# 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_spkb07905 # _entry.id spkb07905 # 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" "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 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" "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" "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 ARG 3 1 n ARG 4 1 n ILE 5 1 n SER 6 1 n PRO 7 1 n VAL 8 1 n VAL 9 1 n ALA 10 1 n PHE 11 1 n LEU 12 1 n LEU 13 1 n CYS 14 1 n PHE 15 1 n GLY 16 1 n LEU 17 1 n SER 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 @ 2025-07-04 16:38:22)" _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 93.62 _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 84.55 1 1 A ALA 2 2 90.14 1 2 A ARG 3 2 84.88 1 3 A ARG 4 2 86.87 1 4 A ILE 5 2 93.98 1 5 A SER 6 2 95.66 1 6 A PRO 7 2 97.59 1 7 A VAL 8 2 97.66 1 8 A VAL 9 2 97.80 1 9 A ALA 10 2 98.26 1 10 A PHE 11 2 96.23 1 11 A LEU 12 2 97.48 1 12 A LEU 13 2 97.09 1 13 A CYS 14 2 97.75 1 14 A PHE 15 2 95.93 1 15 A GLY 16 2 98.04 1 16 A LEU 17 2 95.78 1 17 A SER 18 2 88.53 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 ALA . 2 A 2 A 3 1 n ARG . 3 A 3 A 4 1 n ARG . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n SER . 6 A 6 A 7 1 n PRO . 7 A 7 A 8 1 n VAL . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n PHE . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n CYS . 14 A 14 A 15 1 n PHE . 15 A 15 A 16 1 n GLY . 16 A 16 A 17 1 n LEU . 17 A 17 A 18 1 n SER . 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 ? -4.475 -0.214 18.963 1.00 89.03 1 A 1 ATOM 2 C CA . MET A 1 1 ? -4.385 -0.777 17.601 1.00 90.84 1 A 1 ATOM 3 C C . MET A 1 1 ? -2.968 -0.615 17.055 1.00 91.27 1 A 1 ATOM 4 O O . MET A 1 1 ? -2.347 0.422 17.283 1.00 89.03 1 A 1 ATOM 5 C CB . MET A 1 1 ? -5.375 -0.078 16.676 1.00 86.62 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.813 -0.189 17.195 1.00 81.74 1 A 1 ATOM 7 S SD . MET A 1 1 ? -7.401 -1.875 17.157 1.00 78.68 1 A 1 ATOM 8 C CE . MET A 1 1 ? -8.964 -1.695 18.005 1.00 69.22 1 A 1 ATOM 9 N N . ALA A 1 2 ? -2.477 -1.609 16.347 1.00 88.02 2 A 1 ATOM 10 C CA . ALA A 1 2 ? -1.098 -1.598 15.842 1.00 91.61 2 A 1 ATOM 11 C C . ALA A 1 2 ? -0.908 -0.688 14.624 1.00 93.11 2 A 1 ATOM 12 O O . ALA A 1 2 ? 