data_ma-t3vr3-210 _entry.id ma-t3vr3-210 _entry.ma_collection_id ma-t3vr3 _struct.entry_id ma-t3vr3-210 _struct.pdbx_model_details ;Predicted interaction between Chromobox protein homolog 7 (residue 76 - 251) and BCL-6 corepressor (residue 1121 - 1320). Model generated using AlphaFold2 with a 200 residue separation between the chains starting from a paired Multiple Sequence Alignment(pMSA). ; _struct.pdbx_structure_determination_methodology computational _struct.title 'Predicted interaction between CBX7 (76-251) and BCOR (1121-1320)' _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/ba728c4/archive/mmcif_ma-v1.4.5.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.5 loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Computed cancer interactome explains the effects of somatic mutations in cancers.' 'Protein Sci' 31 e4479 . 2022 36261849 10.1002/pro.4479 2 'Highly accurate protein structure prediction with AlphaFold.' Nature 596 583 589 2021 34265844 10.1038/s41586-021-03819-2 loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Zhang, J.' 1 primary 'Pei, J.' 2 primary 'Durham, J.' 3 primary 'Bos, T.' 4 primary 'Cong, Q.' 5 2 'Jumper, J.' 6 2 'Evans, R.' 7 2 'Pritzel, A.' 8 2 'Green, T.' 9 2 'Figurnov, M.' 10 2 'Ronneberger, O.' 11 2 'Tunyasuvunakool, K.' 12 2 'Bates, R.' 13 2 'Zidek, A.' 14 2 'Potapenko, A.' 15 2 'Bridgland, A.' 16 2 'Meyer, C.' 17 2 'Kohl, S.A.A.' 18 2 'Ballard, A.J.' 19 2 'Cowie, A.' 20 2 'Romera-Paredes, B.' 21 2 'Nikolov, S.' 22 2 'Jain, R.' 23 2 'Adler, J.' 24 2 'Back, T.' 25 2 'Petersen, S.' 26 2 'Reiman, D.' 27 2 'Clancy, E.' 28 2 'Zielinski, M.' 29 2 'Steinegger, M.' 30 2 'Pacholska, M.' 31 2 'Berghammer, T.' 32 2 'Bodenstein, S.' 33 2 'Silver, D.' 34 2 'Vinyals, O.' 35 2 'Senior, A.W.' 36 2 'Kavukcuoglu, K.' 37 2 'Kohli, P.' 38 2 'Hassabis, D.' 39 loop_ _software.pdbx_ordinal _software.name _software.classification _software.description _software.version _software.type _software.location _software.citation_id 1 AlphaFold 'model building' 'Structure prediction' 2.0.0 package https://github.com/deepmind/alphafold 2 loop_ _ma_software_group.ordinal_id _ma_software_group.group_id _ma_software_group.software_id _ma_software_group.parameter_group_id 1 1 1 . loop_ _audit_author.name _audit_author.pdbx_ordinal 'Zhang, J.' 1 'Pei, J.' 2 'Durham, J.' 3 'Bos, T.' 4 'Cong, Q.' 5 loop_ _chem_comp.id _chem_comp.type _chem_comp.name _chem_comp.formula _chem_comp.formula_weight _chem_comp.ma_provenance ALA 'L-peptide linking' ALANINE 'C3 H7 N O2' 89.094 'CCD Core' ARG 'L-peptide linking' ARGININE 'C6 H15 N4 O2 1' 175.212 'CCD Core' ASN 'L-peptide linking' ASPARAGINE 'C4 H8 N2 O3' 132.119 'CCD Core' ASP 'L-peptide linking' 'ASPARTIC ACID' 'C4 H7 N O4' 133.103 'CCD Core' CYS 'L-peptide linking' CYSTEINE 'C3 H7 N O2 S' 121.154 'CCD Core' GLN 'L-peptide linking' GLUTAMINE 'C5 H10 N2 O3' 146.146 'CCD Core' GLU 'L-peptide linking' 'GLUTAMIC ACID' 'C5 H9 N O4' 147.130 'CCD Core' GLY 'peptide linking' GLYCINE 'C2 H5 N O2' 75.067 'CCD Core' HIS 'L-peptide linking' HISTIDINE 'C6 H10 N3 O2 1' 156.165 'CCD Core' ILE 'L-peptide linking' ISOLEUCINE 'C6 