# By using this file you agree to the legally binding terms of use found at alphafoldserver.com/output-terms data_293441646ad6f2dd # _entry.id 293441646ad6f2dd # 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](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H15 N4 O2" 175.209 ARG y ARGININE N[C@@H](CCCNC(N)=[NH2+])C(O)=O ? "L-PEPTIDE LINKING" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE N[C@@H](CC(N)=O)C(O)=O ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" N[C@@H](CC(O)=O)C(O)=O ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE N[C@@H](CS)C(O)=O ? "L-PEPTIDE LINKING" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE N[C@@H](CCC(N)=O)C(O)=O ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" N[C@@H](CCC(O)=O)C(O)=O ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE NCC(O)=O ? "PEPTIDE LINKING" "C6 H10 N3 O2" 156.162 HIS y HISTIDINE N[C@@H](Cc1c[nH]c[nH+]1)C(O)=O ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H15 N2 O2" 147.195 LYS y LYSINE N[C@@H](CCCC[NH3+])C(O)=O ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE N[C@@H](Cc1ccccc1)C(O)=O ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE OC(=O)[C@@H]1CCCN1 ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE N[C@@H](CO)C(O)=O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@@H](O)[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE N[C@@H](Cc1ccc(O)cc1)C(O)=O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@H](N)C(O)=O ? "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 ARG 2 1 n ASN 3 1 n ARG 4 1 n ILE 5 1 n MET 6 1 n PRO 7 1 n GLY 8 1 n VAL 9 1 n TYR 10 1 n ILE 11 1 n VAL 12 1 n ILE 13 1 n ILE 14 1 n PRO 15 1 n TYR 16 1 n VAL 17 1 n ILE 18 1 n VAL 19 1 n SER 20 1 n ILE 21 1 n CYS 22 1 n TYR 23 1 n LEU 24 1 n LEU 25 1 n PHE 26 1 n ARG 27 1 n HIS 28 1 n TYR 29 1 n ILE 30 1 n PRO 31 1 n GLY 32 1 n VAL 33 1 n SER 34 1 n PHE 35 1 n SER 36 1 n ALA 37 1 n HIS 38 1 n ARG 39 1 n ASP 40 1 n GLY 41 1 n LEU 42 1 n GLY 43 1 n ALA 44 1 n THR 45 1 n LEU 46 1 n SER 47 1 n SER 48 1 n TYR 49 1 n ALA 50 1 n GLY 51 1 n THR 52 1 n MET 53 1 n ILE 54 1 n ALA 55 1 n ILE 56 1 n LEU 57 1 n ILE 58 1 n ALA 59 1 n ALA 60 1 n LEU 61 1 n THR 62 1 n PHE 63 1 n LEU 64 1 n ILE 65 1 n GLY 66 1 n SER 67 1 n ARG 68 1 n THR 69 1 n ARG 70 1 n ARG 71 1 n LEU 72 1 n ALA 73 1 n LYS 74 1 n ILE 75 1 n ARG 76 1 n GLU 77 1 n TYR 78 1 n GLY 79 1 n TYR 80 1 n MET 81 1 n THR 82 1 n SER 83 1 n VAL 84 1 n VAL 85 1 n ILE 86 1 n VAL 87 1 n TYR 88 1 n ALA 89 1 n LEU 90 1 n SER 91 1 n PHE 92 1 n VAL 93 1 n GLU 94 1 n LEU 95 1 n GLY 96 1 n ALA 97 1 n LEU 98 1 n PHE 99 1 n PHE 100 1 n CYS 101 1 n GLY 102 1 n LEU 103 1 n LEU 104 1 n LEU 105 1 n LEU 106 1 n SER 107 1 n SER 108 1 n ILE 109 1 n SER 110 1 n GLY 111 1 n TYR 112 1 n MET 113 1 n ILE 114 1 n PRO 115 1 n THR 116 1 n ILE 117 1 n ALA 118 1 n ILE 119 1 n GLY 120 1 n ILE 121 1 n ALA 122 1 n SER 123 1 n ALA 124 1 n SER 125 1 n PHE 126 1 n ILE 127 1 n HIS 128 1 n ILE 129 1 n CYS 130 1 n ILE 131 1 n LEU 132 1 n VAL 133 1 n PHE 134 1 n GLN 135 1 n LEU 136 1 n TYR 137 1 n ASN 138 1 n LEU 139 1 n THR 140 1 n ARG 141 1 n GLU 142 1 n GLN 143 1 n GLU 144 # _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 (2b86f29d-618d-47cf-8aef-20020b1102eb @ 2025-05-02 15:56:47)" _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 80.11 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # _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 alphafoldserver.com/output-terms. ; 1 license ? ;THE INFORMATION IS NOT INTENDED FOR, HAS NOT BEEN VALIDATED FOR, AND IS NOT APPROVED FOR CLINICAL USE. IT SHOULD NOT BE USED FOR CLINICAL PURPOSE OR RELIED ON FOR MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION 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 ARG . 2 A 2 A 3 1 n ASN . 3 A 3 A 4 1 n ARG . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n MET . 6 A 6 A 7 1 n PRO . 7 A 7 A 8 1 n GLY . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n TYR . 10 A 10 A 11 1 n ILE . 11 A 11 A 12 1 n VAL . 12 A 12 A 13 1 n ILE . 13 A 13 A 14 1 n ILE . 14 A 14 A 15 1 n PRO . 15 A 15 A 16 1 n TYR . 16 A 16 A 17 1 n VAL . 17 A 17 A 18 1 n ILE . 18 A 18 A 19 1 n VAL . 19 A 19 A 20 1 n SER . 20 A 20 A 21 1 n ILE . 21 A 21 A 22 1 n CYS . 22 A 22 A 23 1 n TYR . 23 A 23 A 24 1 n LEU . 24 A 24 A 25 1 n LEU . 25 A 25 A 26 1 n PHE . 26 A 26 A 27 1 n ARG . 27 A 27 A 28 1 n HIS . 28 A 28 A 29 1 n TYR . 29 A 29 A 30 1 n ILE . 30 A 30 A 31 1 n PRO . 31 A 31 A 32 1 n GLY . 32 A 32 A 33 1 n VAL . 33 A 33 A 34 1 n SER . 34 A 34 A 35 1 n PHE . 35 A 35 A 36 1 n SER . 36 A 36 A 37 1 n ALA . 37 A 37 A 38 1 n HIS . 38 A 38 A 39 1 n ARG . 39 A 39 A 40 1 n ASP . 40 A 40 A 41 1 n GLY . 41 A 41 A 42 1 n LEU . 42 A 42 A 43 1 n GLY . 43 A 43 A 44 1 n ALA . 44 A 44 A 45 1 n THR . 45 A 45 A 46 1 n LEU . 46 A 46 A 47 1 n SER . 47 A 47 A 48 1 n SER . 48 A 48 A 49 1 n TYR . 49 A 49 A 50 1 n ALA . 50 A 50 A 51 1 n GLY . 51 A 51 A 52 1 n THR . 52 A 52 A 53 1 n MET . 53 A 53 A 54 1 n ILE . 54 A 54 A 55 1 n ALA . 55 A 55 A 56 1 n ILE . 56 A 56 A 57 1 n LEU . 57 A 57 A 58 1 n ILE . 58 A 58 A 59 1 n ALA . 59 A 59 A 60 1 n ALA . 60 A 60 A 61 1 n LEU . 61 A 61 A 62 1 n THR . 62 A 62 A 63 1 n PHE . 63 A 63 A 64 1 n LEU . 64 A 64 A 65 1 n ILE . 65 A 65 A 66 1 n GLY . 66 A 66 A 67 1 n SER . 67 A 67 A 68 1 n ARG . 68 A 68 A 69 1 n THR . 69 A 69 A 70 1 n ARG . 70 A 70 A 71 1 n ARG . 71 A 71 A 72 1 n LEU . 72 A 72 A 73 1 n ALA . 73 A 73 A 74 1 n LYS . 74 A 74 A 75 1 n ILE . 75 A 75 A 76 1 n ARG . 76 A 76 A 77 1 n GLU . 77 A 77 A 78 1 n TYR . 78 A 78 A 79 1 n GLY . 79 A 79 A 80 1 n TYR . 80 A 80 A 81 1 n MET . 81 A 81 A 82 1 n THR . 82 A 82 A 83 1 n SER . 83 A 83 A 84 1 n VAL . 84 A 84 A 85 1 n VAL . 85 A 85 A 86 1 n ILE . 86 A 86 A 87 1 n VAL . 87 A 87 A 88 1 n TYR . 88 A 88 A 89 1 n ALA . 89 A 89 A 90 1 n LEU . 90 A 90 A 91 1 n SER . 91 A 91 A 92 1 n PHE . 92 A 92 A 93 1 n VAL . 93 A 93 A 94 1 n GLU . 94 A 94 A 95 1 n LEU . 95 A 95 A 96 1 n GLY . 96 A 96 A 97 1 n ALA . 97 A 97 A 98 1 n LEU . 98 A 98 A 99 1 n PHE . 99 A 99 A 100 1 n PHE . 100 A 100 A 101 1 n CYS . 101 A 101 A 102 1 n GLY . 102 A 102 A 103 1 n LEU . 103 A 103 A 104 1 n LEU . 104 A 104 A 105 1 n LEU . 105 A 105 A 106 1 n LEU . 106 A 106 A 107 1 n SER . 107 A 107 A 108 1 n SER . 108 A 108 A 109 1 n ILE . 109 A 109 A 110 1 n SER . 110 A 110 A 111 1 n GLY . 111 A 111 A 112 1 n TYR . 112 A 112 A 113 1 n MET . 113 A 113 A 114 1 n ILE . 114 A 114 A 115 1 n PRO . 115 A 115 A 116 1 n THR . 116 A 116 A 117 1 n ILE . 117 A 117 A 118 1 n ALA . 118 A 118 A 119 1 n ILE . 119 A 119 A 120 1 n GLY . 120 A 120 A 121 1 n ILE . 121 A 121 A 122 1 n ALA . 122 A 122 A 123 1 n SER . 123 A 123 A 124 1 n ALA . 124 A 124 A 125 1 n SER . 125 A 125 A 126 1 n PHE . 126 A 126 A 127 1 n ILE . 127 A 127 A 128 1 n HIS . 128 A 128 A 129 1 n ILE . 129 A 129 A 130 1 n CYS . 130 A 130 A 131 1 n ILE . 131 A 131 A 132 1 n LEU . 132 A 132 A 133 1 n VAL . 133 A 133 A 134 1 n PHE . 134 A 134 A 135 1 n GLN . 135 A 135 A 136 1 n LEU . 136 A 136 A 137 1 n TYR . 137 A 137 A 138 1 n ASN . 138 A 138 A 139 1 n LEU . 139 A 139 A 140 1 n THR . 140 A 140 A 141 1 n ARG . 141 A 141 A 142 1 n GLU . 142 A 142 A 143 1 n GLN . 143 A 143 A 144 1 n GLU . 144 A 144 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (2b86f29d-618d-47cf-8aef-20020b1102eb @ 2025-05-02 15:56:47)" # _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 ? 20.353 -7.237 -6.704 1.00 59.16 1 A 1 ATOM 2 C CA . MET A 1 1 ? 18.886 -7.060 -6.824 1.00 63.04 1 A 1 ATOM 3 C C . MET A 1 1 ? 18.217 -6.650 -5.509 1.00 64.52 1 A 1 ATOM 4 O O . MET A 1 1 ? 17.387 -5.758 -5.530 1.00 60.89 1 A 1 ATOM 5 C CB . MET A 1 1 ? 18.218 -8.287 -7.449 1.00 60.37 1 A 1 ATOM 6 C CG . MET A 1 1 ? 18.608 -8.419 -8.932 1.00 55.63 1 A 1 ATOM 7 S SD . MET A 1 1 ? 17.740 -9.754 -9.778 1.00 52.00 1 A 1 ATOM 8 C CE . MET A 1 1 ? 18.398 -9.587 -11.460 1.00 47.49 1 A 1 ATOM 9 N N . ARG A 1 2 ? 18.632 -7.189 -4.358 1.00 66.15 2 A 1 ATOM 10 C CA . ARG A 1 2 ? 18.046 -6.912 -3.026 1.00 67.04 2 A 1 ATOM 11 C C . ARG A 1 2 ? 17.923 -5.421 -2.677 1.00 66.85 2 A 1 ATOM 12 O O . ARG A 1 2 ? 16.860 -4.974 -2.252 1.00 64.68 2 A 1 ATOM 13 C CB . ARG A 1 2 ? 18.852 -7.707 -1.968 1.00 65.91 2 A 1 ATOM 14 C CG . ARG A 1 2 ? 18.134 -7.801 -0.607 1.00 59.61 2 A 1 ATOM 15 C CD . ARG A 1 2 ? 18.763 -8.866 0.315 1.00 57.29 2 A 1 ATOM 16 N NE . ARG A 1 2 ? 20.090 -8.504 0.811 1.00 52.31 2 A 1 ATOM 17 C CZ . ARG A 1 2 ? 20.936 -9.311 1.461 1.00 46.33 2 A 1 ATOM 18 N NH1 . ARG A 1 2 ? 20.677 -10.573 1.661 1.00 45.52 2 A 1 ATOM 19 N NH2 . ARG A 1 2 ? 22.063 -8.851 1.916 1.00 44.00 2 A 1 ATOM 20 N N . ASN A 1 3 ? 18.948 -4.611 -2.951 1.00 71.70 3 A 1 ATOM 21 C CA . ASN A 1 3 ? 18.970 -3.189 -2.573 1.00 70.70 3 A 1 ATOM 22 C C . ASN A 1 3 ? 18.043 -2.282 -3.407 1.00 71.41 3 A 1 ATOM 23 O O . ASN A 1 3 ? 17.836 -1.132 -3.038 1.00 67.52 3 A 1 ATOM 24 C CB . ASN A 1 3 ? 20.423 -2.671 -2.607 1.00 67.03 3 A 1 ATOM 25 C CG . ASN A 1 3 ? 21.329 -3.329 -1.579 1.00 61.57 3 A 1 ATOM 26 O OD1 . ASN A 1 3 ? 20.961 -4.280 -0.901 1.00 55.87 3 A 1 ATOM 27 N ND2 . ASN A 1 3 ? 22.553 -2.894 -1.474 1.00 56.15 3 A 1 ATOM 28 N N . ARG A 1 4 ? 17.480 -2.766 -4.524 1.00 71.56 4 A 1 ATOM 29 C CA . ARG A 1 4 ? 16.573 -1.992 -5.385 1.00 71.54 4 A 1 ATOM 30 C C . ARG A 1 4 ? 15.106 -2.154 -4.988 1.00 73.11 4 A 1 ATOM 31 O O . ARG A 1 4 ? 14.314 -1.272 -5.265 1.00 70.77 4 A 1 ATOM 32 C CB . ARG A 1 4 ? 16.799 -2.355 -6.866 1.00 68.40 4 A 1 ATOM 33 C CG . ARG A 1 4 ? 18.212 -1.978 -7.353 1.00 63.01 4 A 1 ATOM 34 C CD . ARG A 1 4 ? 18.355 -2.224 -8.860 1.00 60.61 4 A 1 ATOM 35 N NE . ARG A 1 4 ? 19.699 -1.888 -9.347 1.00 55.79 4 A 1 ATOM 36 C CZ . ARG A 1 4 ? 20.119 -1.924 -10.618 1.00 49.16 4 A 1 ATOM 37 N NH1 . ARG A 1 4 ? 19.332 -2.305 -11.581 1.00 47.11 4 A 1 ATOM 38 N NH2 . ARG A 1 4 ? 21.326 -1.577 -10.925 1.00 45.09 4 A 1 ATOM 39 N N . ILE A 1 5 ? 14.748 -3.241 -4.306 1.00 75.02 5 A 1 ATOM 40 C CA . ILE A 1 5 ? 13.373 -3.567 -3.888 1.00 75.92 5 A 1 ATOM 41 C C . ILE A 1 5 ? 13.051 -2.944 -2.519 1.00 77.55 5 A 1 ATOM 42 O O . ILE A 1 5 ? 11.927 -2.513 -2.277 1.00 75.66 5 A 1 ATOM 43 C CB . ILE A 1 5 ? 13.173 -5.100 -3.912 1.00 73.30 5 A 1 ATOM 44 C CG1 . ILE A 1 5 ? 13.399 -5.651 -5.339 1.00 68.07 5 A 1 ATOM 45 C CG2 . ILE A 1 5 ? 11.768 -5.481 -3.406 1.00 65.70 5 A 1 ATOM 46 C CD1 . ILE A 1 5 ? 13.413 -7.185 -5.432 1.00 61.55 5 A 1 ATOM 47 N N . MET A 1 6 ? 14.056 -2.841 -1.633 1.00 77.46 6 A 1 ATOM 48 C CA . MET A 1 6 ? 13.894 -2.331 -0.267 1.00 78.59 6 A 1 ATOM 49 C C . MET A 1 6 ? 