0.223 -0.449 14.208 1.00 89.82 2 A 1 ATOM 13 C CB . ALA A 1 2 ? -0.684 -3.018 15.509 1.00 88.14 2 A 1 ATOM 14 N N . ARG A 1 3 ? -2.002 -0.195 14.062 1.00 95.20 3 A 1 ATOM 15 C CA . ARG A 1 3 ? -1.951 0.665 12.872 1.00 95.32 3 A 1 ATOM 16 C C . ARG A 1 3 ? -1.154 0.007 11.744 1.00 96.16 3 A 1 ATOM 17 O O . ARG A 1 3 ? -0.109 0.506 11.330 1.00 93.31 3 A 1 ATOM 18 C CB . ARG A 1 3 ? -1.366 2.031 13.231 1.00 92.95 3 A 1 ATOM 19 C CG . ARG A 1 3 ? -2.438 3.065 13.493 1.00 84.33 3 A 1 ATOM 20 C CD . ARG A 1 3 ? -1.839 4.460 13.531 1.00 83.47 3 A 1 ATOM 21 N NE . ARG A 1 3 ? -2.210 5.152 14.766 1.00 77.81 3 A 1 ATOM 22 C CZ . ARG A 1 3 ? -1.600 6.229 15.218 1.00 75.61 3 A 1 ATOM 23 N NH1 . ARG A 1 3 ? -0.598 6.793 14.562 1.00 70.14 3 A 1 ATOM 24 N NH2 . ARG A 1 3 ? -1.986 6.759 16.355 1.00 69.36 3 A 1 ATOM 25 N N . ARG A 1 4 ? -1.664 -1.094 11.271 1.00 95.76 4 A 1 ATOM 26 C CA . ARG A 1 4 ? -1.001 -1.813 10.182 1.00 96.50 4 A 1 ATOM 27 C C . ARG A 1 4 ? -1.475 -1.270 8.842 1.00 97.21 4 A 1 ATOM 28 O O . ARG A 1 4 ? -2.588 -1.553 8.417 1.00 95.37 4 A 1 ATOM 29 C CB . ARG A 1 4 ? -1.288 -3.303 10.292 1.00 95.06 4 A 1 ATOM 30 C CG . ARG A 1 4 ? -0.438 -3.971 11.345 1.00 87.71 4 A 1 ATOM 31 C CD . ARG A 1 4 ? 0.789 -4.626 10.722 1.00 86.04 4 A 1 ATOM 32 N NE . ARG A 1 4 ? 1.036 -5.912 11.363 1.00 79.76 4 A 1 ATOM 33 C CZ . ARG A 1 4 ? 1.866 -6.835 10.923 1.00 78.50 4 A 1 ATOM 34 N NH1 . ARG A 1 4 ? 2.619 -6.637 9.862 1.00 71.58 4 A 1 ATOM 35 N NH2 . ARG A 1 4 ? 1.943 -7.981 11.553 1.00 72.13 4 A 1 ATOM 36 N N . ILE A 1 5 ? -0.641 -0.508 8.181 1.00 97.24 5 A 1 ATOM 37 C CA . ILE A 1 5 ? -0.960 0.029 6.864 1.00 97.10 5 A 1 ATOM 38 C C . ILE A 1 5 ? -0.795 -1.079 5.828 1.00 97.51 5 A 1 ATOM 39 O O . ILE A 1 5 ? 0.223 -1.759 5.800 1.00 96.93 5 A 1 ATOM 40 C CB . ILE A 1 5 ? -0.063 1.222 6.532 1.00 96.42 5 A 1 ATOM 41 C CG1 . ILE A 1 5 ? -0.211 2.318 7.596 1.00 91.02 5 A 1 ATOM 42 C CG2 . ILE A 1 5 ? -0.423 1.778 5.153 1.00 91.04 5 A 1 ATOM 43 C CD1 . ILE A 1 5 ? 0.862 3.386 7.497 1.00 84.58 5 A 1 ATOM 44 N N . SER A 1 6 ? -1.796 -1.235 4.993 1.00 97.67 6 A 1 ATOM 45 C CA . SER A 1 6 ? -1.756 -2.265 3.963 1.00 97.60 6 A 1 ATOM 46 C C . SER A 1 6 ? -0.613 -2.003 2.977 1.00 97.97 6 A 1 ATOM 47 O O . SER A 1 6 ? -0.340 -0.852 2.639 1.00 97.67 6 A 1 ATOM 48 C CB . SER A 1 6 ? -3.086 -2.320 3.220 1.00 96.49 6 A 1 ATOM 49 O OG . SER A 1 6 ? -4.027 -3.078 3.944 1.00 86.55 6 A 1 ATOM 50 N N . PRO A 1 7 ? 0.042 -3.061 2.505 1.00 97.89 7 A 1 ATOM 51 C CA . PRO A 1 7 ? 1.136 -2.908 1.536 1.00 97.99 7 A 1 ATOM 52 C C . PRO A 1 7 ? 0.658 -2.265 0.238 1.00 98.27 7 A 1 ATOM 53 O O . PRO A 1 7 ? 1.410 -1.544 -0.418 1.00 97.96 7 A 1 ATOM 54 C CB . PRO A 1 7 ? 1.620 -4.344 1.304 1.00 97.42 7 A 1 ATOM 55 C CG . PRO A 1 7 ? 