H13 N O2' 131.175 'CCD Core' LEU 'L-peptide linking' LEUCINE 'C6 H13 N O2' 131.175 'CCD Core' LYS 'L-peptide linking' LYSINE 'C6 H15 N2 O2 1' 147.198 'CCD Core' MET 'L-peptide linking' METHIONINE 'C5 H11 N O2 S' 149.208 'CCD Core' PHE 'L-peptide linking' PHENYLALANINE 'C9 H11 N O2' 165.192 'CCD Core' PRO 'L-peptide linking' PROLINE 'C5 H9 N O2' 115.132 'CCD Core' SER 'L-peptide linking' SERINE 'C3 H7 N O3' 105.093 'CCD Core' THR 'L-peptide linking' THREONINE 'C4 H9 N O3' 119.120 'CCD Core' TRP 'L-peptide linking' TRYPTOPHAN 'C11 H12 N2 O2' 204.229 'CCD Core' TYR 'L-peptide linking' TYROSINE 'C9 H11 N O3' 181.191 'CCD Core' VAL 'L-peptide linking' VALINE 'C5 H11 N O2' 117.148 'CCD Core' loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.details 1 polymer nat 'Homo sapiens (Human) CBX7 (O95931; 76 - 251)' 22564.095 1 . 2 polymer nat 'Homo sapiens (Human) BCOR (Q6W2J9; 1121 - 1320)' 25822.076 1 . loop_ _entity_src_nat.entity_id _entity_src_nat.pdbx_src_id _entity_src_nat.pdbx_ncbi_taxonomy_id _entity_src_nat.pdbx_organism_scientific _entity_src_nat.common_name _entity_src_nat.strain 1 1 9606 'Homo sapiens (Human)' . . 2 2 9606 'Homo sapiens (Human)' . . loop_ _ma_target_ref_db_details.target_entity_id _ma_target_ref_db_details.db_name _ma_target_ref_db_details.db_name_other_details _ma_target_ref_db_details.db_code _ma_target_ref_db_details.db_accession _ma_target_ref_db_details.seq_db_isoform _ma_target_ref_db_details.seq_db_align_begin _ma_target_ref_db_details.seq_db_align_end _ma_target_ref_db_details.ncbi_taxonomy_id _ma_target_ref_db_details.organism_scientific _ma_target_ref_db_details.seq_db_sequence_version_date _ma_target_ref_db_details.seq_db_sequence_checksum 1 UNP . CBX7_HUMAN O95931 . 76 251 9606 'Homo sapiens (Human)' 1999-05-01 A90019C1D08812B8 2 UNP . BCOR_HUMAN Q6W2J9 . 1121 1320 9606 'Homo sapiens (Human)' 2004-07-05 A80CFCD5618EE717 loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_strand_id _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can 1 polypeptide(L) no no A ;PKRLLLQRLYSMDLRSSHKAKGKEKLCFSLTCPLGSGSPEGVVKAGAPELVDKGPLVPTLPFPLRKPRKA HKYLRLSRKKFPPRGPNLESHSHRRELFLQEPPAPDVLQAAGEWEPAAQPPEEEADADLAEGPPPWTPAL PSSEVTVTDITANSITVTFREAQAAEGFFRDRSGKF ; ;PKRLLLQRLYSMDLRSSHKAKGKEKLCFSLTCPLGSGSPEGVVKAGAPELVDKGPLVPTLPFPLRKPRKA HKYLRLSRKKFPPRGPNLESHSHRRELFLQEPPAPDVLQAAGEWEPAAQPPEEEADADLAEGPPPWTPAL PSSEVTVTDITANSITVTFREAQAAEGFFRDRSGKF ; 2 polypeptide(L) no no B ;ASDMPHSPTLRVDRKRKVSGDSSHTETTAEEVPEDPLLKAKRRRVSKDDWPEREMTNSSSNHLEDPHYSE LTNLKVCIELTGLHPKKQRHLLHLRERWEQQVSAADGKPGRQSRKEVTQATQPEAIPQGTNITEEKPGRK RAEAKGNRSWSEESLKPSDNEQGLPVFSGSPPMKSLSSTSAGGKKQAQPSCAPASRPPAK ; ;ASDMPHSPTLRVDRKRKVSGDSSHTETTAEEVPEDPLLKAKRRRVSKDDWPEREMTNSSSNHLEDPHYSE LTNLKVCIELTGLHPKKQRHLLHLRERWEQQVSAADGKPGRQSRKEVTQATQPEAIPQGTNITEEKPGRK RAEAKGNRSWSEESLKPSDNEQGLPVFSGSPPMKSLSSTSAGGKKQAQPSCAPASRPPAK ; loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 PRO . 1 2 LYS . 1 3 ARG . 1 4 LEU . 1 5 LEU . 1 6 LEU . 1 7 GLN . 1 8 ARG . 1 9 LEU . 1 10 TYR . 1 11 SER . 1 12 MET . 1 13 ASP . 1 14 LEU . 1 15 ARG . 1 16 SER . 1 17 SER . 1 18 HIS . 1 19 LYS . 1 20 ALA . 1 21 LYS . 1 22 GLY . 