13.161 -0.976 -0.168 1.00 79.03 6 A 1 ATOM 50 O O . MET A 1 6 ? 12.258 -0.886 0.662 1.00 77.89 6 A 1 ATOM 51 C CB . MET A 1 6 ? 15.261 -2.263 0.448 1.00 77.41 6 A 1 ATOM 52 C CG . MET A 1 6 ? 15.857 -3.659 0.690 1.00 71.18 6 A 1 ATOM 53 S SD . MET A 1 6 ? 14.957 -4.711 1.849 1.00 63.61 6 A 1 ATOM 54 C CE . MET A 1 6 ? 15.505 -4.026 3.425 1.00 55.10 6 A 1 ATOM 55 N N . PRO A 1 7 ? 13.443 0.056 -0.998 1.00 78.50 7 A 1 ATOM 56 C CA . PRO A 1 7 ? 12.712 1.318 -0.934 1.00 77.69 7 A 1 ATOM 57 C C . PRO A 1 7 ? 11.206 1.156 -1.152 1.00 79.07 7 A 1 ATOM 58 O O . PRO A 1 7 ? 10.412 1.767 -0.443 1.00 75.92 7 A 1 ATOM 59 C CB . PRO A 1 7 ? 13.337 2.215 -2.006 1.00 75.33 7 A 1 ATOM 60 C CG . PRO A 1 7 ? 14.742 1.635 -2.196 1.00 72.86 7 A 1 ATOM 61 C CD . PRO A 1 7 ? 14.516 0.143 -1.976 1.00 75.28 7 A 1 ATOM 62 N N . GLY A 1 8 ? 10.800 0.293 -2.092 1.00 75.78 8 A 1 ATOM 63 C CA . GLY A 1 8 ? 9.391 0.007 -2.356 1.00 74.55 8 A 1 ATOM 64 C C . GLY A 1 8 ? 8.699 -0.675 -1.174 1.00 76.81 8 A 1 ATOM 65 O O . GLY A 1 8 ? 7.583 -0.322 -0.815 1.00 77.35 8 A 1 ATOM 66 N N . VAL A 1 9 ? 9.395 -1.601 -0.505 1.00 82.26 9 A 1 ATOM 67 C CA . VAL A 1 9 ? 8.878 -2.296 0.683 1.00 83.38 9 A 1 ATOM 68 C C . VAL A 1 9 ? 8.680 -1.325 1.853 1.00 85.52 9 A 1 ATOM 69 O O . VAL A 1 9 ? 7.638 -1.365 2.508 1.00 86.08 9 A 1 ATOM 70 C CB . VAL A 1 9 ? 9.802 -3.465 1.058 1.00 82.61 9 A 1 ATOM 71 C CG1 . VAL A 1 9 ? 9.358 -4.178 2.344 1.00 76.24 9 A 1 ATOM 72 C CG2 . VAL A 1 9 ? 9.829 -4.528 -0.051 1.00 76.10 9 A 1 ATOM 73 N N . TYR A 1 10 ? 9.627 -0.404 2.089 1.00 83.56 10 A 1 ATOM 74 C CA . TYR A 1 10 ? 9.471 0.604 3.141 1.00 84.42 10 A 1 ATOM 75 C C . TYR A 1 10 ? 8.283 1.529 2.896 1.00 86.03 10 A 1 ATOM 76 O O . TYR A 1 10 ? 7.531 1.808 3.833 1.00 86.17 10 A 1 ATOM 77 C CB . TYR A 1 10 ? 10.759 1.424 3.298 1.00 84.69 10 A 1 ATOM 78 C CG . TYR A 1 10 ? 11.911 0.665 3.928 1.00 80.84 10 A 1 ATOM 79 C CD1 . TYR A 1 10 ? 11.757 0.096 5.208 1.00 74.69 10 A 1 ATOM 80 C CD2 . TYR A 1 10 ? 13.143 0.550 3.262 1.00 74.55 10 A 1 ATOM 81 C CE1 . TYR A 1 10 ? 12.817 -0.606 5.798 1.00 68.36 10 A 1 ATOM 82 C CE2 . TYR A 1 10 ? 14.212 -0.145 3.853 1.00 70.36 10 A 1 ATOM 83 C CZ . TYR A 1 10 ? 14.049 -0.732 5.126 1.00 71.63 10 A 1 ATOM 84 O OH . TYR A 1 10 ? 15.075 -1.413 5.695 1.00 69.05 10 A 1 ATOM 85 N N . ILE A 1 11 ? 8.048 1.953 1.646 1.00 85.53 11 A 1 ATOM 86 C CA . ILE A 1 11 ? 6.901 2.789 1.279 1.00 85.24 11 A 1 ATOM 87 C C . ILE A 1 11 ? 5.570 2.103 1.631 1.00 86.51 11 A 1 ATOM 88 O O . ILE A 1 11 ? 4.643 2.783 2.050 1.00 85.49 11 A 1 ATOM 89 C CB . ILE A 1 11 ? 6.987 3.176 -0.220 1.00 83.77 11 A 1 ATOM 90 C CG1 . ILE A 1 11 ? 8.120 4.195 -0.428 1.00 78.61 11 A 1 ATOM 91 C CG2 . ILE A 1 11 ? 5.660 3.760 -0.747 1.00 76.18 11 A 1 ATOM 92 C CD1 . ILE A 1 11 ? 8.515 4.398 -1.899 1.00 69.24 11 A 1 ATOM 93 N N . VAL A 1 12 ? 5.496 0.777 1.516 1.00 85.52 12 A 1 ATOM 94 C CA . VAL A 1 12 ? 4.280 0.017 1.860 1.00 85.43 12 A 1 ATOM 95 C C . VAL A 1 12 ? 4.160 -0.225 3.369 1.00 87.68 12 A 1 ATOM 96 O O . VAL A 1 12 ? 3.072 -0.116 3.925 1.00 88.76 12 A 1 ATOM 97 C CB . VAL A 1 12 ? 4.233 -1.297 1.061 1.00 84.57 12 A 1 ATOM 98 C CG1 . VAL A 1 12 ? 3.036 -2.174 1.439 1.00 79.65 12 A 1 ATOM 99 C CG2 . VAL A 1 12 ? 4.120 -0.995 -0.447 1.00 80.16 12 A 1 ATOM 100 N N . ILE A 1 13 ? 5.256 -0.498 4.074 1.00 87.99 13 A 1 ATOM 101 C CA . ILE A 1 13 ? 5.203 -0.825 5.506 1.00 89.29 13 A 1 ATOM 102 C C . ILE A 1 13 ? 4.935 0.408 6.384 1.00 90.74 13 A 1 ATOM 103 O O . ILE A 1 13 ? 4.196 0.318 7.360 1.00 91.85 13 A 1 ATOM 104 C CB . ILE A 1 13 ? 6.493 -1.571 5.926 1.00 89.71 13 A 1 ATOM 105 C CG1 . ILE A 1 13 ? 6.513 -2.971 5.274 1.00 84.27 13 A 1 ATOM 106 C CG2 . ILE A 1 13 ? 6.610 -1.698 7.461 1.00 82.28 13 A 1 ATOM 107 C CD1 . ILE A 1 13 ? 7.821 -3.752 5.493 1.00 73.17 13 A 1 ATOM 108 N N . ILE A 1 14 ? 5.533 1.566 6.060 1.00 90.36 14 A 1 ATOM 109 C CA . ILE A 1 14 ? 5.447 2.773 6.891 1.00 90.05 14 A 1 ATOM 110 C C . ILE A 1 14 ? 3.990 3.186 7.193 1.00 91.44 14 A 1 ATOM 111 O O . ILE A 1 14 ? 3.677 3.372 8.375 1.00 92.15 14 A 1 ATOM 112 C CB . ILE A 1 14 ? 6.304 3.909 6.293 1.00 89.64 14 A 1 ATOM 113 C CG1 . ILE A 1 14 ? 7.805 3.612 6.493 1.00 83.88 14 A 1 ATOM 114 C CG2 . ILE A 1 14 ? 5.965 5.282 6.919 1.00 81.17 14 A 1 ATOM 115 C CD1 . ILE A 1 14 ? 8.727 4.478 5.602 1.00 72.35 14 A 1 ATOM 116 N N . PRO A 1 15 ? 3.068 3.285 6.213 1.00 90.08 15 A 1 ATOM 117 C CA . PRO A 1 15 ? 1.661 3.592 6.484 1.00 89.36 15 A 1 ATOM 118 C C . PRO A 1 15 ? 0.983 2.623 7.448 1.00 90.40 15 A 1 ATOM 119 O O . PRO A 1 15 ? 0.265 3.057 8.344 1.00 90.20 15 A 1 ATOM 120 C CB . PRO A 1 15 ? 0.977 3.589 5.121 1.00 88.70 15 A 1 ATOM 121 C CG . PRO A 1 15 ? 2.097 4.030 4.196 1.00 86.10 15 A 1 ATOM 122 C CD . PRO A 1 15 ? 3.307 3.311 4.785 1.00 87.07 15 A 1 ATOM 123 N N . TYR A 1 16 ? 1.252 1.313 7.349 1.00 89.72 16 A 1 ATOM 124 C CA . TYR A 1 16 ? 0.689 0.317 8.261 1.00 89.20 16 A 1 ATOM 125 C C . TYR A 1 16 ? 1.177 0.500 9.697 1.00 90.58 16 A 1 ATOM 126 O O . TYR A 1 16 ? 0.396 0.342 10.636 1.00 89.92 16 A 1 ATOM 127 C CB . TYR A 1 16 ? 1.021 -1.094 7.771 1.00 88.94 16 A 1 ATOM 128 C CG . TYR A 1 16 ? 0.125 -1.555 6.655 1.00 88.81 16 A 1 ATOM 129 C CD1 . TYR A 1 16 ? -1.183 -1.988 6.962 1.00 84.21 16 A 1 ATOM 130 C CD2 . TYR A 1 16 ? 0.572 -1.559 5.328 1.00 83.85 16 A 1 ATOM 131 C CE1 . TYR A 1 16 ? -2.032 -2.429 5.941 1.00 79.85 16 A 1 ATOM 132 C CE2 . TYR A 1 16 ? -0.279 -1.994 4.296 1.00 80.96 16 A 1 ATOM 133 C CZ . TYR A 1 16 ? -1.586 -2.435 4.601 1.00 83.80 16 A 1 ATOM 134 O OH . TYR A 1 16 ? -2.422 -2.874 3.620 1.00 80.67 16 A 1 ATOM 135 N N . VAL A 1 17 ? 2.438 0.877 9.890 1.00 91.31 17 A 1 ATOM 136 C CA . VAL A 1 17 ? 2.988 1.193 11.214 1.00 90.45 17 A 1 ATOM 137 C C . VAL A 1 17 ? 2.290 2.427 11.792 1.00 91.56 17 A 1 ATOM 138 O O . VAL A 1 17 ? 1.835 2.387 12.932 1.00 92.63 17 A 1 ATOM 139 C CB . VAL A 1 17 ? 4.517 1.382 11.157 1.00 91.76 17 A 1 ATOM 140 C CG1 . VAL A 1 17 ? 5.096 1.824 12.504 1.00 87.47 17 A 1 ATOM 141 C CG2 . VAL A 1 17 ? 5.207 0.063 10.776 1.00 85.88 17 A 1 ATOM 142 N N . ILE A 1 18 ? 2.133 3.493 10.998 1.00 92.78 18 A 1 ATOM 143 C CA . ILE A 1 18 ? 1.451 4.724 11.412 1.00 91.72 18 A 1 ATOM 144 C C . ILE A 1 18 ? 0.001 4.419 11.815 1.00 91.79 18 A 1 ATOM 145 O O . ILE A 1 18 ? -0.421 4.778 12.913 1.00 91.76 18 A 1 ATOM 146 C CB . ILE A 1 18 ? 1.525 5.794 10.302 1.00 92.74 18 A 1 ATOM 147 C CG1 . ILE A 1 18 ? 2.983 6.249 10.095 1.00 90.09 18 A 1 ATOM 148 C CG2 . ILE A 1 18 ? 0.638 7.010 10.643 1.00 87.82 18 A 1 ATOM 149 C CD1 . ILE A 1 18 ? 3.194 7.089 8.827 1.00 81.47 18 A 1 ATOM 150 N N . VAL A 1 19 ? -0.747 3.702 10.971 1.00 91.21 19 A 1 ATOM 151 C CA . VAL A 1 19 ? -2.144 3.339 11.234 1.00 89.29 19 A 1 ATOM 152 C C . VAL A 1 19 ? -2.263 2.459 12.475 1.00 88.36 19 A 1 ATOM 153 O O . VAL A 1 19 ? -3.159 2.673 13.290 1.00 89.13 19 A 1 ATOM 154 C CB . VAL A 1 19 ? -2.767 2.656 10.004 1.00 89.42 19 A 1 ATOM 155 C CG1 . VAL A 1 19 ? -4.155 2.064 10.289 1.00 84.08 19 A 1 ATOM 156 C CG2 . VAL A 1 19 ? -2.938 3.680 8.877 1.00 84.85 19 A 1 ATOM 157 N N . SER A 1 20 ? -1.338 1.518 12.681 1.00 90.48 20 A 1 ATOM 158 C CA . SER A 1 20 ? -1.320 0.662 13.870 1.00 87.68 20 A 1 ATOM 159 C C . SER A 1 20 ? -1.099 1.470 15.154 1.00 86.94 20 A 1 ATOM 160 O O . SER A 1 20 ? -1.801 1.258 16.136 1.00 88.51 20 A 1 ATOM 161 C CB . SER A 1 20 ? -0.237 -0.416 13.756 1.00 88.72 20 A 1 ATOM 162 O OG . SER A 1 20 ? -0.463 -1.231 12.632 1.00 77.15 20 A 1 ATOM 163 N N . ILE A 1 21 ? -0.176 2.435 15.142 1.00 92.88 21 A 1 ATOM 164 C CA . ILE A 1 21 ? 0.065 3.336 16.277 1.00 91.68 21 A 1 ATOM 165 C C . ILE A 1 21 ? -1.181 4.192 16.547 1.00 91.21 21 A 1 ATOM 166 O O . ILE A 1 21 ? -1.644 4.249 17.685 1.00 91.77 21 A 1 ATOM 167 C CB . ILE A 1 21 ? 1.314 4.205 16.030 1.00 93.83 21 A 1 ATOM 168 C CG1 . ILE A 1 21 ? 2.590 3.322 16.025 1.00 91.99 21 A 1 ATOM 169 C CG2 . ILE A 1 21 ? 1.451 5.309 17.098 1.00 89.96 21 A 1 ATOM 170 C CD1 . ILE A 1 21 ? 3.822 4.025 15.439 1.00 85.14 21 A 1 ATOM 171 N N . CYS A 1 22 ? -1.777 4.786 15.514 1.00 91.31 22 A 1 ATOM 172 C CA . CYS A 1 22 ? -3.005 5.564 15.639 1.00 87.97 22 A 1 ATOM 173 C C . CYS A 1 22 ? -4.155 4.733 16.218 1.00 87.06 22 A 1 ATOM 174 O O . CYS A 1 22 ? -4.879 5.205 17.089 1.00 87.39 22 A 1 ATOM 175 C CB . CYS A 1 22 ? -3.399 6.129 14.266 1.00 88.11 22 A 1 ATOM 176 S SG . CYS A 1 22 ? -2.244 7.441 13.771 1.00 79.35 22 A 1 ATOM 177 N N . TYR A 1 23 ? -4.297 3.469 15.794 1.00 89.19 23 A 1 ATOM 178 C CA . TYR A 1 23 ? -5.296 2.551 16.326 1.00 85.19 23 A 1 ATOM 179 C C . TYR A 1 23 ? -5.076 2.252 17.815 1.00 85.15 23 A 1 ATOM 180 O O . TYR A 1 23 ? -6.026 2.299 18.594 1.00 86.10 23 A 1 ATOM 181 C CB . TYR A 1 23 ? -5.304 1.262 15.497 1.00 84.04 23 A 1 ATOM 182 C CG . TYR A 1 23 ? -6.213 0.200 16.080 1.00 80.10 23 A 1 ATOM 183 C CD1 . TYR A 1 23 ? -5.680 -0.885 16.814 1.00 76.07 23 A 1 ATOM 184 C CD2 . TYR A 1 23 ? -7.614 0.324 15.950 1.00 75.67 23 A 1 ATOM 185 C CE1 . TYR A 1 23 ? -6.529 -1.838 17.405 1.00 70.36 23 A 1 ATOM 186 C CE2 . TYR A 1 23 ? -8.470 -0.622 16.544 1.00 71.61 23 A 1 ATOM 187 C CZ . TYR A 1 23 ? -7.930 -1.706 17.269 1.00 72.35 23 A 1 ATOM 188 O OH . TYR A 1 23 ? -8.761 -2.621 17.843 1.00 71.41 23 A 1 ATOM 189 N N . LEU A 1 24 ? -3.838 1.972 18.229 1.00 86.62 24 A 1 ATOM 190 C CA . LEU A 1 24 ? -3.502 1.712 19.635 1.00 84.69 24 A 1 ATOM 191 C C . LEU A 1 24 ? -3.783 2.929 20.517 1.00 85.37 24 A 1 ATOM 192 O O . LEU A 1 24 ? -4.398 2.789 21.571 1.00 86.71 24 A 1 ATOM 193 C CB . LEU A 1 24 ? -2.024 1.298 19.748 1.00 87.03 24 A 1 ATOM 194 C CG . LEU A 1 24 ? -1.712 -0.100 19.189 1.00 81.37 24 A 1 ATOM 195 C CD1 . LEU A 1 24 ? -0.198 -0.326 19.221 1.00 76.45 24 A 1 ATOM 196 C CD2 . LEU A 1 24 ? -2.381 -1.219 19.995 1.00 77.23 24 A 1 ATOM 197 N N . LEU A 1 25 ? -3.409 4.134 20.055 1.00 87.94 25 A 1 ATOM 198 C CA . LEU A 1 25 ? -3.713 5.388 20.745 1.00 86.58 25 A 1 ATOM 199 C C . LEU A 1 25 ? -5.221 5.606 20.849 1.00 86.80 25 A 1 ATOM 200 O O . LEU A 1 25 ? -5.736 5.837 21.937 1.00 88.28 25 A 1 ATOM 201 C CB . LEU A 1 25 ? -3.036 6.557 20.007 1.00 89.75 25 A 1 ATOM 202 C CG . LEU A 1 25 ? -1.499 6.582 20.094 1.00 85.21 25 A 1 ATOM 203 C CD1 . LEU A 1 25 ? -0.964 7.689 19.195 1.00 79.73 25 A 1 ATOM 204 C CD2 . LEU A 1 25 ? -0.999 6.822 21.515 1.00 80.80 25 A 1 ATOM 205 N N . PHE A 1 26 ? -5.954 5.445 19.745 1.00 86.70 26 A 1 ATOM 206 C CA . PHE A 1 26 ? -7.405 5.584 19.730 1.00 83.46 26 A 1 ATOM 207 C C . PHE A 1 26 ? -8.088 4.625 20.717 1.00 82.95 26 A 1 ATOM 208 O O . PHE A 1 26 ? -8.952 5.032 21.484 1.00 