0.488 -5.217 1.736 1.00 96.22 7 A 1 ATOM 56 C CD . PRO A 1 7 ? -0.210 -4.460 2.831 1.00 97.37 7 A 1 ATOM 57 N N . VAL A 1 8 ? -0.591 -2.508 -0.110 1.00 98.24 8 A 1 ATOM 58 C CA . VAL A 1 8 ? -1.190 -1.931 -1.313 1.00 98.38 8 A 1 ATOM 59 C C . VAL A 1 8 ? -1.254 -0.408 -1.201 1.00 98.53 8 A 1 ATOM 60 O O . VAL A 1 8 ? -0.987 0.311 -2.164 1.00 98.28 8 A 1 ATOM 61 C CB . VAL A 1 8 ? -2.595 -2.511 -1.544 1.00 98.07 8 A 1 ATOM 62 C CG1 . VAL A 1 8 ? -3.220 -1.940 -2.806 1.00 96.01 8 A 1 ATOM 63 C CG2 . VAL A 1 8 ? -2.539 -4.028 -1.633 1.00 96.14 8 A 1 ATOM 64 N N . VAL A 1 9 ? -1.586 0.065 -0.022 1.00 98.44 9 A 1 ATOM 65 C CA . VAL A 1 9 ? -1.661 1.506 0.226 1.00 98.42 9 A 1 ATOM 66 C C . VAL A 1 9 ? -0.276 2.131 0.093 1.00 98.48 9 A 1 ATOM 67 O O . VAL A 1 9 ? -0.125 3.216 -0.471 1.00 98.27 9 A 1 ATOM 68 C CB . VAL A 1 9 ? -2.253 1.789 1.616 1.00 98.14 9 A 1 ATOM 69 C CG1 . VAL A 1 9 ? -2.266 3.282 1.915 1.00 96.31 9 A 1 ATOM 70 C CG2 . VAL A 1 9 ? -3.665 1.234 1.707 1.00 96.56 9 A 1 ATOM 71 N N . ALA A 1 10 ? 0.725 1.448 0.597 1.00 98.37 10 A 1 ATOM 72 C CA . ALA A 1 10 ? 2.104 1.920 0.484 1.00 98.32 10 A 1 ATOM 73 C C . ALA A 1 10 ? 2.533 2.000 -0.980 1.00 98.45 10 A 1 ATOM 74 O O . ALA A 1 10 ? 3.212 2.943 -1.385 1.00 98.16 10 A 1 ATOM 75 C CB . ALA A 1 10 ? 3.024 0.988 1.259 1.00 98.01 10 A 1 ATOM 76 N N . PHE A 1 11 ? 2.111 1.021 -1.761 1.00 98.19 11 A 1 ATOM 77 C CA . PHE A 1 11 ? 2.415 0.987 -3.189 1.00 98.18 11 A 1 ATOM 78 C C . PHE A 1 11 ? 1.781 2.185 -3.896 1.00 98.39 11 A 1 ATOM 79 O O . PHE A 1 11 ? 2.428 2.864 -4.696 1.00 98.06 11 A 1 ATOM 80 C CB . PHE A 1 11 ? 1.892 -0.318 -3.786 1.00 97.92 11 A 1 ATOM 81 C CG . PHE A 1 11 ? 2.839 -0.923 -4.794 1.00 96.55 11 A 1 ATOM 82 C CD1 . PHE A 1 11 ? 3.272 -0.198 -5.891 1.00 94.94 11 A 1 ATOM 83 C CD2 . PHE A 1 11 ? 3.283 -2.229 -4.636 1.00 94.68 11 A 1 ATOM 84 C CE1 . PHE A 1 11 ? 4.142 -0.757 -6.816 1.00 93.59 11 A 1 ATOM 85 C CE2 . PHE A 1 11 ? 4.149 -2.798 -5.563 1.00 93.50 11 A 1 ATOM 86 C CZ . PHE A 1 11 ? 4.577 -2.059 -6.652 1.00 94.55 11 A 1 ATOM 87 N N . LEU A 1 12 ? 0.526 2.440 -3.572 1.00 98.53 12 A 1 ATOM 88 C CA . LEU A 1 12 ? -0.196 3.568 -4.157 1.00 98.54 12 A 1 ATOM 89 C C . LEU A 1 12 ? 0.454 4.891 -3.773 1.00 98.60 12 A 1 ATOM 90 O O . LEU A 1 12 ? 0.540 5.806 -4.595 1.00 98.33 12 A 1 ATOM 91 C CB . LEU A 1 12 ? -1.650 3.533 -3.687 1.00 98.39 12 A 1 ATOM 92 C CG . LEU A 1 12 ? -2.512 2.536 -4.454 1.00 97.04 12 A 1 ATOM 93 C CD1 . LEU A 1 12 ? -3.770 2.204 -3.666 1.00 95.16 12 A 1 ATOM 94 C CD2 . LEU A 1 12 ? -2.893 3.106 -5.816 1.00 95.25 12 A 1 ATOM 95 N N . LEU A 1 13 ? 0.919 4.982 -2.541 1.00 98.58 13 A 1 ATOM 96 C CA . LEU A 1 13 ? 1.596 6.183 -2.070 1.00 98.47 13 A 1 ATOM 97 C C . LEU A 1 13 ? 2.886 6.416 -2.844 1.00 98.52 13 A 1 ATOM 98 O O . LEU A 1 13 ? 3.180 7.545 -3.241 1.00 98.13 13 A 1 ATOM 99 C CB . LEU A 1 13 ? 