1 23 LYS . 1 24 GLU . 1 25 LYS . 1 26 LEU . 1 27 CYS . 1 28 PHE . 1 29 SER . 1 30 LEU . 1 31 THR . 1 32 CYS . 1 33 PRO . 1 34 LEU . 1 35 GLY . 1 36 SER . 1 37 GLY . 1 38 SER . 1 39 PRO . 1 40 GLU . 1 41 GLY . 1 42 VAL . 1 43 VAL . 1 44 LYS . 1 45 ALA . 1 46 GLY . 1 47 ALA . 1 48 PRO . 1 49 GLU . 1 50 LEU . 1 51 VAL . 1 52 ASP . 1 53 LYS . 1 54 GLY . 1 55 PRO . 1 56 LEU . 1 57 VAL . 1 58 PRO . 1 59 THR . 1 60 LEU . 1 61 PRO . 1 62 PHE . 1 63 PRO . 1 64 LEU . 1 65 ARG . 1 66 LYS . 1 67 PRO . 1 68 ARG . 1 69 LYS . 1 70 ALA . 1 71 HIS . 1 72 LYS . 1 73 TYR . 1 74 LEU . 1 75 ARG . 1 76 LEU . 1 77 SER . 1 78 ARG . 1 79 LYS . 1 80 LYS . 1 81 PHE . 1 82 PRO . 1 83 PRO . 1 84 ARG . 1 85 GLY . 1 86 PRO . 1 87 ASN . 1 88 LEU . 1 89 GLU . 1 90 SER . 1 91 HIS . 1 92 SER . 1 93 HIS . 1 94 ARG . 1 95 ARG . 1 96 GLU . 1 97 LEU . 1 98 PHE . 1 99 LEU . 1 100 GLN . 1 101 GLU . 1 102 PRO . 1 103 PRO . 1 104 ALA . 1 105 PRO . 1 106 ASP . 1 107 VAL . 1 108 LEU . 1 109 GLN . 1 110 ALA . 1 111 ALA . 1 112 GLY . 1 113 GLU . 1 114 TRP . 1 115 GLU . 1 116 PRO . 1 117 ALA . 1 118 ALA . 1 119 GLN . 1 120 PRO . 1 121 PRO . 1 122 GLU . 1 123 GLU . 1 124 GLU . 1 125 ALA . 1 126 ASP . 1 127 ALA . 1 128 ASP . 1 129 LEU . 1 130 ALA . 1 131 GLU . 1 132 GLY . 1 133 PRO . 1 134 PRO . 1 135 PRO . 1 136 TRP . 1 137 THR . 1 138 PRO . 1 139 ALA . 1 140 LEU . 1 141 PRO . 1 142 SER . 1 143 SER . 1 144 GLU . 1 145 VAL . 1 146 THR . 1 147 VAL . 1 148 THR . 1 149 ASP . 1 150 ILE . 1 151 THR . 1 152 ALA . 1 153 ASN . 1 154 SER . 1 155 ILE . 1 156 THR . 1 157 VAL . 1 158 THR . 1 159 PHE . 1 160 ARG . 1 161 GLU . 1 162 ALA . 1 163 GLN . 1 164 ALA . 1 165 ALA . 1 166 GLU . 1 167 GLY . 1 168 PHE . 1 169 PHE . 1 170 ARG . 1 171 ASP . 1 172 ARG . 1 173 SER . 1 174 GLY . 1 175 LYS . 1 176 PHE . 2 1 ALA . 2 2 SER . 2 3 ASP . 2 4 MET . 2 5 PRO . 2 6 HIS . 2 7 SER . 2 8 PRO . 2 9 THR . 2 10 LEU . 2 11 ARG . 2 12 VAL . 2 13 ASP . 2 14 ARG . 2 15 LYS . 2 16 ARG . 2 17 LYS . 2 18 VAL . 2 19 SER . 2 20 GLY . 2 21 ASP . 2 22 SER . 2 23 SER . 2 24 HIS . 2 25 THR . 2 26 GLU . 2 27 THR . 2 28 THR . 2 29 ALA . 2 30 GLU . 2 31 GLU . 2 32 VAL . 2 33 PRO . 2 34 GLU . 2 35 ASP . 2 36 PRO . 2 37 LEU . 2 38 LEU . 2 39 LYS . 2 40 ALA . 2 41 LYS . 2 42 ARG . 2 43 ARG . 2 44 ARG . 2 45 VAL . 2 46 SER . 2 47 LYS . 2 48 ASP . 2 49 ASP . 2 50 TRP . 2 51 PRO . 2 52 GLU . 2 53 ARG . 2 54 GLU . 2 55 MET . 2 56 THR . 2 57 ASN . 2 58 SER . 2 59 SER . 2 60 SER . 2 61 ASN . 2 62 HIS . 2 63 LEU . 2 64 GLU . 2 65 ASP . 2 66 PRO . 2 67 HIS . 2 68 TYR . 2 69 SER . 2 70 GLU . 2 71 LEU . 2 72 THR . 2 73 ASN . 2 74 LEU . 2 75 LYS . 2 76 VAL . 2 77 CYS . 2 78 ILE . 2 79 GLU . 2 80 LEU . 2 81 THR . 2 82 GLY . 2 83 LEU . 2 84 HIS . 2 85 PRO . 2 86 LYS . 2 87 LYS . 2 88 GLN . 2 89 ARG . 2 90 HIS . 2 91 LEU . 2 92 LEU . 2 93 HIS . 2 94 LEU . 2 95 ARG . 2 96 GLU . 2 97 ARG . 2 98 TRP . 2 99 GLU . 2 100 GLN . 2 101 GLN . 2 102 VAL . 2 103 SER . 2 104 ALA . 2 105 ALA . 2 106 ASP . 2 107 GLY . 2 108 LYS . 2 109 PRO . 2 110 GLY . 2 111 ARG . 2 112 GLN . 2 113 SER . 2 114 ARG . 2 115 LYS . 2 116 GLU . 2 117 VAL . 2 118 THR . 2 119 GLN . 2 120 ALA . 2 121 THR . 