82.23 26 A 1 ATOM 209 C CB . PHE A 1 26 ? -7.912 5.351 18.304 1.00 82.41 26 A 1 ATOM 210 C CG . PHE A 1 26 ? -9.401 5.513 18.158 1.00 78.24 26 A 1 ATOM 211 C CD1 . PHE A 1 26 ? -10.243 4.388 18.205 1.00 73.99 26 A 1 ATOM 212 C CD2 . PHE A 1 26 ? -9.964 6.795 18.003 1.00 74.60 26 A 1 ATOM 213 C CE1 . PHE A 1 26 ? -11.638 4.545 18.085 1.00 69.94 26 A 1 ATOM 214 C CE2 . PHE A 1 26 ? -11.351 6.954 17.884 1.00 70.63 26 A 1 ATOM 215 C CZ . PHE A 1 26 ? -12.193 5.835 17.924 1.00 71.43 26 A 1 ATOM 216 N N . ARG A 1 27 ? -7.656 3.347 20.738 1.00 86.34 27 A 1 ATOM 217 C CA . ARG A 1 27 ? -8.183 2.336 21.658 1.00 83.86 27 A 1 ATOM 218 C C . ARG A 1 27 ? -7.874 2.657 23.123 1.00 84.83 27 A 1 ATOM 219 O O . ARG A 1 27 ? -8.681 2.318 23.986 1.00 82.76 27 A 1 ATOM 220 C CB . ARG A 1 27 ? -7.635 0.960 21.254 1.00 81.11 27 A 1 ATOM 221 C CG . ARG A 1 27 ? -8.321 -0.218 21.951 1.00 72.68 27 A 1 ATOM 222 C CD . ARG A 1 27 ? -9.781 -0.369 21.492 1.00 69.28 27 A 1 ATOM 223 N NE . ARG A 1 27 ? -10.440 -1.540 22.105 1.00 64.13 27 A 1 ATOM 224 C CZ . ARG A 1 27 ? -11.626 -2.022 21.772 1.00 58.30 27 A 1 ATOM 225 N NH1 . ARG A 1 27 ? -12.339 -1.509 20.805 1.00 55.41 27 A 1 ATOM 226 N NH2 . ARG A 1 27 ? -12.138 -3.038 22.416 1.00 52.95 27 A 1 ATOM 227 N N . HIS A 1 28 ? -6.736 3.284 23.404 1.00 87.42 28 A 1 ATOM 228 C CA . HIS A 1 28 ? -6.346 3.692 24.745 1.00 87.14 28 A 1 ATOM 229 C C . HIS A 1 28 ? -7.182 4.879 25.257 1.00 88.47 28 A 1 ATOM 230 O O . HIS A 1 28 ? -7.665 4.838 26.382 1.00 87.71 28 A 1 ATOM 231 C CB . HIS A 1 28 ? -4.845 4.021 24.750 1.00 88.62 28 A 1 ATOM 232 C CG . HIS A 1 28 ? -4.328 4.380 26.120 1.00 83.98 28 A 1 ATOM 233 N ND1 . HIS A 1 28 ? -4.137 3.503 27.166 1.00 72.21 28 A 1 ATOM 234 C CD2 . HIS A 1 28 ? -3.987 5.627 26.562 1.00 72.38 28 A 1 ATOM 235 C CE1 . HIS A 1 28 ? -3.691 4.216 28.217 1.00 74.77 28 A 1 ATOM 236 N NE2 . HIS A 1 28 ? -3.582 5.509 27.898 1.00 77.03 28 A 1 ATOM 237 N N . TYR A 1 29 ? -7.391 5.902 24.415 1.00 85.29 29 A 1 ATOM 238 C CA . TYR A 1 29 ? -8.119 7.112 24.815 1.00 83.67 29 A 1 ATOM 239 C C . TYR A 1 29 ? -9.645 6.966 24.769 1.00 82.31 29 A 1 ATOM 240 O O . TYR A 1 29 ? -10.344 7.619 25.546 1.00 80.33 29 A 1 ATOM 241 C CB . TYR A 1 29 ? -7.671 8.291 23.938 1.00 86.06 29 A 1 ATOM 242 C CG . TYR A 1 29 ? -6.308 8.837 24.316 1.00 84.24 29 A 1 ATOM 243 C CD1 . TYR A 1 29 ? -6.149 9.567 25.509 1.00 78.28 29 A 1 ATOM 244 C CD2 . TYR A 1 29 ? -5.189 8.613 23.487 1.00 77.98 29 A 1 ATOM 245 C CE1 . TYR A 1 29 ? -4.886 10.057 25.876 1.00 75.98 29 A 1 ATOM 246 C CE2 . TYR A 1 29 ? -3.917 9.102 23.847 1.00 76.84 29 A 1 ATOM 247 C CZ . TYR A 1 29 ? -3.767 9.821 25.044 1.00 76.92 29 A 1 ATOM 248 O OH . TYR A 1 29 ? -2.534 10.287 25.400 1.00 77.30 29 A 1 ATOM 249 N N . ILE A 1 30 ? -10.184 6.105 23.883 1.00 87.89 30 A 1 ATOM 250 C CA . ILE A 1 30 ? -11.626 5.931 23.694 1.00 84.67 30 A 1 ATOM 251 C C . ILE A 1 30 ? -11.995 4.429 23.745 1.00 82.44 30 A 1 ATOM 252 O O . ILE A 1 30 ? -12.308 3.810 22.722 1.00 79.22 30 A 1 ATOM 253 C CB . ILE A 1 30 ? -12.128 6.652 22.412 1.00 84.11 30 A 1 ATOM 254 C CG1 . ILE A 1 30 ? -11.507 8.057 22.232 1.00 81.01 30 A 1 ATOM 255 C CG2 . ILE A 1 30 ? -13.664 6.774 22.503 1.00 77.56 30 A 1 ATOM 256 C CD1 . ILE A 1 30 ? -11.978 8.811 20.973 1.00 73.53 30 A 1 ATOM 257 N N . PRO A 1 31 ? -11.923 3.795 24.929 1.00 84.91 31 A 1 ATOM 258 C CA . PRO A 1 31 ? -12.316 2.404 25.085 1.00 82.24 31 A 1 ATOM 259 C C . PRO A 1 31 ? -13.832 2.247 24.867 1.00 79.74 31 A 1 ATOM 260 O O . PRO A 1 31 ? -14.630 3.064 25.320 1.00 73.13 31 A 1 ATOM 261 C CB . PRO A 1 31 ? -11.861 2.016 26.495 1.00 80.97 31 A 1 ATOM 262 C CG . PRO A 1 31 ? -11.898 3.333 27.267 1.00 79.96 31 A 1 ATOM 263 C CD . PRO A 1 31 ? -11.516 4.360 26.209 1.00 83.58 31 A 1 ATOM 264 N N . GLY A 1 32 ? -14.246 1.178 24.181 1.00 77.35 32 A 1 ATOM 265 C CA . GLY A 1 32 ? -15.659 0.827 23.997 1.00 75.36 32 A 1 ATOM 266 C C . GLY A 1 32 ? -16.287 1.236 22.656 1.00 75.80 32 A 1 ATOM 267 O O . GLY A 1 32 ? -17.401 0.798 22.364 1.00 71.40 32 A 1 ATOM 268 N N . VAL A 1 33 ? -15.591 1.981 21.795 1.00 75.04 33 A 1 ATOM 269 C CA . VAL A 1 33 ? -16.093 2.282 20.448 1.00 74.97 33 A 1 ATOM 270 C C . VAL A 1 33 ? -16.113 1.018 19.590 1.00 75.38 33 A 1 ATOM 271 O O . VAL A 1 33 ? -15.106 0.314 19.443 1.00 72.36 33 A 1 ATOM 272 C CB . VAL A 1 33 ? -15.306 3.413 19.772 1.00 72.58 33 A 1 ATOM 273 C CG1 . VAL A 1 33 ? -15.787 3.671 18.337 1.00 65.39 33 A 1 ATOM 274 C CG2 . VAL A 1 33 ? -15.500 4.713 20.553 1.00 66.81 33 A 1 ATOM 275 N N . SER A 1 34 ? -17.282 0.727 19.000 1.00 73.41 34 A 1 ATOM 276 C CA . SER A 1 34 ? -17.496 -0.363 18.061 1.00 74.02 34 A 1 ATOM 277 C C . SER A 1 34 ? -17.995 0.177 16.725 1.00 75.44 34 A 1 ATOM 278 O O . SER A 1 34 ? -19.012 0.866 16.665 1.00 72.81 34 A 1 ATOM 279 C CB . SER A 1 34 ? -18.506 -1.363 18.633 1.00 70.17 34 A 1 ATOM 280 O OG . SER A 1 34 ? -18.716 -2.417 17.701 1.00 60.96 34 A 1 ATOM 281 N N . PHE A 1 35 ? -17.308 -0.193 15.646 1.00 77.15 35 A 1 ATOM 282 C CA . PHE A 1 35 ? -17.704 0.134 14.277 1.00 76.52 35 A 1 ATOM 283 C C . PHE A 1 35 ? -18.697 -0.883 13.684 1.00 78.95 35 A 1 ATOM 284 O O . PHE A 1 35 ? -19.003 -0.840 12.498 1.00 77.60 35 A 1 ATOM 285 C CB . PHE A 1 35 ? -16.450 0.310 13.424 1.00 74.36 35 A 1 ATOM 286 C CG . PHE A 1 35 ? -15.539 1.417 13.909 1.00 72.98 35 A 1 ATOM 287 C CD1 . PHE A 1 35 ? -15.902 2.761 13.701 1.00 68.81 35 A 1 ATOM 288 C CD2 . PHE A 1 35 ? -14.341 1.121 14.586 1.00 68.71 35 A 1 ATOM 289 C CE1 . PHE A 1 35 ? -15.071 3.797 14.157 1.00 64.02 35 A 1 ATOM 290 C CE2 . PHE A 1 35 ? -13.506 2.153 15.040 1.00 64.67 35 A 1 ATOM 291 C CZ . PHE A 1 35 ? -13.871 3.498 14.820 1.00 63.99 35 A 1 ATOM 292 N N . SER A 1 36 ? -19.219 -1.802 14.504 1.00 76.71 36 A 1 ATOM 293 C CA . SER A 1 36 ? -20.118 -2.868 14.056 1.00 77.77 36 A 1 ATOM 294 C C . SER A 1 36 ? -21.593 -2.454 13.984 1.00 80.21 36 A 1 ATOM 295 O O . SER A 1 36 ? -22.403 -3.237 13.499 1.00 77.95 36 A 1 ATOM 296 C CB . SER A 1 36 ? -19.967 -4.101 14.953 1.00 74.56 36 A 1 ATOM 297 O OG . SER A 1 36 ? -18.608 -4.501 15.024 1.00 65.00 36 A 1 ATOM 298 N N . ALA A 1 37 ? -21.960 -1.261 14.445 1.00 79.79 37 A 1 ATOM 299 C CA . ALA A 1 37 ? -23.360 -0.823 14.521 1.00 80.18 37 A 1 ATOM 300 C C . ALA A 1 37 ? -24.000 -0.558 13.140 1.00 81.72 37 A 1 ATOM 301 O O . ALA A 1 37 ? -25.194 -0.780 12.967 1.00 79.76 37 A 1 ATOM 302 C CB . ALA A 1 37 ? -23.434 0.415 15.420 1.00 78.28 37 A 1 ATOM 303 N N . HIS A 1 38 ? -23.206 -0.116 12.144 1.00 84.38 38 A 1 ATOM 304 C CA . HIS A 1 38 ? -23.685 0.230 10.800 1.00 85.04 38 A 1 ATOM 305 C C . HIS A 1 38 ? -22.858 -0.476 9.715 1.00 87.12 38 A 1 ATOM 306 O O . HIS A 1 38 ? -22.212 0.147 8.874 1.00 86.36 38 A 1 ATOM 307 C CB . HIS A 1 38 ? -23.687 1.755 10.622 1.00 83.85 38 A 1 ATOM 308 C CG . HIS A 1 38 ? -24.609 2.469 11.568 1.00 80.03 38 A 1 ATOM 309 N ND1 . HIS A 1 38 ? -24.290 2.930 12.823 1.00 69.51 38 A 1 ATOM 310 C CD2 . HIS A 1 38 ? -25.925 2.760 11.357 1.00 69.30 38 A 1 ATOM 311 C CE1 . HIS A 1 38 ? -25.391 3.494 13.357 1.00 66.84 38 A 1 ATOM 312 N NE2 . HIS A 1 38 ? -26.408 3.415 12.496 1.00 69.23 38 A 1 ATOM 313 N N . ARG A 1 39 ? -22.834 -1.830 9.769 1.00 84.99 39 A 1 ATOM 314 C CA . ARG A 1 39 ? -21.979 -2.665 8.913 1.00 87.09 39 A 1 ATOM 315 C C . ARG A 1 39 ? -22.304 -2.521 7.431 1.00 89.44 39 A 1 ATOM 316 O O . ARG A 1 39 ? -21.378 -2.386 6.636 1.00 88.64 39 A 1 ATOM 317 C CB . ARG A 1 39 ? -22.088 -4.139 9.324 1.00 84.71 39 A 1 ATOM 318 C CG . ARG A 1 39 ? -21.586 -4.363 10.752 1.00 79.29 39 A 1 ATOM 319 C CD . ARG A 1 39 ? -21.719 -5.824 11.166 1.00 76.95 39 A 1 ATOM 320 N NE . ARG A 1 39 ? -20.793 -6.680 10.414 1.00 70.37 39 A 1 ATOM 321 C CZ . ARG A 1 39 ? -20.198 -7.757 10.858 1.00 63.44 39 A 1 ATOM 322 N NH1 . ARG A 1 39 ? -20.410 -8.231 12.052 1.00 60.91 39 A 1 ATOM 323 N NH2 . ARG A 1 39 ? -19.366 -8.405 10.098 1.00 54.80 39 A 1 ATOM 324 N N . ASP A 1 40 ? -23.592 -2.486 7.078 1.00 89.69 40 A 1 ATOM 325 C CA . ASP A 1 40 ? -24.030 -2.392 5.687 1.00 90.38 40 A 1 ATOM 326 C C . ASP A 1 40 ? -23.584 -1.070 5.049 1.00 92.13 40 A 1 ATOM 327 O O . ASP A 1 40 ? -22.976 -1.057 3.979 1.00 91.85 40 A 1 ATOM 328 C CB . ASP A 1 40 ? -25.557 -2.541 5.610 1.00 88.23 40 A 1 ATOM 329 C CG . ASP A 1 40 ? -26.071 -3.846 6.231 1.00 82.93 40 A 1 ATOM 330 O OD1 . ASP A 1 40 ? -25.292 -4.819 6.296 1.00 75.95 40 A 1 ATOM 331 O OD2 . ASP A 1 40 ? -27.219 -3.819 6.721 1.00 76.98 40 A 1 ATOM 332 N N . GLY A 1 41 ? -23.800 0.050 5.760 1.00 91.36 41 A 1 ATOM 333 C CA . GLY A 1 41 ? -23.347 1.365 5.299 1.00 91.80 41 A 1 ATOM 334 C C . GLY A 1 41 ? -21.822 1.459 5.193 1.00 93.29 41 A 1 ATOM 335 O O . GLY A 1 41 ? -21.297 1.973 4.207 1.00 92.90 41 A 1 ATOM 336 N N . LEU A 1 42 ? -21.096 0.885 6.166 1.00 89.28 42 A 1 ATOM 337 C CA . LEU A 1 42 ? -19.635 0.813 6.140 1.00 89.29 42 A 1 ATOM 338 C C . LEU A 1 42 ? -19.143 -0.039 4.970 1.00 91.17 42 A 1 ATOM 339 O O . LEU A 1 42 ? -18.265 0.396 4.225 1.00 92.47 42 A 1 ATOM 340 C CB . LEU A 1 42 ? -19.135 0.283 7.495 1.00 88.29 42 A 1 ATOM 341 C CG . LEU A 1 42 ? -17.603 0.223 7.612 1.00 84.31 42 A 1 ATOM 342 C CD1 . LEU A 1 42 ? -16.956 1.603 7.538 1.00 79.39 42 A 1 ATOM 343 C CD2 . LEU A 1 42 ? -17.210 -0.413 8.949 1.00 79.97 42 A 1 ATOM 344 N N . GLY A 1 43 ? -19.726 -1.230 4.760 1.00 91.28 43 A 1 ATOM 345 C CA . GLY A 1 43 ? -19.364 -2.137 3.672 1.00 90.90 43 A 1 ATOM 346 C C . GLY A 1 43 ? -19.596 -1.531 2.289 1.00 92.48 43 A 1 ATOM 347 O O . GLY A 1 43 ? -18.701 -1.566 1.444 1.00 92.84 43 A 1 ATOM 348 N N . ALA A 1 44 ? -20.766 -0.900 2.081 1.00 94.45 44 A 1 ATOM 349 C CA . ALA A 1 44 ? -21.087 -0.211 0.835 1.00 94.26 44 A 1 ATOM 350 C C . ALA A 1 44 ? -20.113 0.951 0.552 1.00 94.66 44 A 1 ATOM 351 O O . ALA A 1 44 ? -19.578 1.058 -0.548 1.00 94.35 44 A 1 ATOM 352 C CB . ALA A 1 44 ? -22.541 0.285 0.916 1.00 94.25 44 A 1 ATOM 353 N N . THR A 1 45 ? -19.821 1.762 1.576 1.00 96.04 45 A 1 ATOM 354 C CA . THR A 1 45 ? -18.909 2.903 1.453 1.00 95.60 45 A 1 ATOM 355 C C . THR A 1 45 ? -17.483 2.448 1.134 1.00 96.15 45 A 1 ATOM 356 O O . THR A 1 45 ? -16.858 2.983 0.223 1.00 95.76 45 A 1 ATOM 357 C CB . THR A 1 45 ? -18.911 3.750 2.735 1.00 95.05 45 A 1 ATOM 358 O OG1 . THR A 1 45 ? -20.219 4.181 3.027 1.00 86.58 45 A 1 ATOM 359 C CG2 . THR A 1 45 ? -18.052 5.007 2.602 1.00 85.91 45 A 1 ATOM 360 N N . LEU A 1 46 ? -16.968 1.431 1.840 1.00 94.66 46 A 1 ATOM 361 C CA . LEU A 1 46 ? -15.624 0.906 1.620 1.00 94.22 46 A 1 ATOM 362 C C . LEU A 1 46 ? -15.479 0.220 0.256 1.00 94.64 46 A 1 ATOM 363 O O . LEU