# 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_spkb26701 # _entry.id spkb26701 # 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" "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" "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 TRP 2 1 n LYS 3 1 n LEU 4 1 n CYS 5 1 n LEU 6 1 n ARG 7 1 n LEU 8 1 n LEU 9 1 n ALA 10 1 n VAL 11 1 n LEU 12 1 n ALA 13 1 n VAL 14 1 n CYS 15 1 n LEU 16 1 n SER 17 1 n THR 18 1 n ALA 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 @ 2025-07-12 04:58:27)" _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 89.11 _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 82.60 1 1 A TRP 2 2 81.68 1 2 A LYS 3 2 86.46 1 3 A LEU 4 2 90.43 1 4 A CYS 5 2 92.92 1 5 A LEU 6 2 90.73 1 6 A ARG 7 2 85.40 1 7 A LEU 8 2 92.01 1 8 A LEU 9 2 91.85 1 9 A ALA 10 2 96.58 1 10 A VAL 11 2 94.74 1 11 A LEU 12 2 90.20 1 12 A ALA 13 2 95.11 1 13 A VAL 14 2 93.60 1 14 A CYS 15 2 93.98 1 15 A LEU 16 2 90.00 1 16 A SER 17 2 91.97 1 17 A THR 18 2 85.36 1 18 A ALA 19 2 81.64 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 TRP . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n CYS . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n ARG . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n VAL . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n VAL . 14 A 14 A 15 1 n CYS . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n SER . 17 A 17 A 18 1 n THR . 18 A 18 A 19 1 n ALA . 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 ? -13.425 3.150 5.045 1.00 88.40 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.173 2.404 5.273 1.00 89.64 1 A 1 ATOM 3 C C . MET A 1 1 ? -10.983 3.153 4.687 1.00 90.71 1 A 1 ATOM 4 O O . MET A 1 1 ? -10.715 3.059 3.491 1.00 88.21 1 A 1 ATOM 5 C CB . MET A 1 1 ? -12.267 1.019 4.635 1.00 84.87 1 A 1 ATOM 6 C CG . MET A 1 1 ? -12.825 -0.015 5.596 1.00 78.45 1 A 1 ATOM 7 S SD . MET A 1 1 ? -12.867 -1.647 4.867 1.00 74.20 1 A 1 ATOM 8 C CE . MET A 1 1 ? -13.201 -2.634 6.314 1.00 66.30 1 A 1 ATOM 9 N N . TRP A 1 2 ? -10.299 3.902 5.528 1.00 89.72 2 A 1 ATOM 10 C CA . TRP A 1 2 ? -9.146 4.680 5.091 1.00 90.91 2 A 1 ATOM 11 C C . TRP A 1 2 ? -7.840 4.035 