2 122 GLN . 2 123 PRO . 2 124 GLU . 2 125 ALA . 2 126 ILE . 2 127 PRO . 2 128 GLN . 2 129 GLY . 2 130 THR . 2 131 ASN . 2 132 ILE . 2 133 THR . 2 134 GLU . 2 135 GLU . 2 136 LYS . 2 137 PRO . 2 138 GLY . 2 139 ARG . 2 140 LYS . 2 141 ARG . 2 142 ALA . 2 143 GLU . 2 144 ALA . 2 145 LYS . 2 146 GLY . 2 147 ASN . 2 148 ARG . 2 149 SER . 2 150 TRP . 2 151 SER . 2 152 GLU . 2 153 GLU . 2 154 SER . 2 155 LEU . 2 156 LYS . 2 157 PRO . 2 158 SER . 2 159 ASP . 2 160 ASN . 2 161 GLU . 2 162 GLN . 2 163 GLY . 2 164 LEU . 2 165 PRO . 2 166 VAL . 2 167 PHE . 2 168 SER . 2 169 GLY . 2 170 SER . 2 171 PRO . 2 172 PRO . 2 173 MET . 2 174 LYS . 2 175 SER . 2 176 LEU . 2 177 SER . 2 178 SER . 2 179 THR . 2 180 SER . 2 181 ALA . 2 182 GLY . 2 183 GLY . 2 184 LYS . 2 185 LYS . 2 186 GLN . 2 187 ALA . 2 188 GLN . 2 189 PRO . 2 190 SER . 2 191 CYS . 2 192 ALA . 2 193 PRO . 2 194 ALA . 2 195 SER . 2 196 ARG . 2 197 PRO . 2 198 PRO . 2 199 ALA . 2 200 LYS . loop_ _struct_asym.id _struct_asym.entity_id _struct_asym.details A 1 . B 2 . loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code A 1 1 PRO 76 76 PRO PRO A . A 1 2 LYS 77 77 LYS LYS A . A 1 3 ARG 78 78 ARG ARG A . A 1 4 LEU 79 79 LEU LEU A . A 1 5 LEU 80 80 LEU LEU A . A 1 6 LEU 81 81 LEU LEU A . A 1 7 GLN 82 82 GLN GLN A . A 1 8 ARG 83 83 ARG ARG A . A 1 9 LEU 84 84 LEU LEU A . A 1 10 TYR 85 85 TYR TYR A . A 1 11 SER 86 86 SER SER A . A 1 12 MET 87 87 MET MET A . A 1 13 ASP 88 88 ASP ASP A . A 1 14 LEU 89 89 LEU LEU A . A 1 15 ARG 90 90 ARG ARG A . A 1 16 SER 91 91 SER SER A . A 1 17 SER 92 92 SER SER A . A 1 18 HIS 93 93 HIS HIS A . A 1 19 LYS 94 94 LYS LYS A . A 1 20 ALA 95 95 ALA ALA A . A 1 21 LYS 96 96 LYS LYS A . A 1 22 GLY 97 97 GLY GLY A . A 1 23 LYS 98 98 LYS LYS A . A 1 24 GLU 99 99 GLU GLU A . A 1 25 LYS 100 100 LYS LYS A . A 1 26 LEU 101 101 LEU LEU A . A 1 27 CYS 102 102 CYS CYS A . A 1 28 PHE 103 103 PHE PHE A . A 1 29 SER 104 104 SER SER A . A 1 30 LEU 105 105 LEU LEU A . A 1 31 THR 106 106 THR THR A . A 1 32 CYS 107 107 CYS CYS A . A 1 33 PRO 108 108 PRO PRO A . A 1 34 LEU 109 109 LEU LEU A . A 1 35 GLY 110 110 GLY GLY A . A 1 36 SER 111 111 SER SER A . A 1 37 GLY 112 112 GLY GLY A . A 1 38 SER 113 113 SER SER A . A 1 39 PRO 114 114 PRO PRO A . A 1 40 GLU 115 115 GLU GLU A . A 1 41 GLY 116 116 GLY GLY A . A 1 42 VAL 117 117 VAL VAL A . A 1 43 VAL 118 118 VAL VAL A . A 1 44 LYS 119 119 LYS LYS A . A 1 45 ALA 120 120 ALA ALA A . A 1 46 GLY 121 121 GLY GLY A . A 1 47 ALA 122 122 ALA ALA A . A 1 48 PRO 123 123 PRO PRO A . A 1 49 GLU 124 124 GLU GLU A . A 1 50 LEU 125 125 LEU LEU A . A 1 51 VAL 126 126 VAL VAL A . A 1 52 ASP 127 127 ASP ASP A . A 1 53 LYS 128 128 LYS LYS A . A 1 54 GLY 129 129 GLY GLY A . A 1 55 PRO 130 130 PRO PRO A . A 1 56 LEU 131 131 LEU LEU A . A 1 57 VAL 132 132 VAL VAL A . A 1 58 PRO 133 133 PRO PRO A . A 1 59 THR 134 134 THR THR A . A 1 60 LEU 135 135 LEU LEU A . A 1 61 PRO 136 136 PRO PRO A . A 1 62 PHE 137 137 PHE PHE A . A 1 63 PRO 138 138 PRO PRO A . A 1 64 LEU 139 139 LEU LEU A . A 1 65 ARG 140 140 ARG ARG A . A 1 66 LYS 141 141 LYS LYS A . A 1 67 PRO 142 142 PRO PRO A . A 1 68 