A 1 46 ? -14.463 0.397 -0.404 1.00 94.65 46 A 1 ATOM 364 C CB . LEU A 1 46 ? -15.252 -0.063 2.745 1.00 93.30 46 A 1 ATOM 365 C CG . LEU A 1 46 ? -15.016 0.612 4.111 1.00 90.90 46 A 1 ATOM 366 C CD1 . LEU A 1 46 ? -14.792 -0.471 5.160 1.00 85.79 46 A 1 ATOM 367 C CD2 . LEU A 1 46 ? -13.791 1.529 4.111 1.00 85.50 46 A 1 ATOM 368 N N . SER A 1 47 ? -16.513 -0.511 -0.202 1.00 95.16 47 A 1 ATOM 369 C CA . SER A 1 47 ? -16.510 -1.124 -1.538 1.00 94.65 47 A 1 ATOM 370 C C . SER A 1 47 ? -16.506 -0.067 -2.646 1.00 95.20 47 A 1 ATOM 371 O O . SER A 1 47 ? -15.736 -0.169 -3.592 1.00 94.52 47 A 1 ATOM 372 C CB . SER A 1 47 ? -17.722 -2.047 -1.720 1.00 93.80 47 A 1 ATOM 373 O OG . SER A 1 47 ? -17.722 -3.056 -0.734 1.00 78.97 47 A 1 ATOM 374 N N . SER A 1 48 ? -17.318 0.993 -2.497 1.00 97.07 48 A 1 ATOM 375 C CA . SER A 1 48 ? -17.342 2.114 -3.439 1.00 96.74 48 A 1 ATOM 376 C C . SER A 1 48 ? -16.020 2.878 -3.464 1.00 96.88 48 A 1 ATOM 377 O O . SER A 1 48 ? -15.480 3.160 -4.538 1.00 96.08 48 A 1 ATOM 378 C CB . SER A 1 48 ? -18.496 3.053 -3.066 1.00 96.30 48 A 1 ATOM 379 O OG . SER A 1 48 ? -18.588 4.097 -4.011 1.00 79.78 48 A 1 ATOM 380 N N . TYR A 1 49 ? -15.448 3.157 -2.287 1.00 95.83 49 A 1 ATOM 381 C CA . TYR A 1 49 ? -14.131 3.772 -2.141 1.00 95.08 49 A 1 ATOM 382 C C . TYR A 1 49 ? -13.053 2.942 -2.841 1.00 95.72 49 A 1 ATOM 383 O O . TYR A 1 49 ? -12.337 3.469 -3.700 1.00 95.91 49 A 1 ATOM 384 C CB . TYR A 1 49 ? -13.815 3.960 -0.649 1.00 95.01 49 A 1 ATOM 385 C CG . TYR A 1 49 ? -12.369 4.315 -0.370 1.00 94.98 49 A 1 ATOM 386 C CD1 . TYR A 1 49 ? -11.455 3.304 0.004 1.00 92.10 49 A 1 ATOM 387 C CD2 . TYR A 1 49 ? -11.917 5.630 -0.541 1.00 92.56 49 A 1 ATOM 388 C CE1 . TYR A 1 49 ? -10.097 3.614 0.200 1.00 90.50 49 A 1 ATOM 389 C CE2 . TYR A 1 49 ? -10.559 5.946 -0.347 1.00 90.55 49 A 1 ATOM 390 C CZ . TYR A 1 49 ? -9.649 4.931 0.021 1.00 91.43 49 A 1 ATOM 391 O OH . TYR A 1 49 ? -8.334 5.230 0.189 1.00 89.38 49 A 1 ATOM 392 N N . ALA A 1 50 ? -12.966 1.635 -2.530 1.00 95.83 50 A 1 ATOM 393 C CA . ALA A 1 50 ? -11.957 0.752 -3.107 1.00 95.36 50 A 1 ATOM 394 C C . ALA A 1 50 ? -12.087 0.659 -4.632 1.00 95.21 50 A 1 ATOM 395 O O . ALA A 1 50 ? -11.088 0.817 -5.334 1.00 94.76 50 A 1 ATOM 396 C CB . ALA A 1 50 ? -12.087 -0.625 -2.448 1.00 95.52 50 A 1 ATOM 397 N N . GLY A 1 51 ? -13.300 0.497 -5.171 1.00 96.45 51 A 1 ATOM 398 C CA . GLY A 1 51 ? -13.538 0.464 -6.615 1.00 95.57 51 A 1 ATOM 399 C C . GLY A 1 51 ? -13.101 1.752 -7.318 1.00 95.97 51 A 1 ATOM 400 O O . GLY A 1 51 ? -12.413 1.701 -8.339 1.00 94.98 51 A 1 ATOM 401 N N . THR A 1 52 ? -13.412 2.909 -6.734 1.00 97.04 52 A 1 ATOM 402 C CA . THR A 1 52 ? -13.004 4.212 -7.267 1.00 96.40 52 A 1 ATOM 403 C C . THR A 1 52 ? -11.481 4.380 -7.244 1.00 96.16 52 A 1 ATOM 404 O O . THR A 1 52 ? -10.882 4.796 -8.237 1.00 94.92 52 A 1 ATOM 405 C CB . THR A 1 52 ? -13.665 5.354 -6.479 1.00 96.13 52 A 1 ATOM 406 O OG1 . THR A 1 52 ? -15.068 5.202 -6.489 1.00 90.13 52 A 1 ATOM 407 C CG2 . THR A 1 52 ? -13.365 6.723 -7.083 1.00 89.05 52 A 1 ATOM 408 N N . MET A 1 53 ? -10.830 4.009 -6.135 1.00 95.69 53 A 1 ATOM 409 C CA . MET A 1 53 ? -9.384 4.114 -5.994 1.00 94.41 53 A 1 ATOM 410 C C . MET A 1 53 ? -8.624 3.145 -6.907 1.00 94.53 53 A 1 ATOM 411 O O . MET A 1 53 ? -7.580 3.518 -7.432 1.00 93.59 53 A 1 ATOM 412 C CB . MET A 1 53 ? -8.977 3.926 -4.534 1.00 93.54 53 A 1 ATOM 413 C CG . MET A 1 53 ? -9.407 5.109 -3.658 1.00 89.21 53 A 1 ATOM 414 S SD . MET A 1 53 ? -8.676 6.697 -4.130 1.00 82.42 53 A 1 ATOM 415 C CE . MET A 1 53 ? -9.633 7.789 -3.059 1.00 71.36 53 A 1 ATOM 416 N N . ILE A 1 54 ? -9.162 1.939 -7.166 1.00 95.41 54 A 1 ATOM 417 C CA . ILE A 1 54 ? -8.612 1.010 -8.165 1.00 94.81 54 A 1 ATOM 418 C C . ILE A 1 54 ? -8.603 1.659 -9.552 1.00 94.59 54 A 1 ATOM 419 O O . ILE A 1 54 ? -7.578 1.623 -10.236 1.00 93.72 54 A 1 ATOM 420 C CB . ILE A 1 54 ? -9.400 -0.325 -8.153 1.00 94.84 54 A 1 ATOM 421 C CG1 . ILE A 1 54 ? -9.026 -1.140 -6.895 1.00 93.20 54 A 1 ATOM 422 C CG2 . ILE A 1 54 ? -9.133 -1.165 -9.417 1.00 92.80 54 A 1 ATOM 423 C CD1 . ILE A 1 54 ? -9.978 -2.306 -6.586 1.00 87.67 54 A 1 ATOM 424 N N . ALA A 1 55 ? -9.703 2.294 -9.962 1.00 96.31 55 A 1 ATOM 425 C CA . ALA A 1 55 ? -9.781 2.966 -11.257 1.00 95.70 55 A 1 ATOM 426 C C . ALA A 1 55 ? -8.759 4.112 -11.374 1.00 95.15 55 A 1 ATOM 427 O O . ALA A 1 55 ? -8.039 4.208 -12.374 1.00 93.91 55 A 1 ATOM 428 C CB . ALA A 1 55 ? -11.218 3.455 -11.474 1.00 95.81 55 A 1 ATOM 429 N N . ILE A 1 56 ? -8.624 4.935 -10.319 1.00 94.55 56 A 1 ATOM 430 C CA . ILE A 1 56 ? -7.623 6.012 -10.254 1.00 92.97 56 A 1 ATOM 431 C C . ILE A 1 56 ? -6.202 5.449 -10.323 1.00 92.64 56 A 1 ATOM 432 O O . ILE A 1 56 ? -5.367 5.966 -11.054 1.00 91.33 56 A 1 ATOM 433 C CB . ILE A 1 56 ? -7.837 6.877 -8.992 1.00 92.07 56 A 1 ATOM 434 C CG1 . ILE A 1 56 ? -9.176 7.645 -9.096 1.00 89.85 56 A 1 ATOM 435 C CG2 . ILE A 1 56 ? -6.673 7.855 -8.765 1.00 88.62 56 A 1 ATOM 436 C CD1 . ILE A 1 56 ? -9.617 8.322 -7.797 1.00 81.06 56 A 1 ATOM 437 N N . LEU A 1 57 ? -5.927 4.356 -9.591 1.00 91.21 57 A 1 ATOM 438 C CA . LEU A 1 57 ? -4.607 3.727 -9.554 1.00 90.92 57 A 1 ATOM 439 C C . LEU A 1 57 ? -4.209 3.159 -10.919 1.00 91.45 57 A 1 ATOM 440 O O . LEU A 1 57 ? -3.072 3.346 -11.346 1.00 91.21 57 A 1 ATOM 441 C CB . LEU A 1 57 ? -4.624 2.638 -8.464 1.00 90.24 57 A 1 ATOM 442 C CG . LEU A 1 57 ? -3.252 1.991 -8.228 1.00 86.19 57 A 1 ATOM 443 C CD1 . LEU A 1 57 ? -2.240 2.980 -7.659 1.00 81.96 57 A 1 ATOM 444 C CD2 . LEU A 1 57 ? -3.415 0.836 -7.235 1.00 81.21 57 A 1 ATOM 445 N N . ILE A 1 58 ? -5.142 2.517 -11.645 1.00 92.59 58 A 1 ATOM 446 C CA . ILE A 1 58 ? -4.916 2.024 -13.009 1.00 91.81 58 A 1 ATOM 447 C C . ILE A 1 58 ? -4.614 3.186 -13.961 1.00 90.92 58 A 1 ATOM 448 O O . ILE A 1 58 ? -3.665 3.112 -14.747 1.00 89.98 58 A 1 ATOM 449 C CB . ILE A 1 58 ? -6.116 1.187 -13.500 1.00 92.22 58 A 1 ATOM 450 C CG1 . ILE A 1 58 ? -6.205 -0.142 -12.702 1.00 91.13 58 A 1 ATOM 451 C CG2 . ILE A 1 58 ? -6.017 0.878 -15.007 1.00 89.67 58 A 1 ATOM 452 C CD1 . ILE A 1 58 ? -7.527 -0.892 -12.893 1.00 83.82 58 A 1 ATOM 453 N N . ALA A 1 59 ? -5.384 4.271 -13.884 1.00 93.05 59 A 1 ATOM 454 C CA . ALA A 1 59 ? -5.152 5.462 -14.705 1.00 91.10 59 A 1 ATOM 455 C C . ALA A 1 59 ? -3.772 6.090 -14.412 1.00 90.19 59 A 1 ATOM 456 O O . ALA A 1 59 ? -3.010 6.366 -15.336 1.00 88.45 59 A 1 ATOM 457 C CB . ALA A 1 59 ? -6.297 6.453 -14.458 1.00 91.28 59 A 1 ATOM 458 N N . ALA A 1 60 ? -3.410 6.231 -13.129 1.00 89.78 60 A 1 ATOM 459 C CA . ALA A 1 60 ? -2.124 6.757 -12.698 1.00 86.91 60 A 1 ATOM 460 C C . ALA A 1 60 ? -0.946 5.877 -13.155 1.00 86.46 60 A 1 ATOM 461 O O . ALA A 1 60 ? 0.055 6.389 -13.661 1.00 84.98 60 A 1 ATOM 462 C CB . ALA A 1 60 ? -2.150 6.916 -11.171 1.00 86.53 60 A 1 ATOM 463 N N . LEU A 1 61 ? -1.069 4.551 -13.045 1.00 85.81 61 A 1 ATOM 464 C CA . LEU A 1 61 ? -0.049 3.605 -13.505 1.00 84.26 61 A 1 ATOM 465 C C . LEU A 1 61 ? 0.115 3.656 -15.031 1.00 84.01 61 A 1 ATOM 466 O O . LEU A 1 61 ? 1.245 3.679 -15.533 1.00 83.24 61 A 1 ATOM 467 C CB . LEU A 1 61 ? -0.419 2.189 -13.025 1.00 83.85 61 A 1 ATOM 468 C CG . LEU A 1 61 ? 0.582 1.098 -13.452 1.00 79.21 61 A 1 ATOM 469 C CD1 . LEU A 1 61 ? 1.986 1.341 -12.899 1.00 75.32 61 A 1 ATOM 470 C CD2 . LEU A 1 61 ? 0.100 -0.267 -12.961 1.00 74.43 61 A 1 ATOM 471 N N . THR A 1 62 ? -0.992 3.712 -15.768 1.00 88.01 62 A 1 ATOM 472 C CA . THR A 1 62 ? -0.985 3.824 -17.235 1.00 86.59 62 A 1 ATOM 473 C C . THR A 1 62 ? -0.294 5.114 -17.677 1.00 85.15 62 A 1 ATOM 474 O O . THR A 1 62 ? 0.578 5.088 -18.540 1.00 83.11 62 A 1 ATOM 475 C CB . THR A 1 62 ? -2.409 3.766 -17.797 1.00 87.00 62 A 1 ATOM 476 O OG1 . THR A 1 62 ? -3.018 2.558 -17.398 1.00 82.65 62 A 1 ATOM 477 C CG2 . THR A 1 62 ? -2.426 3.787 -19.323 1.00 81.05 62 A 1 ATOM 478 N N . PHE A 1 63 ? -0.614 6.236 -17.026 1.00 84.41 63 A 1 ATOM 479 C CA . PHE A 1 63 ? 0.036 7.522 -17.266 1.00 82.08 63 A 1 ATOM 480 C C . PHE A 1 63 ? 1.535 7.477 -16.947 1.00 81.41 63 A 1 ATOM 481 O O . PHE A 1 63 ? 2.354 7.926 -17.750 1.00 79.97 63 A 1 ATOM 482 C CB . PHE A 1 63 ? -0.677 8.592 -16.444 1.00 81.14 63 A 1 ATOM 483 C CG . PHE A 1 63 ? -0.088 9.972 -16.644 1.00 76.34 63 A 1 ATOM 484 C CD1 . PHE A 1 63 ? 0.826 10.496 -15.717 1.00 70.95 63 A 1 ATOM 485 C CD2 . PHE A 1 63 ? -0.426 10.723 -17.784 1.00 69.39 63 A 1 ATOM 486 C CE1 . PHE A 1 63 ? 1.389 11.767 -15.923 1.00 64.46 63 A 1 ATOM 487 C CE2 . PHE A 1 63 ? 0.131 11.992 -17.991 1.00 64.56 63 A 1 ATOM 488 C CZ . PHE A 1 63 ? 1.043 12.513 -17.058 1.00 66.97 63 A 1 ATOM 489 N N . LEU A 1 64 ? 1.919 6.883 -15.816 1.00 80.84 64 A 1 ATOM 490 C CA . LEU A 1 64 ? 3.321 6.722 -15.423 1.00 79.03 64 A 1 ATOM 491 C C . LEU A 1 64 ? 4.111 5.899 -16.444 1.00 78.22 64 A 1 ATOM 492 O O . LEU A 1 64 ? 5.220 6.280 -16.822 1.00 77.29 64 A 1 ATOM 493 C CB . LEU A 1 64 ? 3.368 6.067 -14.028 1.00 78.47 64 A 1 ATOM 494 C CG . LEU A 1 64 ? 4.787 5.895 -13.470 1.00 74.00 64 A 1 ATOM 495 C CD1 . LEU A 1 64 ? 5.428 7.232 -13.111 1.00 70.20 64 A 1 ATOM 496 C CD2 . LEU A 1 64 ? 4.758 5.028 -12.226 1.00 69.02 64 A 1 ATOM 497 N N . ILE A 1 65 ? 3.559 4.771 -16.915 1.00 79.83 65 A 1 ATOM 498 C CA . ILE A 1 65 ? 4.209 3.903 -17.910 1.00 77.50 65 A 1 ATOM 499 C C . ILE A 1 65 ? 4.324 4.608 -19.264 1.00 76.32 65 A 1 ATOM 500 O O . ILE A 1 65 ? 5.356 4.474 -19.929 1.00 72.85 65 A 1 ATOM 501 C CB . ILE A 1 65 ? 3.456 2.551 -18.011 1.00 77.57 65 A 1 ATOM 502 C CG1 . ILE A 1 65 ? 3.645 1.747 -16.701 1.00 74.18 65 A 1 ATOM 503 C CG2 . ILE A 1 65 ? 3.961 1.720 -19.206 1.00 71.82 65 A 1 ATOM 504 C CD1 . ILE A 1 65 ? 2.740 0.510 -16.595 1.00 67.42 65 A 1 ATOM 505 N N . GLY A 1 66 ? 3.299 5.372 -19.663 1.00 79.37 66 A 1 ATOM 506 C CA . GLY A 1 66 ? 3.269 6.133 -20.909 1.00 76.89 66 A 1 ATOM 507 C C . GLY A 1 66 ? 4.145 7.390 -20.913 1.00 76.26 66 A 1 ATOM 508 O O . GLY A 1 66 ? 4.564 7.839 -21.976 1.00 72.86 66 A 1 ATOM 509 N N . SER A 1 67 ? 4.473 7.947 -19.748 1.00 78.16 67 A 1 ATOM 510 C CA . SER A 1 67 ? 5.266 9.167 -19.627 1.00 75.77 67 A 1 ATOM 511 C C . SER A 1 67 ? 6.724 8.969 -20.092 1.00 73.95 67 A 1 ATOM 512 O O . SER A 1 67 ? 7.359 7.940 -19.844 1.00 69.45 67 A 1 ATOM 513 C CB . SER A 1 67 ? 5.212 9.703 -18.195 1.00 73.43 67 A 1 ATOM 514 O OG . SER A 1 67 ? 5.888 10.939 -18.132 1.00 65.46 67 A 1 ATOM 515 N N . ARG A 1 68 ? 7.267 9.978 -20.775 1.00 74.64 68 A 1 ATOM 516 C CA . ARG A 1 68 ? 8.638 10.008 -21.311 1.00 73.27 68 A 1 ATOM 517 C C . ARG A 1 68 ? 9.506 11.115 -20.698 1.00 74.10 68 A 1 ATOM 518 O O . ARG A 1 68 ? 