5.524 1.00 91.99 2 A 1 ATOM 12 O O . TRP A 1 2 ? -6.777 4.355 5.000 1.00 89.15 2 A 1 ATOM 13 C CB . TRP A 1 2 ? -9.255 6.092 5.660 1.00 88.28 2 A 1 ATOM 14 C CG . TRP A 1 2 ? -9.489 7.115 4.590 1.00 82.42 2 A 1 ATOM 15 C CD1 . TRP A 1 2 ? -8.552 7.896 3.996 1.00 78.82 2 A 1 ATOM 16 C CD2 . TRP A 1 2 ? -10.743 7.471 3.973 1.00 82.05 2 A 1 ATOM 17 N NE1 . TRP A 1 2 ? -9.139 8.709 3.054 1.00 76.60 2 A 1 ATOM 18 C CE2 . TRP A 1 2 ? -10.490 8.473 3.014 1.00 82.03 2 A 1 ATOM 19 C CE3 . TRP A 1 2 ? -12.052 7.036 4.153 1.00 75.90 2 A 1 ATOM 20 C CZ2 . TRP A 1 2 ? -11.506 9.038 2.245 1.00 75.41 2 A 1 ATOM 21 C CZ3 . TRP A 1 2 ? -13.061 7.599 3.387 1.00 70.51 2 A 1 ATOM 22 C CH2 . TRP A 1 2 ? -12.789 8.588 2.444 1.00 69.67 2 A 1 ATOM 23 N N . LYS A 1 3 ? -7.927 3.136 6.483 1.00 92.79 3 A 1 ATOM 24 C CA . LYS A 1 3 ? -6.735 2.484 7.018 1.00 93.68 3 A 1 ATOM 25 C C . LYS A 1 3 ? -6.050 1.620 5.958 1.00 94.53 3 A 1 ATOM 26 O O . LYS A 1 3 ? -4.830 1.679 5.794 1.00 93.80 3 A 1 ATOM 27 C CB . LYS A 1 3 ? -7.109 1.648 8.241 1.00 92.74 3 A 1 ATOM 28 C CG . LYS A 1 3 ? -6.007 1.602 9.276 1.00 86.02 3 A 1 ATOM 29 C CD . LYS A 1 3 ? -6.496 1.001 10.590 1.00 82.22 3 A 1 ATOM 30 C CE . LYS A 1 3 ? -6.256 -0.494 10.611 1.00 74.71 3 A 1 ATOM 31 N NZ . LYS A 1 3 ? -6.457 -1.051 11.984 1.00 67.68 3 A 1 ATOM 32 N N . LEU A 1 4 ? -6.836 0.828 5.249 1.00 94.49 4 A 1 ATOM 33 C CA . LEU A 1 4 ? -6.298 -0.056 4.221 1.00 94.34 4 A 1 ATOM 34 C C . LEU A 1 4 ? -5.646 0.738 3.098 1.00 95.54 4 A 1 ATOM 35 O O . LEU A 1 4 ? -4.535 0.430 2.664 1.00 94.78 4 A 1 ATOM 36 C CB . LEU A 1 4 ? -7.412 -0.955 3.667 1.00 93.76 4 A 1 ATOM 37 C CG . LEU A 1 4 ? -7.174 -2.455 3.838 1.00 86.46 4 A 1 ATOM 38 C CD1 . LEU A 1 4 ? -5.884 -2.896 3.172 1.00 81.92 4 A 1 ATOM 39 C CD2 . LEU A 1 4 ? -7.165 -2.821 5.310 1.00 82.13 4 A 1 ATOM 40 N N . CYS A 1 5 ? -6.342 1.747 2.626 1.00 94.72 5 A 1 ATOM 41 C CA . CYS A 1 5 ? -5.829 2.587 1.550 1.00 94.88 5 A 1 ATOM 42 C C . CYS A 1 5 ? -4.550 3.310 1.967 1.00 95.58 5 A 1 ATOM 43 O O . CYS A 1 5 ? -3.581 3.365 1.213 1.00 94.73 5 A 1 ATOM 44 C CB . CYS A 1 5 ? -6.900 3.592 1.136 1.00 93.85 5 A 1 ATOM 45 S SG . CYS A 1 5 ? -8.355 2.768 0.450 1.00 