1.886 6.046 -0.576 1.00 98.23 13 A 1 ATOM 100 C CG . LEU A 1 13 ? 0.702 6.445 0.302 1.00 96.27 13 A 1 ATOM 101 C CD1 . LEU A 1 13 ? 0.840 5.841 1.692 1.00 94.13 13 A 1 ATOM 102 C CD2 . LEU A 1 13 ? 0.616 7.961 0.405 1.00 94.43 13 A 1 ATOM 103 N N . CYS A 1 14 ? 3.647 5.359 -3.068 1.00 98.39 14 A 1 ATOM 104 C CA . CYS A 1 14 ? 4.890 5.457 -3.828 1.00 98.38 14 A 1 ATOM 105 C C . CYS A 1 14 ? 4.621 5.852 -5.277 1.00 98.42 14 A 1 ATOM 106 O O . CYS A 1 14 ? 5.330 6.682 -5.839 1.00 97.80 14 A 1 ATOM 107 C CB . CYS A 1 14 ? 5.632 4.121 -3.771 1.00 97.97 14 A 1 ATOM 108 S SG . CYS A 1 14 ? 6.374 3.843 -2.153 1.00 95.53 14 A 1 ATOM 109 N N . PHE A 1 15 ? 3.599 5.254 -5.858 1.00 98.32 15 A 1 ATOM 110 C CA . PHE A 1 15 ? 3.242 5.534 -7.247 1.00 98.27 15 A 1 ATOM 111 C C . PHE A 1 15 ? 2.681 6.943 -7.403 1.00 98.46 15 A 1 ATOM 112 O O . PHE A 1 15 ? 3.025 7.653 -8.346 1.00 97.84 15 A 1 ATOM 113 C CB . PHE A 1 15 ? 2.226 4.498 -7.732 1.00 97.81 15 A 1 ATOM 114 C CG . PHE A 1 15 ? 2.669 3.795 -8.984 1.00 96.20 15 A 1 ATOM 115 C CD1 . PHE A 1 15 ? 3.690 2.854 -8.941 1.00 94.04 15 A 1 ATOM 116 C CD2 . PHE A 1 15 ? 2.066 4.084 -10.199 1.00 94.28 15 A 1 ATOM 117 C CE1 . PHE A 1 15 ? 4.107 2.207 -10.097 1.00 93.32 15 A 1 ATOM 118 C CE2 . PHE A 1 15 ? 2.475 3.438 -11.364 1.00 93.11 15 A 1 ATOM 119 C CZ . PHE A 1 15 ? 3.498 2.497 -11.311 1.00 93.60 15 A 1 ATOM 120 N N . GLY A 1 16 ? 1.824 7.339 -6.479 1.00 98.16 16 A 1 ATOM 121 C CA . GLY A 1 16 ? 1.214 8.665 -6.521 1.00 98.09 16 A 1 ATOM 122 C C . GLY A 1 16 ? 2.189 9.770 -6.159 1.00 98.22 16 A 1 ATOM 123 O O . GLY A 1 16 ? 2.066 10.897 -6.634 1.00 97.69 16 A 1 ATOM 124 N N . LEU A 1 17 ? 3.154 9.448 -5.315 1.00 98.21 17 A 1 ATOM 125 C CA . LEU A 1 17 ? 4.163 10.419 -4.897 1.00 98.10 17 A 1 ATOM 126 C C . LEU A 1 17 ? 5.142 10.723 -6.024 1.00 98.10 17 A 1 ATOM 127 O O . LEU A 1 17 ? 5.629 11.851 -6.143 1.00 96.81 17 A 1 ATOM 128 C CB . LEU A 1 17 ? 4.921 9.888 -3.678 1.00 97.59 17 A 1 ATOM 129 C CG . LEU A 1 17 ? 5.533 10.992 -2.825 1.00 95.41 17 A 1 ATOM 130 C CD1 . LEU A 1 17 ? 4.511 11.504 -1.810 1.00 92.08 17 A 1 ATOM 131 C CD2 . LEU A 1 17 ? 6.765 10.473 -2.100 1.00 89.92 17 A 1 ATOM 132 N N . SER A 1 18 ? 5.415 9.722 -6.836 1.00 96.21 18 A 1 ATOM 133 C CA . SER A 1 18 ? 6.359 9.860 -7.945 1.00 94.68 18 A 1 ATOM 134 C C . SER A 1 18 ? 5.756 10.702 -9.070 1.00 91.24 18 A 1 ATOM 135 O O . SER A 1 18 ? 6.498 11.463 -9.711 1.00 84.51 18 A 1 ATOM 136 C CB . SER A 1 18 ? 6.776 8.480 -8.458 1.00 90.50 18 A 1 ATOM 137 O OG . SER A 1 18 ? 7.946 8.575 -9.220 1.00 80.49 18 A 1 ATOM 138 O OXT . SER A 1 18 ? 4.536 10.580 -9.308 1.00 82.09 18 A 1 #