10.461 11.569 -21.323 1.00 69.20 68 A 1 ATOM 519 C CB . ARG A 1 68 ? 8.610 10.086 -22.855 1.00 69.72 68 A 1 ATOM 520 C CG . ARG A 1 68 ? 7.965 8.863 -23.504 1.00 64.21 68 A 1 ATOM 521 C CD . ARG A 1 68 ? 8.187 8.908 -25.022 1.00 60.30 68 A 1 ATOM 522 N NE . ARG A 1 68 ? 7.580 7.759 -25.695 1.00 55.82 68 A 1 ATOM 523 C CZ . ARG A 1 68 ? 7.838 7.341 -26.930 1.00 48.96 68 A 1 ATOM 524 N NH1 . ARG A 1 68 ? 8.722 7.935 -27.695 1.00 46.45 68 A 1 ATOM 525 N NH2 . ARG A 1 68 ? 7.219 6.308 -27.430 1.00 45.55 68 A 1 ATOM 526 N N . THR A 1 69 ? 9.198 11.553 -19.479 1.00 71.83 69 A 1 ATOM 527 C CA . THR A 1 69 ? 9.965 12.591 -18.788 1.00 70.79 69 A 1 ATOM 528 C C . THR A 1 69 ? 11.413 12.157 -18.530 1.00 72.25 69 A 1 ATOM 529 O O . THR A 1 69 ? 11.710 10.977 -18.298 1.00 68.65 69 A 1 ATOM 530 C CB . THR A 1 69 ? 9.311 13.024 -17.468 1.00 67.56 69 A 1 ATOM 531 O OG1 . THR A 1 69 ? 9.184 11.925 -16.598 1.00 60.35 69 A 1 ATOM 532 C CG2 . THR A 1 69 ? 7.931 13.621 -17.692 1.00 59.92 69 A 1 ATOM 533 N N . ARG A 1 70 ? 12.350 13.119 -18.498 1.00 68.42 70 A 1 ATOM 534 C CA . ARG A 1 70 ? 13.784 12.872 -18.269 1.00 67.60 70 A 1 ATOM 535 C C . ARG A 1 70 ? 14.058 12.163 -16.941 1.00 71.13 70 A 1 ATOM 536 O O . ARG A 1 70 ? 14.951 11.317 -16.859 1.00 69.35 70 A 1 ATOM 537 C CB . ARG A 1 70 ? 14.520 14.218 -18.349 1.00 64.21 70 A 1 ATOM 538 C CG . ARG A 1 70 ? 16.054 14.072 -18.310 1.00 56.58 70 A 1 ATOM 539 C CD . ARG A 1 70 ? 16.704 15.452 -18.415 1.00 53.00 70 A 1 ATOM 540 N NE . ARG A 1 70 ? 18.178 15.371 -18.417 1.00 47.70 70 A 1 ATOM 541 C CZ . ARG A 1 70 ? 19.024 16.394 -18.318 1.00 40.88 70 A 1 ATOM 542 N NH1 . ARG A 1 70 ? 18.596 17.617 -18.161 1.00 37.70 70 A 1 ATOM 543 N NH2 . ARG A 1 70 ? 20.308 16.208 -18.385 1.00 36.61 70 A 1 ATOM 544 N N . ARG A 1 71 ? 13.282 12.475 -15.884 1.00 70.78 71 A 1 ATOM 545 C CA . ARG A 1 71 ? 13.409 11.809 -14.577 1.00 70.38 71 A 1 ATOM 546 C C . ARG A 1 71 ? 12.992 10.343 -14.649 1.00 72.80 71 A 1 ATOM 547 O O . ARG A 1 71 ? 13.694 9.484 -14.115 1.00 72.42 71 A 1 ATOM 548 C CB . ARG A 1 71 ? 12.563 12.531 -13.516 1.00 67.71 71 A 1 ATOM 549 C CG . ARG A 1 71 ? 13.156 13.895 -13.133 1.00 62.64 71 A 1 ATOM 550 C CD . ARG A 1 71 ? 12.319 14.514 -12.010 1.00 60.76 71 A 1 ATOM 551 N NE . ARG A 1 71 ? 12.864 15.816 -11.567 1.00 57.85 71 A 1 ATOM 552 C CZ . ARG A 1 71 ? 12.426 16.510 -10.539 1.00 51.77 71 A 1 ATOM 553 N NH1 . ARG A 1 71 ? 11.439 16.095 -9.786 1.00 49.72 71 A 1 ATOM 554 N NH2 . ARG A 1 71 ? 12.974 17.646 -10.227 1.00 46.85 71 A 1 ATOM 555 N N . LEU A 1 72 ? 11.903 10.033 -15.348 1.00 73.70 72 A 1 ATOM 556 C CA . LEU A 1 72 ? 11.441 8.659 -15.516 1.00 74.13 72 A 1 ATOM 557 C C . LEU A 1 72 ? 12.412 7.844 -16.382 1.00 76.48 72 A 1 ATOM 558 O O . LEU A 1 72 ? 12.667 6.684 -16.069 1.00 76.00 72 A 1 ATOM 559 C CB . LEU A 1 72 ? 10.024 8.686 -16.103 1.00 72.30 72 A 1 ATOM 560 C CG . LEU A 1 72 ? 9.329 7.316 -16.023 1.00 67.08 72 A 1 ATOM 561 C CD1 . LEU A 1 72 ? 9.042 6.888 -14.582 1.00 62.52 72 A 1 ATOM 562 C CD2 . LEU A 1 72 ? 7.999 7.380 -16.756 1.00 63.46 72 A 1 ATOM 563 N N . ALA A 1 73 ? 13.011 8.458 -17.401 1.00 78.11 73 A 1 ATOM 564 C CA . ALA A 1 73 ? 14.059 7.832 -18.205 1.00 78.01 73 A 1 ATOM 565 C C . ALA A 1 73 ? 15.260 7.413 -17.333 1.00 78.56 73 A 1 ATOM 566 O O . ALA A 1 73 ? 15.671 6.258 -17.384 1.00 76.96 73 A 1 ATOM 567 C CB . ALA A 1 73 ? 14.466 8.781 -19.331 1.00 77.42 73 A 1 ATOM 568 N N . LYS A 1 74 ? 15.743 8.293 -16.439 1.00 77.07 74 A 1 ATOM 569 C CA . LYS A 1 74 ? 16.807 7.969 -15.475 1.00 76.00 74 A 1 ATOM 570 C C . LYS A 1 74 ? 16.409 6.828 -14.527 1.00 77.34 74 A 1 ATOM 571 O O . LYS A 1 74 ? 17.194 5.921 -14.293 1.00 76.39 74 A 1 ATOM 572 C CB . LYS A 1 74 ? 17.189 9.207 -14.656 1.00 74.91 74 A 1 ATOM 573 C CG . LYS A 1 74 ? 17.992 10.229 -15.481 1.00 68.70 74 A 1 ATOM 574 C CD . LYS A 1 74 ? 18.395 11.411 -14.593 1.00 65.58 74 A 1 ATOM 575 C CE . LYS A 1 74 ? 19.266 12.393 -15.375 1.00 59.89 74 A 1 ATOM 576 N NZ . LYS A 1 74 ? 19.803 13.470 -14.502 1.00 52.50 74 A 1 ATOM 577 N N . ILE A 1 75 ? 15.186 6.829 -14.008 1.00 76.98 75 A 1 ATOM 578 C CA . ILE A 1 75 ? 14.698 5.749 -13.118 1.00 75.96 75 A 1 ATOM 579 C C . ILE A 1 75 ? 14.688 4.395 -13.834 1.00 77.49 75 A 1 ATOM 580 O O . ILE A 1 75 ? 15.035 3.378 -13.228 1.00 76.48 75 A 1 ATOM 581 C CB . ILE A 1 75 ? 13.321 6.128 -12.537 1.00 74.67 75 A 1 ATOM 582 C CG1 . ILE A 1 75 ? 13.534 7.249 -11.499 1.00 70.10 75 A 1 ATOM 583 C CG2 . ILE A 1 75 ? 12.605 4.929 -11.890 1.00 67.95 75 A 1 ATOM 584 C CD1 . ILE A 1 75 ? 12.237 7.809 -10.918 1.00 64.46 75 A 1 ATOM 585 N N . ARG A 1 76 ? 14.318 4.384 -15.125 1.00 74.84 76 A 1 ATOM 586 C CA . ARG A 1 76 ? 14.368 3.178 -15.961 1.00 73.55 76 A 1 ATOM 587 C C . ARG A 1 76 ? 15.813 2.726 -16.193 1.00 73.80 76 A 1 ATOM 588 O O . ARG A 1 76 ? 16.095 1.536 -16.007 1.00 72.41 76 A 1 ATOM 589 C CB . ARG A 1 76 ? 13.665 3.437 -17.303 1.00 73.52 76 A 1 ATOM 590 C CG . ARG A 1 76 ? 12.137 3.541 -17.159 1.00 67.32 76 A 1 ATOM 591 C CD . ARG A 1 76 ? 11.499 3.913 -18.501 1.00 66.74 76 A 1 ATOM 592 N NE . ARG A 1 76 ? 10.027 4.067 -18.386 1.00 62.51 76 A 1 ATOM 593 C CZ . ARG A 1 76 ? 9.183 4.393 -19.351 1.00 54.83 76 A 1 ATOM 594 N NH1 . ARG A 1 76 ? 9.571 4.594 -20.574 1.00 53.38 76 A 1 ATOM 595 N NH2 . ARG A 1 76 ? 7.917 4.527 -19.098 1.00 49.98 76 A 1 ATOM 596 N N . GLU A 1 77 ? 16.719 3.653 -16.506 1.00 74.50 77 A 1 ATOM 597 C CA . GLU A 1 77 ? 18.143 3.385 -16.737 1.00 74.61 77 A 1 ATOM 598 C C . GLU A 1 77 ? 18.820 2.798 -15.492 1.00 73.38 77 A 1 ATOM 599 O O . GLU A 1 77 ? 19.487 1.760 -15.559 1.00 70.27 77 A 1 ATOM 600 C CB . GLU A 1 77 ? 18.804 4.702 -17.164 1.00 73.63 77 A 1 ATOM 601 C CG . GLU A 1 77 ? 20.261 4.535 -17.621 1.00 64.61 77 A 1 ATOM 602 C CD . GLU A 1 77 ? 20.907 5.867 -18.030 1.00 62.64 77 A 1 ATOM 603 O OE1 . GLU A 1 77 ? 22.078 5.817 -18.453 1.00 56.93 77 A 1 ATOM 604 O OE2 . GLU A 1 77 ? 20.254 6.932 -17.885 1.00 60.65 77 A 1 ATOM 605 N N . TYR A 1 78 ? 18.563 3.375 -14.308 1.00 74.97 78 A 1 ATOM 606 C CA . TYR A 1 78 ? 19.069 2.838 -13.039 1.00 74.06 78 A 1 ATOM 607 C C . TYR A 1 78 ? 18.354 1.549 -12.580 1.00 73.29 78 A 1 ATOM 608 O O . TYR A 1 78 ? 18.770 0.930 -11.596 1.00 68.82 78 A 1 ATOM 609 C CB . TYR A 1 78 ? 19.036 3.932 -11.967 1.00 73.68 78 A 1 ATOM 610 C CG . TYR A 1 78 ? 19.986 5.092 -12.242 1.00 69.74 78 A 1 ATOM 611 C CD1 . TYR A 1 78 ? 21.372 4.852 -12.350 1.00 65.31 78 A 1 ATOM 612 C CD2 . TYR A 1 78 ? 19.495 6.398 -12.374 1.00 64.09 78 A 1 ATOM 613 C CE1 . TYR A 1 78 ? 22.257 5.920 -12.627 1.00 59.19 78 A 1 ATOM 614 C CE2 . TYR A 1 78 ? 20.370 7.469 -12.652 1.00 59.66 78 A 1 ATOM 615 C CZ . TYR A 1 78 ? 21.753 7.229 -12.788 1.00 58.84 78 A 1 ATOM 616 O OH . TYR A 1 78 ? 22.593 8.253 -13.075 1.00 58.32 78 A 1 ATOM 617 N N . GLY A 1 79 ? 17.294 1.112 -13.249 1.00 73.79 79 A 1 ATOM 618 C CA . GLY A 1 79 ? 16.560 -0.124 -12.950 1.00 72.41 79 A 1 ATOM 619 C C . GLY A 1 79 ? 15.656 -0.048 -11.709 1.00 73.79 79 A 1 ATOM 620 O O . GLY A 1 79 ? 15.266 -1.089 -11.178 1.00 69.52 79 A 1 ATOM 621 N N . TYR A 1 80 ? 15.307 1.160 -11.237 1.00 73.54 80 A 1 ATOM 622 C CA . TYR A 1 80 ? 14.364 1.368 -10.129 1.00 73.98 80 A 1 ATOM 623 C C . TYR A 1 80 ? 12.893 1.324 -10.559 1.00 76.45 80 A 1 ATOM 624 O O . TYR A 1 80 ? 12.013 1.313 -9.708 1.00 74.78 80 A 1 ATOM 625 C CB . TYR A 1 80 ? 14.685 2.670 -9.392 1.00 71.19 80 A 1 ATOM 626 C CG . TYR A 1 80 ? 15.948 2.605 -8.561 1.00 65.77 80 A 1 ATOM 627 C CD1 . TYR A 1 80 ? 15.947 1.900 -7.336 1.00 61.58 80 A 1 ATOM 628 C CD2 . TYR A 1 80 ? 17.125 3.253 -8.982 1.00 59.65 80 A 1 ATOM 629 C CE1 . TYR A 1 80 ? 17.110 1.838 -6.554 1.00 53.41 80 A 1 ATOM 630 C CE2 . TYR A 1 80 ? 18.295 3.183 -8.211 1.00 53.62 80 A 1 ATOM 631 C CZ . TYR A 1 80 ? 18.296 2.478 -6.990 1.00 54.36 80 A 1 ATOM 632 O OH . TYR A 1 80 ? 19.422 2.404 -6.242 1.00 53.37 80 A 1 ATOM 633 N N . MET A 1 81 ? 12.620 1.241 -11.869 1.00 75.31 81 A 1 ATOM 634 C CA . MET A 1 81 ? 11.241 1.132 -12.382 1.00 76.97 81 A 1 ATOM 635 C C . MET A 1 81 ? 10.514 -0.090 -11.806 1.00 78.60 81 A 1 ATOM 636 O O . MET A 1 81 ? 9.332 0.001 -11.483 1.00 76.89 81 A 1 ATOM 637 C CB . MET A 1 81 ? 11.278 1.073 -13.918 1.00 74.74 81 A 1 ATOM 638 C CG . MET A 1 81 ? 9.885 1.241 -14.524 1.00 70.15 81 A 1 ATOM 639 S SD . MET A 1 81 ? 9.150 2.874 -14.214 1.00 66.20 81 A 1 ATOM 640 C CE . MET A 1 81 ? 7.464 2.593 -14.835 1.00 59.59 81 A 1 ATOM 641 N N . THR A 1 82 ? 11.224 -1.202 -11.586 1.00 79.56 82 A 1 ATOM 642 C CA . THR A 1 82 ? 10.663 -2.407 -10.958 1.00 79.31 82 A 1 ATOM 643 C C . THR A 1 82 ? 10.130 -2.125 -9.551 1.00 80.40 82 A 1 ATOM 644 O O . THR A 1 82 ? 9.046 -2.588 -9.211 1.00 79.15 82 A 1 ATOM 645 C CB . THR A 1 82 ? 11.717 -3.522 -10.888 1.00 78.22 82 A 1 ATOM 646 O OG1 . THR A 1 82 ? 12.321 -3.689 -12.149 1.00 70.21 82 A 1 ATOM 647 C CG2 . THR A 1 82 ? 11.129 -4.871 -10.484 1.00 68.88 82 A 1 ATOM 648 N N . SER A 1 83 ? 10.841 -1.339 -8.736 1.00 79.23 83 A 1 ATOM 649 C CA . SER A 1 83 ? 10.372 -0.964 -7.394 1.00 79.11 83 A 1 ATOM 650 C C . SER A 1 83 ? 9.108 -0.116 -7.448 1.00 80.77 83 A 1 ATOM 651 O O . SER A 1 83 ? 8.198 -0.343 -6.656 1.00 79.55 83 A 1 ATOM 652 C CB . SER A 1 83 ? 11.435 -0.173 -6.640 1.00 77.20 83 A 1 ATOM 653 O OG . SER A 1 83 ? 12.605 -0.940 -6.530 1.00 66.97 83 A 1 ATOM 654 N N . VAL A 1 84 ? 9.037 0.819 -8.397 1.00 81.33 84 A 1 ATOM 655 C CA . VAL A 1 84 ? 7.848 1.657 -8.597 1.00 81.43 84 A 1 ATOM 656 C C . VAL A 1 84 ? 6.647 0.780 -8.961 1.00 83.05 84 A 1 ATOM 657 O O . VAL A 1 84 ? 5.625 0.834 -8.278 1.00 83.09 84 A 1 ATOM 658 C CB . VAL A 1 84 ? 8.102 2.737 -9.663 1.00 80.75 84 A 1 ATOM 659 C CG1 . VAL A 1 84 ? 6.867 3.601 -9.900 1.00 76.70 84 A 1 ATOM 660 C CG2 . VAL A 1 84 ? 9.253 3.670 -9.251 1.00 76.91 84 A 1 ATOM 661 N N . VAL A 1 85 ? 6.788 -0.104 -9.960 1.00 82.64 85 A 1 ATOM 662 C CA . VAL A 1 85 ? 5.715 -1.015 -10.384 1.00 82.93 85 A 1 ATOM 663 C C . VAL A 1 85 ? 5.270 -1.936 -9.245 1.00 85.02 85 A 1 ATOM 664 O O . VAL A 1 85 ? 4.072 -2.159 -9.079 1.00 85.59 85 A 1 ATOM 665 C CB . VAL A 1 85 ? 6.142 -1.828 -11.620 1.00 81.60 85 A 1 ATOM 666 C CG1 . VAL A 1 85 ? 5.109 -2.893 -12.023 1.00 76.63 85 A 1 ATOM 667 C CG2 . VAL A 1 85 ? 6.313 -0.898 -12.835 1.00 75.85 85 A 1 ATOM 668 N N . ILE A 1 86 ? 6.201 -2.438 -8.421 1.00 84.45 86 A 1 ATOM 669 C CA . ILE A 1 86 ? 5.873 -3.270 -7.249 1.00 85.11 86 A 1 ATOM 670 C C . ILE A 1 86 ? 4.994 -2.505 -6.259 1.00 87.17 86 A 1 ATOM 671 O O . ILE A 1 86 ? 4.019 -3.066 -5.773 1.00 87.53 86 A 1 ATOM 672 C CB . ILE A 1 86 ? 