83.74 5 A 1 ATOM 46 N N . LEU A 1 6 ? -4.570 3.854 3.164 1.00 93.93 6 A 1 ATOM 47 C CA . LEU A 1 6 ? -3.409 4.575 3.684 1.00 94.42 6 A 1 ATOM 48 C C . LEU A 1 6 ? -2.218 3.647 3.871 1.00 95.45 6 A 1 ATOM 49 O O . LEU A 1 6 ? -1.087 3.992 3.524 1.00 94.92 6 A 1 ATOM 50 C CB . LEU A 1 6 ? -3.775 5.237 5.013 1.00 94.17 6 A 1 ATOM 51 C CG . LEU A 1 6 ? -4.131 6.708 4.877 1.00 87.39 6 A 1 ATOM 52 C CD1 . LEU A 1 6 ? -5.088 7.126 5.985 1.00 82.89 6 A 1 ATOM 53 C CD2 . LEU A 1 6 ? -2.872 7.552 4.933 1.00 82.70 6 A 1 ATOM 54 N N . ARG A 1 7 ? -2.478 2.476 4.409 1.00 94.69 7 A 1 ATOM 55 C CA . ARG A 1 7 ? -1.416 1.500 4.647 1.00 95.07 7 A 1 ATOM 56 C C . ARG A 1 7 ? -0.819 1.019 3.334 1.00 96.40 7 A 1 ATOM 57 O O . ARG A 1 7 ? 0.402 0.919 3.203 1.00 95.58 7 A 1 ATOM 58 C CB . ARG A 1 7 ? -1.967 0.318 5.439 1.00 94.25 7 A 1 ATOM 59 C CG . ARG A 1 7 ? -2.129 0.649 6.910 1.00 87.83 7 A 1 ATOM 60 C CD . ARG A 1 7 ? -2.537 -0.581 7.699 1.00 83.98 7 A 1 ATOM 61 N NE . ARG A 1 7 ? -1.524 -0.940 8.692 1.00 79.30 7 A 1 ATOM 62 C CZ . ARG A 1 7 ? -1.502 -2.102 9.333 1.00 75.57 7 A 1 ATOM 63 N NH1 . ARG A 1 7 ? -2.424 -3.021 9.117 1.00 68.79 7 A 1 ATOM 64 N NH2 . ARG A 1 7 ? -0.529 -2.351 10.196 1.00 67.90 7 A 1 ATOM 65 N N . LEU A 1 8 ? -1.670 0.739 2.369 1.00 95.69 8 A 1 ATOM 66 C CA . LEU A 1 8 ? -1.204 0.300 1.059 1.00 95.95 8 A 1 ATOM 67 C C . LEU A 1 8 ? -0.355 1.375 0.393 1.00 96.56 8 A 1 ATOM 68 O O . LEU A 1 8 ? 0.690 1.080 -0.197 1.00 96.34 8 A 1 ATOM 69 C CB . LEU A 1 8 ? -2.403 -0.048 0.175 1.00 96.00 8 A 1 ATOM 70 C CG . LEU A 1 8 ? -2.963 -1.446 0.426 1.00 87.64 8 A 1 ATOM 71 C CD1 . LEU A 1 8 ? -4.397 -1.551 -0.064 1.00 83.09 8 A 1 ATOM 72 C CD2 . LEU A 1 8 ? -2.102 -2.493 -0.275 1.00 84.83 8 A 1 ATOM 73 N N . LEU A 1 9 ? -0.795 2.599 0.495 1.00 96.25 9 A 1 ATOM 74 C CA . LEU A 1 9 ? -0.053 3.720 -0.070 1.00 96.06 9 A 1 ATOM 75 C C . LEU A 1 9 ? 1.303 3.868 0.607 1.00 96.33 9 A 1 ATOM 76 O O . LEU A 1 9 ? 2.314 4.114 -0.057 1.00 95.92 9 A 1 ATOM 77 C CB . LEU A 1 9 ? -0.870 5.006 0.095 1.00 95.75 9 A 1 ATOM 78 C CG . LEU A 1 9 ? -1.789 5.294 -1.087 1.00 87.67 9 A 1 ATOM 79 C CD1 . LEU A 1 9 ? -2.962 6.161 -0.661 1.00 83.15 9 A 1 ATOM 80 C CD2 . LEU A 1 9 ? -1.009 5.980 -2.196 1.00 83.64 9 A 1 ATOM 81 N N . ALA A 1 10 ? 