ARG 143 143 ARG ARG A . A 1 69 LYS 144 144 LYS LYS A . A 1 70 ALA 145 145 ALA ALA A . A 1 71 HIS 146 146 HIS HIS A . A 1 72 LYS 147 147 LYS LYS A . A 1 73 TYR 148 148 TYR TYR A . A 1 74 LEU 149 149 LEU LEU A . A 1 75 ARG 150 150 ARG ARG A . A 1 76 LEU 151 151 LEU LEU A . A 1 77 SER 152 152 SER SER A . A 1 78 ARG 153 153 ARG ARG A . A 1 79 LYS 154 154 LYS LYS A . A 1 80 LYS 155 155 LYS LYS A . A 1 81 PHE 156 156 PHE PHE A . A 1 82 PRO 157 157 PRO PRO A . A 1 83 PRO 158 158 PRO PRO A . A 1 84 ARG 159 159 ARG ARG A . A 1 85 GLY 160 160 GLY GLY A . A 1 86 PRO 161 161 PRO PRO A . A 1 87 ASN 162 162 ASN ASN A . A 1 88 LEU 163 163 LEU LEU A . A 1 89 GLU 164 164 GLU GLU A . A 1 90 SER 165 165 SER SER A . A 1 91 HIS 166 166 HIS HIS A . A 1 92 SER 167 167 SER SER A . A 1 93 HIS 168 168 HIS HIS A . A 1 94 ARG 169 169 ARG ARG A . A 1 95 ARG 170 170 ARG ARG A . A 1 96 GLU 171 171 GLU GLU A . A 1 97 LEU 172 172 LEU LEU A . A 1 98 PHE 173 173 PHE PHE A . A 1 99 LEU 174 174 LEU LEU A . A 1 100 GLN 175 175 GLN GLN A . A 1 101 GLU 176 176 GLU GLU A . A 1 102 PRO 177 177 PRO PRO A . A 1 103 PRO 178 178 PRO PRO A . A 1 104 ALA 179 179 ALA ALA A . A 1 105 PRO 180 180 PRO PRO A . A 1 106 ASP 181 181 ASP ASP A . A 1 107 VAL 182 182 VAL VAL A . A 1 108 LEU 183 183 LEU LEU A . A 1 109 GLN 184 184 GLN GLN A . A 1 110 ALA 185 185 ALA ALA A . A 1 111 ALA 186 186 ALA ALA A . A 1 112 GLY 187 187 GLY GLY A . A 1 113 GLU 188 188 GLU GLU A . A 1 114 TRP 189 189 TRP TRP A . A 1 115 GLU 190 190 GLU GLU A . A 1 116 PRO 191 191 PRO PRO A . A 1 117 ALA 192 192 ALA ALA A . A 1 118 ALA 193 193 ALA ALA A . A 1 119 GLN 194 194 GLN GLN A . A 1 120 PRO 195 195 PRO PRO A . A 1 121 PRO 196 196 PRO PRO A . A 1 122 GLU 197 197 GLU GLU A . A 1 123 GLU 198 198 GLU GLU A . A 1 124 GLU 199 199 GLU GLU A . A 1 125 ALA 200 200 ALA ALA A . A 1 126 ASP 201 201 ASP ASP A . A 1 127 ALA 202 202 ALA ALA A . A 1 128 ASP 203 203 ASP ASP A . A 1 129 LEU 204 204 LEU LEU A . A 1 130 ALA 205 205 ALA ALA A . A 1 131 GLU 206 206 GLU GLU A . A 1 132 GLY 207 207 GLY GLY A . A 1 133 PRO 208 208 PRO PRO A . A 1 134 PRO 209 209 PRO PRO A . A 1 135 PRO 210 210 PRO PRO A . A 1 136 TRP 211 211 TRP TRP A . A 1 137 THR 212 212 THR THR A . A 1 138 PRO 213 213 PRO PRO A . A 1 139 ALA 214 214 ALA ALA A . A 1 140 LEU 215 215 LEU LEU A . A 1 141 PRO 216 216 PRO PRO A . A 1 142 SER 217 217 SER SER A . A 1 143 SER 218 218 SER SER A . A 1 144 GLU 219 219 GLU GLU A . A 1 145 VAL 220 220 VAL VAL A . A 1 146 THR 221 221 THR THR A . A 1 147 VAL 222 222 VAL VAL A . A 1 148 THR 223 223 THR THR A . A 1 149 ASP 224 224 ASP ASP A . A 1 150 ILE 225 225 ILE ILE A . A 1 151 THR 226 226 THR THR A . A 1 152 ALA 227 227 ALA ALA A . A 1 153 ASN 228 228 ASN ASN A . A 1 154 SER 229 229 SER SER A . A 1 155 ILE 230 230 ILE ILE A . A 1 156 THR 231 231 THR THR A . A 1 157 VAL 232 232 VAL VAL A . A 1 158 THR 233 233 THR THR A . A 1 159 PHE 234 234 PHE PHE A . A 1 160 ARG 235 235 ARG ARG A . A 1 161 GLU 236 236 GLU GLU A . A 1 162 ALA 237 237 ALA ALA A . A 1 163 GLN 238 238 GLN GLN A . A 1 164 ALA 239 239 ALA ALA A . A 1 165 ALA 240 240 ALA ALA A . A 1 166 GLU 241 241 