7.158 -3.812 -6.577 1.00 84.10 86 A 1 ATOM 673 C CG1 . ILE A 1 86 ? 7.768 -4.931 -7.457 1.00 78.57 86 A 1 ATOM 674 C CG2 . ILE A 1 86 ? 6.896 -4.354 -5.162 1.00 76.48 86 A 1 ATOM 675 C CD1 . ILE A 1 86 ? 9.205 -5.307 -7.069 1.00 69.65 86 A 1 ATOM 676 N N . VAL A 1 87 ? 5.285 -1.231 -5.963 1.00 86.60 87 A 1 ATOM 677 C CA . VAL A 1 87 ? 4.462 -0.424 -5.054 1.00 87.08 87 A 1 ATOM 678 C C . VAL A 1 87 ? 3.040 -0.282 -5.599 1.00 89.01 87 A 1 ATOM 679 O O . VAL A 1 87 ? 2.087 -0.554 -4.876 1.00 89.26 87 A 1 ATOM 680 C CB . VAL A 1 87 ? 5.086 0.946 -4.760 1.00 86.08 87 A 1 ATOM 681 C CG1 . VAL A 1 87 ? 4.204 1.795 -3.843 1.00 81.74 87 A 1 ATOM 682 C CG2 . VAL A 1 87 ? 6.431 0.797 -4.042 1.00 81.43 87 A 1 ATOM 683 N N . TYR A 1 88 ? 2.891 0.055 -6.890 1.00 88.01 88 A 1 ATOM 684 C CA . TYR A 1 88 ? 1.573 0.146 -7.523 1.00 88.74 88 A 1 ATOM 685 C C . TYR A 1 88 ? 0.820 -1.199 -7.499 1.00 90.65 88 A 1 ATOM 686 O O . TYR A 1 88 ? -0.373 -1.221 -7.199 1.00 90.81 88 A 1 ATOM 687 C CB . TYR A 1 88 ? 1.702 0.647 -8.965 1.00 87.95 88 A 1 ATOM 688 C CG . TYR A 1 88 ? 1.793 2.158 -9.096 1.00 85.85 88 A 1 ATOM 689 C CD1 . TYR A 1 88 ? 0.670 2.892 -9.545 1.00 81.84 88 A 1 ATOM 690 C CD2 . TYR A 1 88 ? 2.975 2.844 -8.789 1.00 81.49 88 A 1 ATOM 691 C CE1 . TYR A 1 88 ? 0.739 4.291 -9.681 1.00 77.86 88 A 1 ATOM 692 C CE2 . TYR A 1 88 ? 3.054 4.241 -8.917 1.00 78.52 88 A 1 ATOM 693 C CZ . TYR A 1 88 ? 1.935 4.972 -9.366 1.00 79.60 88 A 1 ATOM 694 O OH . TYR A 1 88 ? 2.014 6.317 -9.492 1.00 76.89 88 A 1 ATOM 695 N N . ALA A 1 89 ? 1.503 -2.316 -7.759 1.00 89.55 89 A 1 ATOM 696 C CA . ALA A 1 89 ? 0.906 -3.653 -7.710 1.00 89.55 89 A 1 ATOM 697 C C . ALA A 1 89 ? 0.450 -4.037 -6.294 1.00 91.22 89 A 1 ATOM 698 O O . ALA A 1 89 ? -0.647 -4.556 -6.130 1.00 91.29 89 A 1 ATOM 699 C CB . ALA A 1 89 ? 1.921 -4.659 -8.271 1.00 88.34 89 A 1 ATOM 700 N N . LEU A 1 90 ? 1.256 -3.735 -5.273 1.00 90.39 90 A 1 ATOM 701 C CA . LEU A 1 90 ? 0.884 -3.986 -3.879 1.00 91.01 90 A 1 ATOM 702 C C . LEU A 1 90 ? -0.302 -3.120 -3.443 1.00 92.42 90 A 1 ATOM 703 O O . LEU A 1 90 ? -1.236 -3.655 -2.853 1.00 92.35 90 A 1 ATOM 704 C CB . LEU A 1 90 ? 2.104 -3.769 -2.962 1.00 90.28 90 A 1 ATOM 705 C CG . LEU A 1 90 ? 3.183 -4.857 -3.077 1.00 83.71 90 A 1 ATOM 706 C CD1 . LEU A 1 90 ? 4.404 -4.465 -2.234 1.00 78.39 90 A 1 ATOM 707 C CD2 . LEU A 1 90 ? 2.705 -6.229 -2.590 1.00 77.48 90 A 1 ATOM 708 N N . SER A 1 91 ? -0.327 -1.838 -3.809 1.00 91.83 91 A 1 ATOM 709 C CA . SER A 1 91 ? -1.482 -0.969 -3.552 1.00 92.59 91 A 1 ATOM 710 C C . SER A 1 91 ? -2.745 -1.446 -4.276 1.00 93.71 91 A 1 ATOM 711 O O . SER A 1 91 ? -3.842 -1.342 -3.744 1.00 93.38 91 A 1 ATOM 712 C CB . SER A 1 91 ? -1.173 0.469 -3.970 1.00 92.07 91 A 1 ATOM 713 O OG . SER A 1 91 ? -0.069 0.972 -3.252 1.00 83.65 91 A 1 ATOM 714 N N . PHE A 1 92 ? -2.614 -2.023 -5.473 1.00 92.59 92 A 1 ATOM 715 C CA . PHE A 1 92 ? -3.739 -2.627 -6.180 1.00 92.81 92 A 1 ATOM 716 C C . PHE A 1 92 ? -4.297 -3.845 -5.429 1.00 94.14 92 A 1 ATOM 717 O O . PHE A 1 92 ? -5.510 -3.955 -5.244 1.00 94.09 92 A 1 ATOM 718 C CB . PHE A 1 92 ? -3.311 -2.995 -7.609 1.00 91.38 92 A 1 ATOM 719 C CG . PHE A 1 92 ? -4.419 -3.604 -8.435 1.00 84.90 92 A 1 ATOM 720 C CD1 . PHE A 1 92 ? -4.626 -5.001 -8.441 1.00 78.55 92 A 1 ATOM 721 C CD2 . PHE A 1 92 ? -5.284 -2.773 -9.179 1.00 79.14 92 A 1 ATOM 722 C CE1 . PHE A 1 92 ? -5.682 -5.556 -9.182 1.00 72.07 92 A 1 ATOM 723 C CE2 . PHE A 1 92 ? -6.340 -3.332 -9.925 1.00 73.01 92 A 1 ATOM 724 C CZ . PHE A 1 92 ? -6.539 -4.719 -9.921 1.00 72.93 92 A 1 ATOM 725 N N . VAL A 1 93 ? -3.428 -4.741 -4.945 1.00 94.35 93 A 1 ATOM 726 C CA . VAL A 1 93 ? -3.822 -5.906 -4.136 1.00 94.33 93 A 1 ATOM 727 C C . VAL A 1 93 ? -4.479 -5.465 -2.822 1.00 94.87 93 A 1 ATOM 728 O O . VAL A 1 93 ? -5.496 -6.028 -2.431 1.00 94.68 93 A 1 ATOM 729 C CB . VAL A 1 93 ? -2.615 -6.822 -3.865 1.00 93.98 93 A 1 ATOM 730 C CG1 . VAL A 1 93 ? -2.926 -7.952 -2.880 1.00 90.39 93 A 1 ATOM 731 C CG2 . VAL A 1 93 ? -2.137 -7.481 -5.169 1.00 89.99 93 A 1 ATOM 732 N N . GLU A 1 94 ? -3.934 -4.436 -2.171 1.00 93.29 94 A 1 ATOM 733 C CA . GLU A 1 94 ? -4.482 -3.843 -0.952 1.00 93.28 94 A 1 ATOM 734 C C . GLU A 1 94 ? -5.909 -3.310 -1.164 1.00 93.53 94 A 1 ATOM 735 O O . GLU A 1 94 ? -6.815 -3.654 -0.410 1.00 93.24 94 A 1 ATOM 736 C CB . GLU A 1 94 ? -3.526 -2.725 -0.505 1.00 91.88 94 A 1 ATOM 737 C CG . GLU A 1 94 ? -4.027 -1.955 0.713 1.00 85.95 94 A 1 ATOM 738 C CD . GLU A 1 94 ? -3.062 -0.820 1.077 1.00 85.93 94 A 1 ATOM 739 O OE1 . GLU A 1 94 ? -2.801 -0.640 2.279 1.00 74.37 94 A 1 ATOM 740 O OE2 . GLU A 1 94 ? -2.565 -0.136 0.154 1.00 76.58 94 A 1 ATOM 741 N N . LEU A 1 95 ? -6.144 -2.531 -2.226 1.00 94.69 95 A 1 ATOM 742 C CA . LEU A 1 95 ? -7.471 -2.026 -2.568 1.00 94.74 95 A 1 ATOM 743 C C . LEU A 1 95 ? -8.438 -3.153 -2.953 1.00 95.42 95 A 1 ATOM 744 O O . LEU A 1 95 ? -9.614 -3.099 -2.599 1.00 95.19 95 A 1 ATOM 745 C CB . LEU A 1 95 ? -7.340 -1.012 -3.712 1.00 94.58 95 A 1 ATOM 746 C CG . LEU A 1 95 ? -6.696 0.329 -3.320 1.00 93.33 95 A 1 ATOM 747 C CD1 . LEU A 1 95 ? -6.466 1.148 -4.588 1.00 89.98 95 A 1 ATOM 748 C CD2 . LEU A 1 95 ? -7.592 1.144 -2.386 1.00 90.03 95 A 1 ATOM 749 N N . GLY A 1 96 ? -7.950 -4.202 -3.623 1.00 95.58 96 A 1 ATOM 750 C CA . GLY A 1 96 ? -8.729 -5.415 -3.889 1.00 94.52 96 A 1 ATOM 751 C C . GLY A 1 96 ? -9.156 -6.121 -2.596 1.00 94.88 96 A 1 ATOM 752 O O . GLY A 1 96 ? -10.331 -6.429 -2.423 1.00 94.47 96 A 1 ATOM 753 N N . ALA A 1 97 ? -8.232 -6.297 -1.644 1.00 95.26 97 A 1 ATOM 754 C CA . ALA A 1 97 ? -8.539 -6.863 -0.338 1.00 94.01 97 A 1 ATOM 755 C C . ALA A 1 97 ? -9.559 -6.006 0.426 1.00 93.74 97 A 1 ATOM 756 O O . ALA A 1 97 ? -10.504 -6.536 1.007 1.00 92.42 97 A 1 ATOM 757 C CB . ALA A 1 97 ? -7.237 -7.029 0.452 1.00 93.39 97 A 1 ATOM 758 N N . LEU A 1 98 ? -9.430 -4.670 0.368 1.00 93.57 98 A 1 ATOM 759 C CA . LEU A 1 98 ? -10.385 -3.743 0.955 1.00 93.35 98 A 1 ATOM 760 C C . LEU A 1 98 ? -11.772 -3.866 0.327 1.00 93.43 98 A 1 ATOM 761 O O . LEU A 1 98 ? -12.769 -3.891 1.056 1.00 93.29 98 A 1 ATOM 762 C CB . LEU A 1 98 ? -9.841 -2.314 0.827 1.00 93.23 98 A 1 ATOM 763 C CG . LEU A 1 98 ? -10.765 -1.258 1.455 1.00 90.51 98 A 1 ATOM 764 C CD1 . LEU A 1 98 ? -10.960 -1.475 2.956 1.00 85.82 98 A 1 ATOM 765 C CD2 . LEU A 1 98 ? -10.159 0.134 1.237 1.00 86.39 98 A 1 ATOM 766 N N . PHE A 1 99 ? -11.858 -3.991 -0.998 1.00 94.36 99 A 1 ATOM 767 C CA . PHE A 1 99 ? -13.113 -4.211 -1.711 1.00 92.94 99 A 1 ATOM 768 C C . PHE A 1 99 ? -13.821 -5.477 -1.212 1.00 92.89 99 A 1 ATOM 769 O O . PHE A 1 99 ? -14.997 -5.423 -0.850 1.00 93.32 99 A 1 ATOM 770 C CB . PHE A 1 99 ? -12.837 -4.286 -3.213 1.00 93.55 99 A 1 ATOM 771 C CG . PHE A 1 99 ? -14.074 -4.539 -4.046 1.00 93.58 99 A 1 ATOM 772 C CD1 . PHE A 1 99 ? -14.394 -5.846 -4.465 1.00 89.99 99 A 1 ATOM 773 C CD2 . PHE A 1 99 ? -14.927 -3.474 -4.385 1.00 91.29 99 A 1 ATOM 774 C CE1 . PHE A 1 99 ? -15.558 -6.081 -5.225 1.00 87.59 99 A 1 ATOM 775 C CE2 . PHE A 1 99 ? -16.082 -3.707 -5.141 1.00 88.35 99 A 1 ATOM 776 C CZ . PHE A 1 99 ? -16.393 -5.006 -5.559 1.00 88.40 99 A 1 ATOM 777 N N . PHE A 1 100 ? -13.100 -6.603 -1.100 1.00 94.08 100 A 1 ATOM 778 C CA . PHE A 1 100 ? -13.657 -7.843 -0.569 1.00 92.64 100 A 1 ATOM 779 C C . PHE A 1 100 ? -14.047 -7.735 0.908 1.00 92.07 100 A 1 ATOM 780 O O . PHE A 1 100 ? -15.093 -8.253 1.295 1.00 91.50 100 A 1 ATOM 781 C CB . PHE A 1 100 ? -12.682 -9.005 -0.783 1.00 92.15 100 A 1 ATOM 782 C CG . PHE A 1 100 ? -12.629 -9.496 -2.223 1.00 86.79 100 A 1 ATOM 783 C CD1 . PHE A 1 100 ? -13.739 -10.142 -2.790 1.00 79.68 100 A 1 ATOM 784 C CD2 . PHE A 1 100 ? -11.470 -9.302 -3.000 1.00 80.08 100 A 1 ATOM 785 C CE1 . PHE A 1 100 ? -13.704 -10.576 -4.120 1.00 74.40 100 A 1 ATOM 786 C CE2 . PHE A 1 100 ? -11.434 -9.739 -4.331 1.00 75.74 100 A 1 ATOM 787 C CZ . PHE A 1 100 ? -12.553 -10.367 -4.887 1.00 76.76 100 A 1 ATOM 788 N N . CYS A 1 101 ? -13.279 -7.026 1.745 1.00 93.50 101 A 1 ATOM 789 C CA . CYS A 1 101 ? -13.679 -6.731 3.121 1.00 92.30 101 A 1 ATOM 790 C C . CYS A 1 101 ? -14.996 -5.948 3.170 1.00 92.10 101 A 1 ATOM 791 O O . CYS A 1 101 ? -15.850 -6.254 3.994 1.00 91.17 101 A 1 ATOM 792 C CB . CYS A 1 101 ? -12.566 -5.950 3.837 1.00 91.51 101 A 1 ATOM 793 S SG . CYS A 1 101 ? -11.150 -7.027 4.193 1.00 85.95 101 A 1 ATOM 794 N N . GLY A 1 102 ? -15.184 -4.982 2.273 1.00 93.57 102 A 1 ATOM 795 C CA . GLY A 1 102 ? -16.439 -4.247 2.132 1.00 91.84 102 A 1 ATOM 796 C C . GLY A 1 102 ? -17.612 -5.160 1.771 1.00 91.99 102 A 1 ATOM 797 O O . GLY A 1 102 ? -18.647 -5.112 2.432 1.00 91.10 102 A 1 ATOM 798 N N . LEU A 1 103 ? -17.438 -6.074 0.806 1.00 93.65 103 A 1 ATOM 799 C CA . LEU A 1 103 ? -18.458 -7.074 0.451 1.00 92.56 103 A 1 ATOM 800 C C . LEU A 1 103 ? -18.764 -8.033 1.610 1.00 91.65 103 A 1 ATOM 801 O O . LEU A 1 103 ? -19.923 -8.357 1.848 1.00 90.75 103 A 1 ATOM 802 C CB . LEU A 1 103 ? -18.008 -7.884 -0.776 1.00 92.66 103 A 1 ATOM 803 C CG . LEU A 1 103 ? -17.893 -7.106 -2.095 1.00 87.79 103 A 1 ATOM 804 C CD1 . LEU A 1 103 ? -17.486 -8.081 -3.201 1.00 82.82 103 A 1 ATOM 805 C CD2 . LEU A 1 103 ? -19.200 -6.430 -2.502 1.00 82.80 103 A 1 ATOM 806 N N . LEU A 1 104 ? -17.752 -8.458 2.367 1.00 92.69 104 A 1 ATOM 807 C CA . LEU A 1 104 ? -17.946 -9.307 3.545 1.00 91.03 104 A 1 ATOM 808 C C . LEU A 1 104 ? -18.721 -8.588 4.650 1.00 90.19 104 A 1 ATOM 809 O O . LEU A 1 104 ? -19.479 -9.230 5.377 1.00 89.08 104 A 1 ATOM 810 C CB . LEU A 1 104 ? -16.580 -9.780 4.072 1.00 90.42 104 A 1 ATOM 811 C CG . LEU A 1 104 ? -15.884 -10.838 3.200 1.00 85.16 104 A 1 ATOM 812 C CD1 . LEU A 1 104 ? -14.487 -11.104 3.764 1.00 79.67 104 A 1 ATOM 813 C CD2 . LEU A 1 104 ? -16.640 -12.161 3.164 1.00 78.64 104 A 1 ATOM 814 N N . LEU A 1 105 ? -18.581 -7.267 4.779 1.00 90.56 105 A 1 ATOM 815 C CA . LEU A 1 105 ? -19.373 -6.475 5.733 1.00 89.51 105 A 1 ATOM 816 C C . LEU A 1 105 ? -20.857 -6.421 5.369 1.00 88.58 105 A 1 ATOM 817 O O . LEU A 1 105 ? -21.675 -6.345 6.280 1.00 87.32 105 A 1 ATOM 818 C CB . LEU A 1 105 ? -18.798 -5.059 5.831 1.00 89.00 105 A 1 ATOM 819 C CG . LEU A 1 105 ? -17.498 -4.975 6.650 1.00 87.37 105 A 1 ATOM 820 C CD1 . LEU A 1 105 ? -16.882 -3.588 6.506 1.00 82.76 105 A 1 ATOM 821 C CD2 . LEU A 1 105 ? -17.765 -5.222 8.127 1.00 83.34 105 A 1 ATOM 822 N N . LEU A 1 106 ? -21.214 -6.514 4.076 1.00 91.52 106 A 1 ATOM 823 C CA . LEU A 1 106 ? -22.591 -6.614 3.588 1.00 89.88 106 A 1 ATOM 824 C C . LEU A 1 106 ? -23.197 -8.013 3.773 1.00 88.42 106 A 1 ATOM 825 O O . LEU A 1 106 ? -24.402 -8.197 