1.321 3.712 1.909 1.00 96.98 10 A 1 ATOM 82 C CA . ALA A 1 10 ? 2.560 3.819 2.669 1.00 96.81 10 A 1 ATOM 83 C C . ALA A 1 10 ? 3.548 2.733 2.251 1.00 96.94 10 A 1 ATOM 84 O O . ALA A 1 10 ? 4.729 3.006 2.044 1.00 95.94 10 A 1 ATOM 85 C CB . ALA A 1 10 ? 2.260 3.722 4.159 1.00 96.24 10 A 1 ATOM 86 N N . VAL A 1 11 ? 3.064 1.517 2.108 1.00 96.43 11 A 1 ATOM 87 C CA . VAL A 1 11 ? 3.907 0.395 1.698 1.00 95.99 11 A 1 ATOM 88 C C . VAL A 1 11 ? 4.479 0.645 0.310 1.00 95.90 11 A 1 ATOM 89 O O . VAL A 1 11 ? 5.663 0.398 0.060 1.00 94.62 11 A 1 ATOM 90 C CB . VAL A 1 11 ? 3.117 -0.922 1.713 1.00 95.28 11 A 1 ATOM 91 C CG1 . VAL A 1 11 ? 3.960 -2.066 1.166 1.00 92.41 11 A 1 ATOM 92 C CG2 . VAL A 1 11 ? 2.668 -1.247 3.123 1.00 92.55 11 A 1 ATOM 93 N N . LEU A 1 12 ? 3.648 1.126 -0.572 1.00 94.78 12 A 1 ATOM 94 C CA . LEU A 1 12 ? 4.083 1.426 -1.933 1.00 94.02 12 A 1 ATOM 95 C C . LEU A 1 12 ? 5.182 2.481 -1.930 1.00 94.62 12 A 1 ATOM 96 O O . LEU A 1 12 ? 6.175 2.360 -2.654 1.00 93.86 12 A 1 ATOM 97 C CB . LEU A 1 12 ? 2.896 1.914 -2.764 1.00 93.41 12 A 1 ATOM 98 C CG . LEU A 1 12 ? 2.950 1.450 -4.212 1.00 86.86 12 A 1 ATOM 99 C CD1 . LEU A 1 12 ? 1.851 0.428 -4.484 1.00 81.50 12 A 1 ATOM 100 C CD2 . LEU A 1 12 ? 2.818 2.622 -5.160 1.00 82.58 12 A 1 ATOM 101 N N . ALA A 1 13 ? 4.999 3.505 -1.135 1.00 95.71 13 A 1 ATOM 102 C CA . ALA A 1 13 ? 5.981 4.581 -1.026 1.00 95.38 13 A 1 ATOM 103 C C . ALA A 1 13 ? 7.310 4.058 -0.491 1.00 95.91 13 A 1 ATOM 104 O O . ALA A 1 13 ? 8.376 4.422 -0.992 1.00 94.20 13 A 1 ATOM 105 C CB . ALA A 1 13 ? 5.440 5.684 -0.123 1.00 94.37 13 A 1 ATOM 106 N N . VAL A 1 14 ? 7.249 3.205 0.511 1.00 95.45 14 A 1 ATOM 107 C CA . VAL A 1 14 ? 8.452 2.623 1.104 1.00 94.91 14 A 1 ATOM 108 C C . VAL A 1 14 ? 9.177 1.752 0.088 1.00 95.53 14 A 1 ATOM 109 O O . VAL A 1 14 ? 10.403 1.829 -0.049 1.00 94.29 14 A 1 ATOM 110 C CB . VAL A 1 14 ? 8.105 1.806 2.358 1.00 93.95 14 A 1 ATOM 111 C CG1 . VAL A 1 14 ? 9.338 1.096 2.902 1.00 90.36 14 A 1 ATOM 112 C CG2 . VAL A 1 14 ? 7.520 2.701 3.432 1.00 90.70 14 A 1 ATOM 113 N N . CYS A 1 15 ? 