.004 6.341 1.00 89.58 12 A 1 ATOM 89 N N . VAL A 1 13 ? 2.783 2.999 2.532 1.00 97.58 13 A 1 ATOM 90 C CA . VAL A 1 13 ? 3.816 3.004 1.498 1.00 97.33 13 A 1 ATOM 91 C C . VAL A 1 13 ? 4.224 4.432 1.150 1.00 97.29 13 A 1 ATOM 92 O O . VAL A 1 13 ? 5.414 4.739 1.042 1.00 96.55 13 A 1 ATOM 93 C CB . VAL A 1 13 ? 3.321 2.284 0.235 1.00 96.90 13 A 1 ATOM 94 C CG1 . VAL A 1 13 ? 4.337 2.416 -0.892 1.00 94.49 13 A 1 ATOM 95 C CG2 . VAL A 1 13 ? 3.074 0.813 0.539 1.00 94.95 13 A 1 ATOM 96 N N . LEU A 1 14 ? 3.239 5.298 0.989 1.00 97.58 14 A 1 ATOM 97 C CA . LEU A 1 14 ? 3.509 6.694 0.659 1.00 97.25 14 A 1 ATOM 98 C C . LEU A 1 14 ? 4.232 7.395 1.799 1.00 97.44 14 A 1 ATOM 99 O O . LEU A 1 14 ? 5.084 8.254 1.563 1.00 96.74 14 A 1 ATOM 100 C CB . LEU A 1 14 ? 2.190 7.413 0.366 1.00 97.06 14 A 1 ATOM 101 C CG . LEU A 1 14 ? 1.507 6.949 -0.917 1.00 91.62 14 A 1 ATOM 102 C CD1 . LEU A 1 14 ? 0.117 7.557 -1.017 1.00 86.71 14 A 1 ATOM 103 C CD2 . LEU A 1 14 ? 2.338 7.334 -2.134 1.00 88.48 14 A 1 ATOM 104 N N . SER A 1 15 ? 3.896 7.026 3.024 1.00 97.79 15 A 1 ATOM 105 C CA . SER A 1 15 ? 4.505 7.623 4.209 1.00 97.57 15 A 1 ATOM 106 C C . SER A 1 15 ? 5.998 7.303 4.284 1.00 97.79 15 A 1 ATOM 107 O O . SER A 1 15 ? 6.816 8.179 4.565 1.00 97.04 15 A 1 ATOM 108 C CB . SER A 1 15 ? 3.801 7.120 5.471 1.00 96.98 15 A 1 ATOM 109 O OG . SER A 1 15 ? 4.364 7.715 6.623 1.00 89.40 15 A 1 ATOM 110 N N . CYS A 1 16 ? 6.360 6.052 4.030 1.00 96.56 16 A 1 ATOM 111 C CA . CYS A 1 16 ? 7.763 5.636 4.102 1.00 96.55 16 A 1 ATOM 112 C C . CYS A 1 16 ? 8.373 5.438 2.717 1.00 97.05 16 A 1 ATOM 113 O O . CYS A 1 16 ? 9.404 4.783 2.574 1.00 95.52 16 A 1 ATOM 114 C CB . CYS A 1 16 ? 7.877 4.345 4.919 1.00 95.19 16 A 1 ATOM 115 S SG . CYS A 1 16 ? 7.493 2.845 3.997 1.00 86.99 16 A 1 ATOM 116 N N . LYS A 1 17 ? 7.743 6.003 1.711 1.00 95.84 17 A 1 ATOM 117 C CA . LYS A 1 17 ? 8.209 5.841 0.334 1.00 95.51 17 A 1 ATOM 118 C C . LYS A 1 17 ? 9.661 6.272 0.182 1.00 95.07 17 A 1 ATOM 119 O O . LYS A 1 17 ? 10.462 5.568 -0.438 1.00 93.50 17 A 1 ATOM 120 C CB . LYS A 1 17 ? 7.323 6.654 -0.606 1.00 94.68 17 A 1 ATOM 121 C CG . LYS A 1 17 ? 7.650 6.393 -2.063 1.00 86.67 17 A 1 ATOM 122 C CD . LYS A 1 17 ? 6.706 7.154 -2.973 1.00 82.38 17 A 1 ATOM 123 C CE . LYS A 1 17 ? 7.030 6.872 -4.437 1.00 77.58 17 A 1 ATOM 124 N NZ . LYS A 1 17 ? 6.116 7.619 -5.336 1.00 68.61 17 A 1 ATOM 125 N N . SER A 1 18 ? 