3.596 1.00 84.74 106 A 1 ATOM 826 C CB . LEU A 1 106 ? -22.634 -6.218 2.099 1.00 89.56 106 A 1 ATOM 827 C CG . LEU A 1 106 ? -22.176 -4.783 1.784 1.00 87.89 106 A 1 ATOM 828 C CD1 . LEU A 1 106 ? -22.105 -4.579 0.272 1.00 82.43 106 A 1 ATOM 829 C CD2 . LEU A 1 106 ? -23.144 -3.753 2.359 1.00 82.31 106 A 1 ATOM 830 N N . SER A 1 107 ? -22.388 -9.023 4.107 1.00 88.68 107 A 1 ATOM 831 C CA . SER A 1 107 ? -22.864 -10.381 4.356 1.00 85.09 107 A 1 ATOM 832 C C . SER A 1 107 ? -23.333 -10.566 5.805 1.00 83.13 107 A 1 ATOM 833 O O . SER A 1 107 ? -23.012 -9.781 6.697 1.00 79.54 107 A 1 ATOM 834 C CB . SER A 1 107 ? -21.782 -11.399 3.972 1.00 83.83 107 A 1 ATOM 835 O OG . SER A 1 107 ? -20.809 -11.504 4.990 1.00 74.75 107 A 1 ATOM 836 N N . SER A 1 108 ? -24.041 -11.662 6.071 1.00 79.68 108 A 1 ATOM 837 C CA . SER A 1 108 ? -24.519 -12.041 7.405 1.00 76.88 108 A 1 ATOM 838 C C . SER A 1 108 ? -23.425 -12.532 8.366 1.00 76.43 108 A 1 ATOM 839 O O . SER A 1 108 ? -23.729 -13.016 9.459 1.00 72.88 108 A 1 ATOM 840 C CB . SER A 1 108 ? -25.627 -13.086 7.260 1.00 74.64 108 A 1 ATOM 841 O OG . SER A 1 108 ? -25.152 -14.212 6.552 1.00 66.35 108 A 1 ATOM 842 N N . ILE A 1 109 ? -22.138 -12.440 7.992 1.00 77.50 109 A 1 ATOM 843 C CA . ILE A 1 109 ? -21.017 -12.891 8.815 1.00 77.29 109 A 1 ATOM 844 C C . ILE A 1 109 ? -20.896 -11.992 10.048 1.00 76.97 109 A 1 ATOM 845 O O . ILE A 1 109 ? -20.531 -10.820 9.940 1.00 73.58 109 A 1 ATOM 846 C CB . ILE A 1 109 ? -19.701 -12.930 7.993 1.00 75.26 109 A 1 ATOM 847 C CG1 . ILE A 1 109 ? -19.800 -13.997 6.878 1.00 68.90 109 A 1 ATOM 848 C CG2 . ILE A 1 109 ? -18.501 -13.225 8.903 1.00 66.75 109 A 1 ATOM 849 C CD1 . ILE A 1 109 ? -18.603 -14.011 5.913 1.00 62.69 109 A 1 ATOM 850 N N . SER A 1 110 ? -21.128 -12.534 11.236 1.00 79.44 110 A 1 ATOM 851 C CA . SER A 1 110 ? -20.995 -11.834 12.516 1.00 76.46 110 A 1 ATOM 852 C C . SER A 1 110 ? -19.868 -12.421 13.379 1.00 75.16 110 A 1 ATOM 853 O O . SER A 1 110 ? -19.390 -13.522 13.126 1.00 66.83 110 A 1 ATOM 854 C CB . SER A 1 110 ? -22.347 -11.813 13.236 1.00 71.95 110 A 1 ATOM 855 O OG . SER A 1 110 ? -22.763 -13.120 13.543 1.00 62.67 110 A 1 ATOM 856 N N . GLY A 1 111 ? -19.405 -11.679 14.381 1.00 71.83 111 A 1 ATOM 857 C CA . GLY A 1 111 ? -18.397 -12.147 15.349 1.00 69.48 111 A 1 ATOM 858 C C . GLY A 1 111 ? -16.925 -11.929 14.967 1.00 71.38 111 A 1 ATOM 859 O O . GLY A 1 111 ? -16.060 -12.074 15.820 1.00 65.09 111 A 1 ATOM 860 N N . TYR A 1 112 ? -16.614 -11.511 13.752 1.00 74.34 112 A 1 ATOM 861 C CA . TYR A 1 112 ? -15.243 -11.202 13.321 1.00 75.47 112 A 1 ATOM 862 C C . TYR A 1 112 ? -14.939 -9.695 13.381 1.00 78.27 112 A 1 ATOM 863 O O . TYR A 1 112 ? -15.825 -8.852 13.209 1.00 75.29 112 A 1 ATOM 864 C CB . TYR A 1 112 ? -15.000 -11.764 11.914 1.00 73.56 112 A 1 ATOM 865 C CG . TYR A 1 112 ? -15.069 -13.275 11.847 1.00 69.96 112 A 1 ATOM 866 C CD1 . TYR A 1 112 ? -13.945 -14.057 12.186 1.00 65.38 112 A 1 ATOM 867 C CD2 . TYR A 1 112 ? -16.266 -13.909 11.462 1.00 65.24 112 A 1 ATOM 868 C CE1 . TYR A 1 112 ? -14.018 -15.462 12.140 1.00 57.64 112 A 1 ATOM 869 C CE2 . TYR A 1 112 ? -16.349 -15.314 11.416 1.00 59.20 112 A 1 ATOM 870 C CZ . TYR A 1 112 ? -15.220 -16.089 11.758 1.00 58.42 112 A 1 ATOM 871 O OH . TYR A 1 112 ? -15.292 -17.441 11.712 1.00 58.86 112 A 1 ATOM 872 N N . MET A 1 113 ? -13.657 -9.343 13.560 1.00 79.48 113 A 1 ATOM 873 C CA . MET A 1 113 ? -13.169 -7.955 13.598 1.00 82.15 113 A 1 ATOM 874 C C . MET A 1 113 ? -13.051 -7.303 12.203 1.00 85.25 113 A 1 ATOM 875 O O . MET A 1 113 ? -12.245 -6.392 12.006 1.00 83.35 113 A 1 ATOM 876 C CB . MET A 1 113 ? -11.837 -7.882 14.369 1.00 77.82 113 A 1 ATOM 877 C CG . MET A 1 113 ? -11.972 -8.291 15.838 1.00 71.47 113 A 1 ATOM 878 S SD . MET A 1 113 ? -10.437 -8.118 16.798 1.00 62.46 113 A 1 ATOM 879 C CE . MET A 1 113 ? -10.288 -6.312 16.923 1.00 54.80 113 A 1 ATOM 880 N N . ILE A 1 114 ? -13.862 -7.750 11.235 1.00 84.17 114 A 1 ATOM 881 C CA . ILE A 1 114 ? -13.836 -7.262 9.846 1.00 85.60 114 A 1 ATOM 882 C C . ILE A 1 114 ? -13.979 -5.728 9.761 1.00 87.08 114 A 1 ATOM 883 O O . ILE A 1 114 ? -13.180 -5.127 9.048 1.00 86.99 114 A 1 ATOM 884 C CB . ILE A 1 114 ? -14.873 -7.993 8.958 1.00 84.53 114 A 1 ATOM 885 C CG1 . ILE A 1 114 ? -14.636 -9.522 8.972 1.00 79.62 114 A 1 ATOM 886 C CG2 . ILE A 1 114 ? -14.819 -7.474 7.508 1.00 77.71 114 A 1 ATOM 887 C CD1 . ILE A 1 114 ? -15.727 -10.334 8.254 1.00 70.61 114 A 1 ATOM 888 N N . PRO A 1 115 ? -14.901 -5.059 10.506 1.00 88.34 115 A 1 ATOM 889 C CA . PRO A 1 115 ? -15.019 -3.600 10.445 1.00 87.94 115 A 1 ATOM 890 C C . PRO A 1 115 ? -13.718 -2.875 10.807 1.00 88.97 115 A 1 ATOM 891 O O . PRO A 1 115 ? -13.292 -1.960 10.113 1.00 88.67 115 A 1 ATOM 892 C CB . PRO A 1 115 ? -16.141 -3.238 11.427 1.00 86.63 115 A 1 ATOM 893 C CG . PRO A 1 115 ? -16.971 -4.507 11.526 1.00 83.67 115 A 1 ATOM 894 C CD . PRO A 1 115 ? -15.927 -5.609 11.379 1.00 86.90 115 A 1 ATOM 895 N N . THR A 1 116 ? -13.054 -3.321 11.887 1.00 88.25 116 A 1 ATOM 896 C CA . THR A 1 116 ? -11.797 -2.729 12.355 1.00 86.57 116 A 1 ATOM 897 C C . THR A 1 116 ? -10.663 -2.942 11.358 1.00 87.76 116 A 1 ATOM 898 O O . THR A 1 116 ? -9.920 -2.011 11.066 1.00 87.45 116 A 1 ATOM 899 C CB . THR A 1 116 ? -11.407 -3.337 13.713 1.00 84.99 116 A 1 ATOM 900 O OG1 . THR A 1 116 ? -12.471 -3.206 14.617 1.00 78.64 116 A 1 ATOM 901 C CG2 . THR A 1 116 ? -10.190 -2.644 14.333 1.00 77.21 116 A 1 ATOM 902 N N . ILE A 1 117 ? -10.548 -4.169 10.806 1.00 87.92 117 A 1 ATOM 903 C CA . ILE A 1 117 ? -9.533 -4.500 9.802 1.00 87.78 117 A 1 ATOM 904 C C . ILE A 1 117 ? -9.754 -3.667 8.538 1.00 89.61 117 A 1 ATOM 905 O O . ILE A 1 117 ? -8.813 -3.062 8.029 1.00 90.03 117 A 1 ATOM 906 C CB . ILE A 1 117 ? -9.547 -6.016 9.503 1.00 87.67 117 A 1 ATOM 907 C CG1 . ILE A 1 117 ? -9.124 -6.816 10.766 1.00 82.79 117 A 1 ATOM 908 C CG2 . ILE A 1 117 ? -8.622 -6.363 8.325 1.00 80.29 117 A 1 ATOM 909 C CD1 . ILE A 1 117 ? -9.366 -8.330 10.660 1.00 74.06 117 A 1 ATOM 910 N N . ALA A 1 118 ? -10.997 -3.576 8.066 1.00 88.90 118 A 1 ATOM 911 C CA . ALA A 1 118 ? -11.336 -2.831 6.868 1.00 89.33 118 A 1 ATOM 912 C C . ALA A 1 118 ? -11.040 -1.328 7.007 1.00 90.67 118 A 1 ATOM 913 O O . ALA A 1 118 ? -10.447 -0.747 6.111 1.00 91.14 118 A 1 ATOM 914 C CB . ALA A 1 118 ? -12.810 -3.110 6.538 1.00 89.85 118 A 1 ATOM 915 N N . ILE A 1 119 ? -11.350 -0.718 8.157 1.00 90.59 119 A 1 ATOM 916 C CA . ILE A 1 119 ? -11.005 0.686 8.435 1.00 90.15 119 A 1 ATOM 917 C C . ILE A 1 119 ? -9.475 0.879 8.481 1.00 91.07 119 A 1 ATOM 918 O O . ILE A 1 119 ? -8.967 1.876 7.963 1.00 91.07 119 A 1 ATOM 919 C CB . ILE A 1 119 ? -11.669 1.161 9.746 1.00 89.10 119 A 1 ATOM 920 C CG1 . ILE A 1 119 ? -13.206 1.244 9.552 1.00 85.52 119 A 1 ATOM 921 C CG2 . ILE A 1 119 ? -11.138 2.530 10.204 1.00 84.26 119 A 1 ATOM 922 C CD1 . ILE A 1 119 ? -13.978 1.355 10.874 1.00 76.82 119 A 1 ATOM 923 N N . GLY A 1 120 ? -8.746 -0.079 9.071 1.00 89.90 120 A 1 ATOM 924 C CA . GLY A 1 120 ? -7.283 -0.061 9.086 1.00 88.53 120 A 1 ATOM 925 C C . GLY A 1 120 ? -6.691 -0.077 7.679 1.00 90.12 120 A 1 ATOM 926 O O . GLY A 1 120 ? -5.883 0.789 7.340 1.00 90.41 120 A 1 ATOM 927 N N . ILE A 1 121 ? -7.144 -1.004 6.829 1.00 91.27 121 A 1 ATOM 928 C CA . ILE A 1 121 ? -6.713 -1.098 5.431 1.00 91.46 121 A 1 ATOM 929 C C . ILE A 1 121 ? -7.100 0.170 4.660 1.00 92.19 121 A 1 ATOM 930 O O . ILE A 1 121 ? -6.266 0.724 3.956 1.00 92.14 121 A 1 ATOM 931 C CB . ILE A 1 121 ? -7.273 -2.372 4.752 1.00 91.68 121 A 1 ATOM 932 C CG1 . ILE A 1 121 ? -6.761 -3.659 5.444 1.00 89.45 121 A 1 ATOM 933 C CG2 . ILE A 1 121 ? -6.865 -2.421 3.268 1.00 88.23 121 A 1 ATOM 934 C CD1 . ILE A 1 121 ? -7.497 -4.932 5.005 1.00 84.89 121 A 1 ATOM 935 N N . ALA A 1 122 ? -8.317 0.691 4.846 1.00 92.75 122 A 1 ATOM 936 C CA . ALA A 1 122 ? -8.762 1.912 4.184 1.00 92.39 122 A 1 ATOM 937 C C . ALA A 1 122 ? -7.888 3.123 4.540 1.00 93.07 122 A 1 ATOM 938 O O . ALA A 1 122 ? -7.526 3.922 3.676 1.00 93.06 122 A 1 ATOM 939 C CB . ALA A 1 122 ? -10.228 2.180 4.559 1.00 92.87 122 A 1 ATOM 940 N N . SER A 1 123 ? -7.492 3.237 5.810 1.00 92.65 123 A 1 ATOM 941 C CA . SER A 1 123 ? -6.618 4.316 6.277 1.00 92.12 123 A 1 ATOM 942 C C . SER A 1 123 ? -5.203 4.194 5.696 1.00 92.45 123 A 1 ATOM 943 O O . SER A 1 123 ? -4.641 5.180 5.231 1.00 91.53 123 A 1 ATOM 944 C CB . SER A 1 123 ? -6.553 4.327 7.805 1.00 91.38 123 A 1 ATOM 945 O OG . SER A 1 123 ? -7.840 4.423 8.369 1.00 79.14 123 A 1 ATOM 946 N N . ALA A 1 124 ? -4.642 2.974 5.670 1.00 92.22 124 A 1 ATOM 947 C CA . ALA A 1 124 ? -3.337 2.715 5.077 1.00 91.39 124 A 1 ATOM 948 C C . ALA A 1 124 ? -3.343 2.967 3.558 1.00 91.44 124 A 1 ATOM 949 O O . ALA A 1 124 ? -2.467 3.675 3.048 1.00 91.10 124 A 1 ATOM 950 C CB . ALA A 1 124 ? -2.908 1.286 5.416 1.00 91.97 124 A 1 ATOM 951 N N . SER A 1 125 ? -4.374 2.481 2.853 1.00 94.16 125 A 1 ATOM 952 C CA . SER A 1 125 ? -4.523 2.668 1.407 1.00 93.29 125 A 1 ATOM 953 C C . SER A 1 125 ? -4.642 4.142 1.026 1.00 93.09 125 A 1 ATOM 954 O O . SER A 1 125 ? -4.041 4.575 0.046 1.00 91.98 125 A 1 ATOM 955 C CB . SER A 1 125 ? -5.725 1.882 0.859 1.00 92.78 125 A 1 ATOM 956 O OG . SER A 1 125 ? -6.958 2.422 1.261 1.00 83.95 125 A 1 ATOM 957 N N . PHE A 1 126 ? -5.324 4.954 1.835 1.00 93.60 126 A 1 ATOM 958 C CA . PHE A 1 126 ? -5.401 6.392 1.610 1.00 92.68 126 A 1 ATOM 959 C C . PHE A 1 126 ? -4.021 7.049 1.653 1.00 92.96 126 A 1 ATOM 960 O O . PHE A 1 126 ? -3.665 7.809 0.752 1.00 92.75 126 A 1 ATOM 961 C CB . PHE A 1 126 ? -6.357 7.022 2.630 1.00 91.93 126 A 1 ATOM 962 C CG . PHE A 1 126 ? -6.533 8.506 2.413 1.00 90.72 126 A 1 ATOM 963 C CD1 . PHE A 1 126 ? -5.897 9.436 3.260 1.00 86.67 126 A 1 ATOM 964 C CD2 . PHE A 1 126 ? -7.310 8.967 1.339 1.00 87.01 126 A 1 ATOM 965 C CE1 . PHE A 1 126 ? -6.042 10.809 3.038 1.00 83.21 126 A 1 ATOM 966 C CE2 . PHE A 1 126 ? -7.460 10.347 1.112 1.00 83.86 126 A 1 ATOM 967 C CZ . PHE A 1 126 ? -6.829 11.269 1.958 1.00 85.24 126 A 1 ATOM 968 N N . ILE A 1 127 ? -3.195 6.706 2.659 1.00 93.23 127 A 1 ATOM 969 C CA . ILE A 1 127 ? -1.820 7.206 2.766 1.00 92.73 127 A 1 ATOM 970 C C . ILE A 1 127 ? -0.984 6.738 1.564 1.00 92.39 127 A 1 ATOM 971 O O . ILE A 1 127 ? -0.252 7.544 0.983 1.00 91.61 127 A 1 ATOM 972 C CB . ILE A 1 127 ? -1.176 6.797 4.108 1.00 93.14 127 A 1 ATOM 973 C CG1 . ILE A 1 127 ? -1.958 7.361 5.313 1.00 91.32 127 A 1 ATOM 974 C CG2 . ILE A 1 127 ? 