8.430 0.939 -0.630 1.00 95.23 15 A 1 ATOM 114 C CA . CYS A 1 15 ? 9.005 0.067 -1.647 1.00 95.11 15 A 1 ATOM 115 C C . CYS A 1 15 ? 9.696 0.879 -2.742 1.00 95.49 15 A 1 ATOM 116 O O . CYS A 1 15 ? 10.764 0.509 -3.223 1.00 93.80 15 A 1 ATOM 117 C CB . CYS A 1 15 ? 7.912 -0.812 -2.256 1.00 94.28 15 A 1 ATOM 118 S SG . CYS A 1 15 ? 7.451 -2.178 -1.171 1.00 90.00 15 A 1 ATOM 119 N N . LEU A 1 16 ? 9.075 1.963 -3.127 1.00 94.61 16 A 1 ATOM 120 C CA . LEU A 1 16 ? 9.650 2.843 -4.141 1.00 94.10 16 A 1 ATOM 121 C C . LEU A 1 16 ? 10.881 3.568 -3.613 1.00 94.82 16 A 1 ATOM 122 O O . LEU A 1 16 ? 11.836 3.809 -4.360 1.00 93.59 16 A 1 ATOM 123 C CB . LEU A 1 16 ? 8.592 3.857 -4.589 1.00 93.06 16 A 1 ATOM 124 C CG . LEU A 1 16 ? 7.756 3.374 -5.768 1.00 87.72 16 A 1 ATOM 125 C CD1 . LEU A 1 16 ? 6.362 3.974 -5.733 1.00 80.87 16 A 1 ATOM 126 C CD2 . LEU A 1 16 ? 8.444 3.721 -7.076 1.00 81.24 16 A 1 ATOM 127 N N . SER A 1 17 ? 10.854 3.917 -2.352 1.00 95.65 17 A 1 ATOM 128 C CA . SER A 1 17 ? 11.970 4.609 -1.716 1.00 95.38 17 A 1 ATOM 129 C C . SER A 1 17 ? 13.213 3.727 -1.680 1.00 95.19 17 A 1 ATOM 130 O O . SER A 1 17 ? 14.319 4.179 -1.986 1.00 92.46 17 A 1 ATOM 131 C CB . SER A 1 17 ? 11.586 5.042 -0.304 1.00 93.60 17 A 1 ATOM 132 O OG . SER A 1 17 ? 12.559 5.891 0.243 1.00 79.55 17 A 1 ATOM 133 N N . THR A 1 18 ? 13.029 2.471 -1.319 1.00 92.33 18 A 1 ATOM 134 C CA . THR A 1 18 ? 14.139 1.523 -1.248 1.00 90.30 18 A 1 ATOM 135 C C . THR A 1 18 ? 14.212 0.681 -2.515 1.00 89.39 18 A 1 ATOM 136 O O . THR A 1 18 ? 13.246 0.022 -2.894 1.00 82.80 18 A 1 ATOM 137 C CB . THR A 1 18 ? 14.012 0.625 -0.012 1.00 87.17 18 A 1 ATOM 138 O OG1 . THR A 1 18 ? 15.053 -0.352 -0.034 1.00 78.85 18 A 1 ATOM 139 C CG2 . THR A 1 18 ? 12.683 -0.093 0.059 1.00 76.69 18 A 1 ATOM 140 N N . ALA A 1 19 ? 15.346 0.702 -3.151 1.00 90.09 19 A 1 ATOM 141 C CA . ALA A 1 19 ? 15.538 -0.063 -4.379 1.00 86.80 19 A 1 ATOM 142 C C . ALA A 1 19 ? 15.927 -1.508 -4.063 1.00 83.92 19 A 1 ATOM 143 O O . ALA A 1 19 ? 15.659 -2.401 -4.879 1.00 76.69 19 A 1 ATOM 144 C CB . ALA A 1 19 ? 16.609 0.604 -5.236 1.00 81.04 19 A 1 ATOM 145 O OXT . ALA A 1 19 ? 16.502 -1.762 -3.010 1.00 71.32 19 A 1 #