10.003 7.409 0.744 1.00 96.83 18 A 1 ATOM 126 C CA . SER A 1 18 ? 11.366 7.928 0.655 1.00 96.13 18 A 1 ATOM 127 C C . SER A 1 18 ? 12.335 7.135 1.518 1.00 96.15 18 A 1 ATOM 128 O O . SER A 1 18 ? 13.479 6.903 1.126 1.00 93.78 18 A 1 ATOM 129 C CB . SER A 1 18 ? 11.396 9.392 1.083 1.00 94.65 18 A 1 ATOM 130 O OG . SER A 1 18 ? 10.956 9.520 2.416 1.00 80.46 18 A 1 ATOM 131 N N . SER A 1 19 ? 11.886 6.724 2.703 1.00 95.32 19 A 1 ATOM 132 C CA . SER A 1 19 ? 12.729 5.970 3.633 1.00 95.26 19 A 1 ATOM 133 C C . SER A 1 19 ? 12.820 4.497 3.245 1.00 95.52 19 A 1 ATOM 134 O O . SER A 1 19 ? 13.884 3.886 3.325 1.00 92.16 19 A 1 ATOM 135 C CB . SER A 1 19 ? 12.187 6.076 5.059 1.00 93.96 19 A 1 ATOM 136 O OG . SER A 1 19 ? 12.166 7.418 5.497 1.00 81.83 19 A 1 ATOM 137 N N . CYS A 1 20 ? 11.692 3.924 2.828 1.00 92.28 20 A 1 ATOM 138 C CA . CYS A 1 20 ? 11.646 2.513 2.451 1.00 92.16 20 A 1 ATOM 139 C C . CYS A 1 20 ? 12.283 2.267 1.083 1.00 93.54 20 A 1 ATOM 140 O O . CYS A 1 20 ? 12.622 1.135 0.754 1.00 89.58 20 A 1 ATOM 141 C CB . CYS A 1 20 ? 10.198 2.009 2.449 1.00 89.37 20 A 1 ATOM 142 S SG . CYS A 1 20 ? 9.476 1.862 4.101 1.00 82.08 20 A 1 ATOM 143 N N . SER A 1 21 ? 12.449 3.334 0.308 1.00 90.39 21 A 1 ATOM 144 C CA . SER A 1 21 ? 13.044 3.238 -1.026 1.00 91.66 21 A 1 ATOM 145 C C . SER A 1 21 ? 12.235 2.326 -1.940 1.00 92.42 21 A 1 ATOM 146 O O . SER A 1 21 ? 12.502 1.127 -2.032 1.00 88.34 21 A 1 ATOM 147 C CB . SER A 1 21 ? 14.477 2.724 -0.926 1.00 88.94 21 A 1 ATOM 148 O OG . SER A 1 21 ? 15.085 2.720 -2.202 1.00 77.12 21 A 1 ATOM 149 N N . VAL A 1 22 ? 11.238 2.901 -2.603 1.00 88.08 22 A 1 ATOM 150 C CA . VAL A 1 22 ? 10.379 2.123 -3.498 1.00 87.60 22 A 1 ATOM 151 C C . VAL A 1 22 ? 10.822 2.299 -4.946 1.00 88.01 22 A 1 ATOM 152 O O . VAL A 1 22 ? 11.143 1.330 -5.632 1.00 82.25 22 A 1 ATOM 153 C CB . VAL A 1 22 ? 8.911 2.540 -3.345 1.00 84.27 22 A 1 ATOM 154 C CG1 . VAL A 1 22 ? 8.035 1.745 -4.306 1.00 74.38 22 A 1 ATOM 155 C CG2 . VAL A 1 22 ? 8.450 2.341 -1.919 1.00 75.83 22 A 1 ATOM 156 N N . GLY A 1 23 ? 10.844 3.533 -5.386 1.00 79.65 23 A 1 ATOM 157 C CA . GLY A 1 23 ? 11.248 3.806 -6.755 1.00 73.55 23 A 1 ATOM 158 C C . GLY A 1 23 ? 10.374 4.863 -7.400 1.00 68.20 23 A 1 ATOM 159 O O . GLY A 1 23 ? 9.149 4.773 -7.295 1.00 61.79 23 A 1 ATOM 160 O OXT . GLY A 1 23 ? 10.916 5.780 -8.048 1.00 64.98 23 A 1 #