0.286 7.282 4.170 1.00 90.10 127 A 1 ATOM 975 C CD1 . ILE A 1 127 ? -1.549 6.765 6.668 1.00 85.54 127 A 1 ATOM 976 N N . HIS A 1 128 ? -1.112 5.476 1.138 1.00 92.03 128 A 1 ATOM 977 C CA . HIS A 1 128 ? -0.428 4.966 -0.053 1.00 91.11 128 A 1 ATOM 978 C C . HIS A 1 128 ? -0.802 5.750 -1.310 1.00 90.47 128 A 1 ATOM 979 O O . HIS A 1 128 ? 0.094 6.177 -2.045 1.00 89.43 128 A 1 ATOM 980 C CB . HIS A 1 128 ? -0.735 3.478 -0.272 1.00 90.66 128 A 1 ATOM 981 C CG . HIS A 1 128 ? -0.086 2.571 0.729 1.00 88.76 128 A 1 ATOM 982 N ND1 . HIS A 1 128 ? -0.691 1.498 1.358 1.00 77.58 128 A 1 ATOM 983 C CD2 . HIS A 1 128 ? 1.223 2.598 1.146 1.00 79.27 128 A 1 ATOM 984 C CE1 . HIS A 1 128 ? 0.233 0.918 2.140 1.00 79.14 128 A 1 ATOM 985 N NE2 . HIS A 1 128 ? 1.405 1.555 2.042 1.00 81.83 128 A 1 ATOM 986 N N . ILE A 1 129 ? -2.092 6.005 -1.538 1.00 92.58 129 A 1 ATOM 987 C CA . ILE A 1 129 ? -2.544 6.793 -2.687 1.00 91.50 129 A 1 ATOM 988 C C . ILE A 1 129 ? -1.968 8.211 -2.639 1.00 91.17 129 A 1 ATOM 989 O O . ILE A 1 129 ? -1.461 8.691 -3.656 1.00 89.81 129 A 1 ATOM 990 C CB . ILE A 1 129 ? -4.084 6.775 -2.783 1.00 91.21 129 A 1 ATOM 991 C CG1 . ILE A 1 129 ? -4.636 5.364 -3.117 1.00 88.58 129 A 1 ATOM 992 C CG2 . ILE A 1 129 ? -4.595 7.794 -3.815 1.00 87.29 129 A 1 ATOM 993 C CD1 . ILE A 1 129 ? -4.242 4.780 -4.480 1.00 77.99 129 A 1 ATOM 994 N N . CYS A 1 130 ? -1.940 8.867 -1.472 1.00 91.80 130 A 1 ATOM 995 C CA . CYS A 1 130 ? -1.306 10.176 -1.327 1.00 90.42 130 A 1 ATOM 996 C C . CYS A 1 130 ? 0.185 10.147 -1.700 1.00 90.07 130 A 1 ATOM 997 O O . CYS A 1 130 ? 0.657 11.015 -2.433 1.00 89.81 130 A 1 ATOM 998 C CB . CYS A 1 130 ? -1.491 10.673 0.115 1.00 90.63 130 A 1 ATOM 999 S SG . CYS A 1 130 ? -3.231 11.092 0.423 1.00 86.12 130 A 1 ATOM 1000 N N . ILE A 1 131 ? 0.923 9.122 -1.248 1.00 91.47 131 A 1 ATOM 1001 C CA . ILE A 1 131 ? 2.345 8.938 -1.584 1.00 90.05 131 A 1 ATOM 1002 C C . ILE A 1 131 ? 2.518 8.731 -3.095 1.00 89.19 131 A 1 ATOM 1003 O O . ILE A 1 131 ? 3.395 9.351 -3.700 1.00 87.74 131 A 1 ATOM 1004 C CB . ILE A 1 131 ? 2.951 7.769 -0.774 1.00 90.20 131 A 1 ATOM 1005 C CG1 . ILE A 1 131 ? 3.027 8.130 0.730 1.00 87.91 131 A 1 ATOM 1006 C CG2 . ILE A 1 131 ? 4.356 7.402 -1.287 1.00 86.75 131 A 1 ATOM 1007 C CD1 . ILE A 1 131 ? 3.303 6.926 1.645 1.00 82.02 131 A 1 ATOM 1008 N N . LEU A 1 132 ? 1.676 7.898 -3.716 1.00 88.84 132 A 1 ATOM 1009 C CA . LEU A 1 132 ? 1.745 7.613 -5.150 1.00 87.67 132 A 1 ATOM 1010 C C . LEU A 1 132 ? 1.420 8.839 -6.010 1.00 87.14 132 A 1 ATOM 1011 O O . LEU A 1 132 ? 2.106 9.089 -6.997 1.00 86.06 132 A 1 ATOM 1012 C CB . LEU A 1 132 ? 0.796 6.448 -5.490 1.00 87.30 132 A 1 ATOM 1013 C CG . LEU A 1 132 ? 1.252 5.079 -4.961 1.00 83.44 132 A 1 ATOM 1014 C CD1 . LEU A 1 132 ? 0.172 4.040 -5.259 1.00 77.46 132 A 1 ATOM 1015 C CD2 . LEU A 1 132 ? 2.555 4.611 -5.614 1.00 77.13 132 A 1 ATOM 1016 N N . VAL A 1 133 ? 0.426 9.646 -5.612 1.00 87.83 133 A 1 ATOM 1017 C CA . VAL A 1 133 ? 0.104 10.911 -6.293 1.00 85.77 133 A 1 ATOM 1018 C C . VAL A 1 133 ? 1.263 11.903 -6.169 1.00 85.83 133 A 1 ATOM 1019 O O . VAL A 1 133 ? 1.671 12.507 -7.170 1.00 85.46 133 A 1 ATOM 1020 C CB . VAL A 1 133 ? -1.205 11.510 -5.728 1.00 85.35 133 A 1 ATOM 1021 C CG1 . VAL A 1 133 ? -1.464 12.936 -6.241 1.00 82.21 133 A 1 ATOM 1022 C CG2 . VAL A 1 133 ? -2.409 10.663 -6.158 1.00 82.18 133 A 1 ATOM 1023 N N . PHE A 1 134 ? 1.860 12.034 -4.981 1.00 88.41 134 A 1 ATOM 1024 C CA . PHE A 1 134 ? 3.023 12.886 -4.775 1.00 86.90 134 A 1 ATOM 1025 C C . PHE A 1 134 ? 4.247 12.399 -5.576 1.00 85.89 134 A 1 ATOM 1026 O O . PHE A 1 134 ? 4.971 13.201 -6.176 1.00 84.29 134 A 1 ATOM 1027 C CB . PHE A 1 134 ? 3.329 12.947 -3.279 1.00 87.88 134 A 1 ATOM 1028 C CG . PHE A 1 134 ? 4.457 13.901 -2.945 1.00 82.03 134 A 1 ATOM 1029 C CD1 . PHE A 1 134 ? 5.731 13.410 -2.590 1.00 75.92 134 A 1 ATOM 1030 C CD2 . PHE A 1 134 ? 4.232 15.288 -2.997 1.00 74.57 134 A 1 ATOM 1031 C CE1 . PHE A 1 134 ? 6.766 14.311 -2.275 1.00 70.16 134 A 1 ATOM 1032 C CE2 . PHE A 1 134 ? 5.271 16.187 -2.684 1.00 71.01 134 A 1 ATOM 1033 C CZ . PHE A 1 134 ? 6.536 15.693 -2.316 1.00 72.71 134 A 1 ATOM 1034 N N . GLN A 1 135 ? 4.456 11.082 -5.630 1.00 86.57 135 A 1 ATOM 1035 C CA . GLN A 1 135 ? 5.485 10.466 -6.465 1.00 84.42 135 A 1 ATOM 1036 C C . GLN A 1 135 ? 5.252 10.797 -7.943 1.00 83.53 135 A 1 ATOM 1037 O O . GLN A 1 135 ? 6.179 11.261 -8.607 1.00 82.53 135 A 1 ATOM 1038 C CB . GLN A 1 135 ? 5.498 8.950 -6.220 1.00 82.67 135 A 1 ATOM 1039 C CG . GLN A 1 135 ? 6.584 8.231 -7.030 1.00 72.66 135 A 1 ATOM 1040 C CD . GLN A 1 135 ? 6.476 6.709 -6.914 1.00 73.00 135 A 1 ATOM 1041 O OE1 . GLN A 1 135 ? 5.418 6.130 -6.943 1.00 66.27 135 A 1 ATOM 1042 N NE2 . GLN A 1 135 ? 7.571 6.003 -6.811 1.00 62.22 135 A 1 ATOM 1043 N N . LEU A 1 136 ? 4.037 10.602 -8.444 1.00 83.49 136 A 1 ATOM 1044 C CA . LEU A 1 136 ? 3.675 10.886 -9.829 1.00 81.87 136 A 1 ATOM 1045 C C . LEU A 1 136 ? 3.931 12.351 -10.184 1.00 81.14 136 A 1 ATOM 1046 O O . LEU A 1 136 ? 4.614 12.626 -11.169 1.00 79.93 136 A 1 ATOM 1047 C CB . LEU A 1 136 ? 2.200 10.489 -10.048 1.00 81.37 136 A 1 ATOM 1048 C CG . LEU A 1 136 ? 1.728 10.616 -11.507 1.00 75.39 136 A 1 ATOM 1049 C CD1 . LEU A 1 136 ? 2.469 9.639 -12.419 1.00 71.09 136 A 1 ATOM 1050 C CD2 . LEU A 1 136 ? 0.229 10.316 -11.590 1.00 71.01 136 A 1 ATOM 1051 N N . TYR A 1 137 ? 3.491 13.277 -9.333 1.00 82.99 137 A 1 ATOM 1052 C CA . TYR A 1 137 ? 3.747 14.711 -9.490 1.00 81.54 137 A 1 ATOM 1053 C C . TYR A 1 137 ? 5.246 15.028 -9.595 1.00 80.52 137 A 1 ATOM 1054 O O . TYR A 1 137 ? 5.689 15.702 -10.519 1.00 78.76 137 A 1 ATOM 1055 C CB . TYR A 1 137 ? 3.110 15.463 -8.318 1.00 82.70 137 A 1 ATOM 1056 C CG . TYR A 1 137 ? 3.423 16.950 -8.317 1.00 82.42 137 A 1 ATOM 1057 C CD1 . TYR A 1 137 ? 4.422 17.455 -7.467 1.00 77.92 137 A 1 ATOM 1058 C CD2 . TYR A 1 137 ? 2.730 17.811 -9.184 1.00 77.92 137 A 1 ATOM 1059 C CE1 . TYR A 1 137 ? 4.724 18.836 -7.489 1.00 75.08 137 A 1 ATOM 1060 C CE2 . TYR A 1 137 ? 3.033 19.184 -9.206 1.00 75.47 137 A 1 ATOM 1061 C CZ . TYR A 1 137 ? 4.033 19.702 -8.355 1.00 76.73 137 A 1 ATOM 1062 O OH . TYR A 1 137 ? 4.318 21.026 -8.377 1.00 75.62 137 A 1 ATOM 1063 N N . ASN A 1 138 ? 6.058 14.492 -8.681 1.00 81.96 138 A 1 ATOM 1064 C CA . ASN A 1 138 ? 7.502 14.727 -8.686 1.00 79.89 138 A 1 ATOM 1065 C C . ASN A 1 138 ? 8.204 14.138 -9.913 1.00 78.27 138 A 1 ATOM 1066 O O . ASN A 1 138 ? 9.212 14.683 -10.372 1.00 76.83 138 A 1 ATOM 1067 C CB . ASN A 1 138 ? 8.103 14.141 -7.403 1.00 80.00 138 A 1 ATOM 1068 C CG . ASN A 1 138 ? 7.915 15.047 -6.208 1.00 74.71 138 A 1 ATOM 1069 O OD1 . ASN A 1 138 ? 7.841 16.257 -6.312 1.00 69.56 138 A 1 ATOM 1070 N ND2 . ASN A 1 138 ? 7.904 14.482 -5.023 1.00 68.36 138 A 1 ATOM 1071 N N . LEU A 1 139 ? 7.715 13.015 -10.447 1.00 79.80 139 A 1 ATOM 1072 C CA . LEU A 1 139 ? 8.285 12.355 -11.622 1.00 77.36 139 A 1 ATOM 1073 C C . LEU A 1 139 ? 7.928 13.070 -12.927 1.00 76.16 139 A 1 ATOM 1074 O O . LEU A 1 139 ? 8.722 13.034 -13.861 1.00 72.99 139 A 1 ATOM 1075 C CB . LEU A 1 139 ? 7.821 10.891 -11.656 1.00 76.45 139 A 1 ATOM 1076 C CG . LEU A 1 139 ? 8.423 10.010 -10.544 1.00 72.51 139 A 1 ATOM 1077 C CD1 . LEU A 1 139 ? 7.879 8.587 -10.657 1.00 68.69 139 A 1 ATOM 1078 C CD2 . LEU A 1 139 ? 9.948 9.965 -10.597 1.00 68.74 139 A 1 ATOM 1079 N N . THR A 1 140 ? 6.759 13.708 -12.986 1.00 79.14 140 A 1 ATOM 1080 C CA . THR A 1 140 ? 6.278 14.395 -14.189 1.00 75.86 140 A 1 ATOM 1081 C C . THR A 1 140 ? 6.687 15.859 -14.267 1.00 74.30 140 A 1 ATOM 1082 O O . THR A 1 140 ? 6.760 16.398 -15.366 1.00 70.76 140 A 1 ATOM 1083 C CB . THR A 1 140 ? 4.756 14.280 -14.308 1.00 74.47 140 A 1 ATOM 1084 O OG1 . THR A 1 140 ? 4.117 14.766 -13.155 1.00 68.10 140 A 1 ATOM 1085 C CG2 . THR A 1 140 ? 4.341 12.819 -14.504 1.00 66.09 140 A 1 ATOM 1086 N N . ARG A 1 141 ? 7.019 16.488 -13.132 1.00 77.24 141 A 1 ATOM 1087 C CA . ARG A 1 141 ? 7.515 17.866 -13.111 1.00 74.72 141 A 1 ATOM 1088 C C . ARG A 1 141 ? 8.896 17.938 -13.759 1.00 71.27 141 A 1 ATOM 1089 O O . ARG A 1 141 ? 9.889 17.469 -13.184 1.00 66.26 141 A 1 ATOM 1090 C CB . ARG A 1 141 ? 7.503 18.384 -11.660 1.00 73.04 141 A 1 ATOM 1091 C CG . ARG A 1 141 ? 7.800 19.881 -11.589 1.00 67.29 141 A 1 ATOM 1092 C CD . ARG A 1 141 ? 7.712 20.378 -10.140 1.00 64.78 141 A 1 ATOM 1093 N NE . ARG A 1 141 ? 7.958 21.825 -10.056 1.00 60.20 141 A 1 ATOM 1094 C CZ . ARG A 1 141 ? 8.034 22.550 -8.949 1.00 54.93 141 A 1 ATOM 1095 N NH1 . ARG A 1 141 ? 7.914 22.020 -7.770 1.00 52.49 141 A 1 ATOM 1096 N NH2 . ARG A 1 141 ? 8.238 23.845 -9.026 1.00 50.08 141 A 1 ATOM 1097 N N . GLU A 1 142 ? 8.983 18.545 -14.932 1.00 65.55 142 A 1 ATOM 1098 C CA . GLU A 1 142 ? 10.260 18.980 -15.497 1.00 63.55 142 A 1 ATOM 1099 C C . GLU A 1 142 ? 10.673 20.277 -14.790 1.00 61.67 142 A 1 ATOM 1100 O O . GLU A 1 142 ? 9.841 21.131 -14.489 1.00 55.71 142 A 1 ATOM 1101 C CB . GLU A 1 142 ? 10.201 19.062 -17.030 1.00 58.44 142 A 1 ATOM 1102 C CG . GLU A 1 142 ? 9.950 17.658 -17.621 1.00 52.20 142 A 1 ATOM 1103 C CD . GLU A 1 142 ? 10.261 17.499 -19.122 1.00 49.92 142 A 1 ATOM 1104 O OE1 . GLU A 1 142 ? 10.666 16.365 -19.478 1.00 46.37 142 A 1 ATOM 1105 O OE2 . GLU A 1 142 ? 10.104 18.467 -19.877 1.00 47.74 142 A 1 ATOM 1106 N N . GLN A 1 143 ? 11.940 20.382 -14.383 1.00 63.26 143 A 1 ATOM 1107 C CA . GLN A 1 143 ? 12.504 21.668 -13.980 1.00 60.40 143 A 1 ATOM 1108 C C . GLN A 1 143 ? 12.800 22.416 -15.278 1.00 60.52 143 A 1 ATOM 1109 O O . GLN A 1 143 ? 13.560 21.909 -16.099 1.00 55.21 143 A 1 ATOM 1110 C CB . GLN A 1 143 ? 13.773 21.489 -13.123 1.00 55.81 143 A 1 ATOM 1111 C CG . GLN A 1 143 ? 13.427 21.262 -11.644 1.00 48.85 143 A 1 ATOM 1112 C CD . GLN A 1 143 ? 14.650 20.934 -10.784 1.00 45.32 143 A 1 ATOM 1113 O OE1 . GLN A 1 143 ? 15.279 19.893 -10.925 1.00 45.11 143 A 1 ATOM 1114 N NE2 . GLN A 1 143 ? 14.996 21.767 -9.825 1.00 41.59 143 A 1 ATOM 1115 N N . GLU A 1 144 ? 12.136 23.582 -15.453 1.00 56.36 144 A 1 ATOM 1116 C CA . GLU A 1 144 ? 12.568 24.598 -16.411 1.00 56.09 144 A 1 ATOM 1117 C C . GLU A 1 144 ? 14.026 25.002 -16.130 1.00 50.82 144 A 1 ATOM 1118 O O . GLU A 1 144 ? 14.403 25.074 -14.940 1.00 46.82 144 A 1 ATOM 1119 C CB . GLU A 1 144 ? 11.617 25.813 -16.364 1.00 51.69 144 A 1 ATOM 1120 C CG . GLU A 1 144 ? 10.219 25.506 -16.941 1.00 44.07 144 A 1 ATOM 1121 C CD . GLU A 1 144 ? 9.243 26.707 -16.877 1.00 43.20 144 A 1 ATOM 1122 O OE1 . GLU A 1 144 ? 8.259 26.678 -17.656 1.00 39.23 144 A 1 ATOM 1123 O OE2 . GLU A 1 144 ? 9.435 27.604 -16.025 1.00 45.66 144 A 1 ATOM 1124 O OXT . GLU A 1 144 ? 14.746 25.208 -17.124 1.00 52.54 144 A 1 #