GLU GLU A . A 1 167 GLY 242 242 GLY GLY A . A 1 168 PHE 243 243 PHE PHE A . A 1 169 PHE 244 244 PHE PHE A . A 1 170 ARG 245 245 ARG ARG A . A 1 171 ASP 246 246 ASP ASP A . A 1 172 ARG 247 247 ARG ARG A . A 1 173 SER 248 248 SER SER A . A 1 174 GLY 249 249 GLY GLY A . A 1 175 LYS 250 250 LYS LYS A . A 1 176 PHE 251 251 PHE PHE A . B 2 1 ALA 1121 1121 ALA ALA B . B 2 2 SER 1122 1122 SER SER B . B 2 3 ASP 1123 1123 ASP ASP B . B 2 4 MET 1124 1124 MET MET B . B 2 5 PRO 1125 1125 PRO PRO B . B 2 6 HIS 1126 1126 HIS HIS B . B 2 7 SER 1127 1127 SER SER B . B 2 8 PRO 1128 1128 PRO PRO B . B 2 9 THR 1129 1129 THR THR B . B 2 10 LEU 1130 1130 LEU LEU B . B 2 11 ARG 1131 1131 ARG ARG B . B 2 12 VAL 1132 1132 VAL VAL B . B 2 13 ASP 1133 1133 ASP ASP B . B 2 14 ARG 1134 1134 ARG ARG B . B 2 15 LYS 1135 1135 LYS LYS B . B 2 16 ARG 1136 1136 ARG ARG B . B 2 17 LYS 1137 1137 LYS LYS B . B 2 18 VAL 1138 1138 VAL VAL B . B 2 19 SER 1139 1139 SER SER B . B 2 20 GLY 1140 1140 GLY GLY B . B 2 21 ASP 1141 1141 ASP ASP B . B 2 22 SER 1142 1142 SER SER B . B 2 23 SER 1143 1143 SER SER B . B 2 24 HIS 1144 1144 HIS HIS B . B 2 25 THR 1145 1145 THR THR B . B 2 26 GLU 1146 1146 GLU GLU B . B 2 27 THR 1147 1147 THR THR B . B 2 28 THR 1148 1148 THR THR B . B 2 29 ALA 1149 1149 ALA ALA B . B 2 30 GLU 1150 1150 GLU GLU B . B 2 31 GLU 1151 1151 GLU GLU B . B 2 32 VAL 1152 1152 VAL VAL B . B 2 33 PRO 1153 1153 PRO PRO B . B 2 34 GLU 1154 1154 GLU GLU B . B 2 35 ASP 1155 1155 ASP ASP B . B 2 36 PRO 1156 1156 PRO PRO B . B 2 37 LEU 1157 1157 LEU LEU B . B 2 38 LEU 1158 1158 LEU LEU B . B 2 39 LYS 1159 1159 LYS LYS B . B 2 40 ALA 1160 1160 ALA ALA B . B 2 41 LYS 1161 1161 LYS LYS B . B 2 42 ARG 1162 1162 ARG ARG B . B 2 43 ARG 1163 1163 ARG ARG B . B 2 44 ARG 1164 1164 ARG ARG B . B 2 45 VAL 1165 1165 VAL VAL B . B 2 46 SER 1166 1166 SER SER B . B 2 47 LYS 1167 1167 LYS LYS B . B 2 48 ASP 1168 1168 ASP ASP B . B 2 49 ASP 1169 1169 ASP ASP B . B 2 50 TRP 1170 1170 TRP TRP B . B 2 51 PRO 1171 1171 PRO PRO B . B 2 52 GLU 1172 1172 GLU GLU B . B 2 53 ARG 1173 1173 ARG ARG B . B 2 54 GLU 1174 1174 GLU GLU B . B 2 55 MET 1175 1175 MET MET B . B 2 56 THR 1176 1176 THR THR B . B 2 57 ASN 1177 1177 ASN ASN B . B 2 58 SER 1178 1178 SER SER B . B 2 59 SER 1179 1179 SER SER B . B 2 60 SER 1180 1180 SER SER B . B 2 61 ASN 1181 1181 ASN ASN B . B 2 62 HIS 1182 1182 HIS HIS B . B 2 63 LEU 1183 1183 LEU LEU B . B 2 64 GLU 1184 1184 GLU GLU B . B 2 65 ASP 1185 1185 ASP ASP B . B 2 66 PRO 1186 1186 PRO PRO B . B 2 67 HIS 1187 1187 HIS HIS B . B 2 68 TYR 1188 1188 TYR TYR B . B 2 69 SER 1189 1189 SER SER B . B 2 70 GLU 1190 1190 GLU GLU B . B 2 71 LEU 1191 1191 LEU LEU B . B 2 72 THR 1192 1192 THR THR B . B 2 73 ASN 1193 1193 ASN ASN B . B 2 74 LEU 1194 1194 LEU LEU B . B 2 75 LYS 1195 1195 LYS LYS B . B 2 76 VAL 1196 1196 VAL VAL B . B 2 77 CYS 1197 1197 CYS CYS B . B 2 78 ILE 1198 1198 ILE ILE B . B 2 79 GLU 1199 1199 GLU GLU B . B 2 80 LEU 1200 1200 LEU LEU B . B 2 81 THR 1201 1201 THR THR B . B 2 82 GLY 1202 1202 GLY GLY B . B 2 83 LEU 1203 1203 LEU LEU B . B 2 84 HIS 1204 1204 HIS HIS B . B 2 85 PRO 1205 1205 PRO PRO B . B 2 86 LYS 1206 1206 LYS LYS B . B 2 87 LYS 1207 1207 LYS LYS B . B 2 88 GLN 1208 1208 GLN GLN B . B 2 89 ARG 1209 1209 ARG ARG B . B 2 90 HIS 1210 1210 HIS HIS B . B 2 91 LEU 1211 1211 LEU LEU B . B 2 92 LEU 1212 1212 LEU LEU B . B 2 93 HIS 1213 1213 HIS HIS B . B 2 94 LEU 1214 1214 LEU LEU B . B 2 95 ARG 1215 1215 ARG ARG B . B 2 96 GLU 1216 1216 GLU GLU B . B 2 97 ARG 1217 1217 ARG ARG B . B 2 98 TRP 1218 1218 TRP TRP B . B 2 99 GLU 1219 1219 GLU GLU B . B 2 100 GLN 1220 1220 GLN GLN B . B 2 101 GLN 1221 1221 GLN GLN B . B 2 102 VAL 1222 1222 VAL VAL B . B 2 103 SER 1223 1223 SER SER B . B 2 104 ALA 1224 1224 ALA ALA B . B 2 105 ALA 1225 1225 ALA ALA B . B 2 106 ASP 1226 1226 ASP ASP B . B 2 107 GLY 1227 1227 GLY GLY B . B 2 108 LYS 1228 1228 LYS LYS B . B 2 109 PRO 1229 1229 PRO PRO B . B 2 110 GLY 1230 1230 GLY GLY B . B 2 111 ARG 1231 1231 ARG ARG B . B 2 112 GLN 1232 1232 GLN GLN B . B 2 113 SER 1233 1233 SER SER B . B 2 114 ARG 1234 1234 ARG ARG B . B 2 115 LYS 1235 1235 LYS LYS B . B 2 116 GLU 1236 1236 GLU GLU B . B 2 117 VAL 1237 1237 VAL VAL B . B 2 118 THR 1238 1238 THR THR B . B 2 119 GLN 1239 1239 GLN GLN B . B 2 120 ALA 1240 1240 ALA ALA B . B 2 121 THR 1241 1241 THR THR B . B 2 122 GLN 1242 1242 GLN GLN B . B 2 123 PRO 1243 1243 PRO PRO B . B 2 124 GLU 1244 1244 GLU GLU B . B 2 125 ALA 1245 1245 ALA ALA B . B 2 126 ILE 1246 1246 ILE ILE B . B 2 127 PRO 1247 1247 PRO PRO B . B 2 128 GLN 1248 1248 GLN GLN B . B 2 129 GLY 1249 1249 GLY GLY B . B 2 130 THR 1250 1250 THR THR B . B 2 131 ASN 1251 1251 ASN ASN B . B 2 132 ILE 1252 1252 ILE ILE B . B 2 133 THR 1253 1253 THR THR B . B 2 134 GLU 1254 1254 GLU GLU B . B 2 135 GLU 1255 1255 GLU GLU B . B 2 136 LYS 1256 1256 LYS LYS B . B 2 137 PRO 1257 1257 PRO PRO B . B 2 138 GLY 1258 1258 GLY GLY B . B 2 139 ARG 1259 1259 ARG ARG B . B 2 140 LYS 1260 1260 LYS LYS B . B 2 141 ARG 1261 1261 ARG ARG B . B 2 142 ALA 1262 1262 ALA ALA B . B 2 143 GLU 1263 1263 GLU GLU B . B 2 144 ALA 1264 1264 ALA ALA B . B 2 145 LYS 1265 1265 LYS LYS B . B 2 146 GLY 1266 1266 GLY GLY B . B 2 147 ASN 1267 1267 ASN ASN B . B 2 148 ARG 1268 1268 ARG ARG B . B 2 149 SER 1269 1269 SER SER B . B 2 150 TRP 1270 1270 TRP TRP B . B 2 151 SER 1271 1271 SER SER B . B 2 152 GLU 1272 1272 GLU GLU B . B 2 153 GLU 1273 1273 GLU GLU B . B 2 154 SER 1274 1274 SER SER B . B 2 155 LEU 1275 1275 LEU LEU B . B 2 156 LYS 1276 1276 LYS LYS B . B 2 157 PRO 1277 1277 PRO PRO B . B 2 158 SER 1278 1278 SER SER B . B 2 159 ASP 1279 1279 ASP ASP B . B 2 160 ASN 1280 1280 ASN ASN B . B 2 161 GLU 1281 1281 GLU GLU B . B 2 162 GLN 1282 1282 GLN GLN B . B 2 163 GLY 1283 1283 GLY GLY B . B 2 164 LEU 1284 1284 LEU LEU B . B 2 165 PRO 1285 1285 PRO PRO B . B 2 166 VAL 1286 1286 VAL VAL B . B 2 167 PHE 1287 1287 PHE PHE B . B 2 168 SER 1288 1288 SER SER B . B 2 169 GLY 1289 1289 GLY GLY B . B 2 170 SER 1290 1290 SER SER B . B 2 171 PRO 1291 1291 PRO PRO B . B 2 172 PRO 1292 1292 PRO PRO B . B 2 173 MET 1293 1293 MET MET B . B 2 174 LYS 1294 1294 LYS LYS B . B 2 175 SER 1295 1295 SER SER B . B 2 176 LEU 1296 1296 LEU LEU B . B 2 177 SER 1297 1297 SER SER B . B 2 178 SER 1298 1298 SER SER B . B 2 179 THR 1299 1299 THR THR B . B 2 180 SER 1300 1300 SER SER B . B 2 181 ALA 1301 1301 ALA ALA B . B 2 182 GLY 1302 1302 GLY GLY B . B 2 183 GLY 1303 1303 GLY GLY B . B 2 184 LYS 1304 1304 LYS LYS B . B 2 185 LYS 1305 1305 LYS LYS B . B 2 186 GLN 1306 1306 GLN GLN B . B 2 187 ALA 1307 1307 ALA ALA B . B 2 188 GLN 1308 1308 GLN GLN B . B 2 189 PRO 1309 1309 PRO PRO B . B 2 190 SER 1310 1310 SER SER B . B 2 191 CYS 1311 1311 CYS CYS B . B 2 192 ALA 1312 1312 ALA ALA B . B 2 193 PRO 1313 1313 PRO PRO B . B 2 194 ALA 1314 1314 ALA ALA B . B 2 195 SER 1315 1315 SER SER B . B 2 196 ARG 1316 1316 ARG ARG B . B 2 197 PRO 1317 1317 PRO PRO B . B 2 198 PRO 1318 1318 PRO PRO B . B 2 199 ALA 1319 1319 ALA ALA B . B 2 200 LYS 1320 1320 LYS LYS B . loop_ _ma_data.id _ma_data.name _ma_data.content_type 1 'Homo sapiens (Human) CBX7 (O95931; 76 - 251)' target 2 'Homo sapiens (Human) BCOR (Q6W2J9; 1121 - 1320)' target 3 'Model 3' 'model coordinates' 4 'Paired MSA for the dimer' 'coevolution MSA' loop_ _ma_data_group.ordinal_id _ma_data_group.group_id _ma_data_group.data_id 1 1 1 2 1 2 3 2 1 4 2 2 5 2 4 6 3 4 7 4 3 loop_ _ma_target_entity.entity_id _ma_target_entity.data_id _ma_target_entity.origin 1 1 'reference database' 2 2 'reference database' loop_ _ma_target_entity_instance.asym_id _ma_target_entity_instance.entity_id _ma_target_entity_instance.details A 1 . B 2 . loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type _ma_protocol_step.step_name _ma_protocol_step.details _ma_protocol_step.software_group_id _ma_protocol_step.input_data_group_id _ma_protocol_step.output_data_group_id 1 1 1 'coevolution MSA' . 'Create paired MSAs for the dimers' . 1 3 2 1 2 modeling . "Model using AlphaFold ('model 3' parameters; pTM monomer version) with a 200 residue gap between the two chains, without templates and without model relaxation" 1 2 4 loop_ _ma_model_list.ordinal_id _ma_model_list.model_id _ma_model_list.model_group_id _ma_model_list.model_name _ma_model_list.model_group_name _ma_model_list.data_id _ma_model_list.model_type _ma_model_list.model_type_other_details 1 1 1 'Model 3' . 3 'Ab initio model' . 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_seq_id _atom_site.auth_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.label_asym_id _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.label_entity_id _atom_site.auth_asym_id _atom_site.B_iso_or_equiv _atom_site.pdbx_PDB_model_num ATOM 1 N N . PRO 1 76 ? A 6.473 -9.123 -19.280 1.000 1 A 57.539 1 ATOM 2 C CA . PRO 1 76 ? A 6.176 -9.619 -17.934 1.000 1 A 57.539 1 ATOM 3 C C . PRO 1 76 ? A 5.452 -8.587 -17.071 1.000 1 A 57.539 1 ATOM 4 O O . PRO 1 76 ? A 4.763 -8.951 -16.114 1.000 1 A 57.539 1 ATOM 5 C CB . PRO 1 76 ? A 7.560 -9.935 -17.361 1.000 1 A 57.539 1 ATOM 6 C CG . PRO 1 76 ? A 8.522 -9.337 -18.336 1.000 1 A 57.539 1 ATOM 7 C CD . PRO 1 76 ? A 7.766 -8.944 -19.572 1.000 1 A 57.539 1 ATOM 8 N N . LYS 2 77 ? A 5.592 -7.257 -17.442 1.000 1 A 56.683 1 ATOM 9 C CA . LYS 2 77 ? A 4.965 -6.126 -16.763 1.000 1 A 56.683 1 ATOM 10 C C . LYS 2 77 ? A 3.476 -6.047 -17.088 1.000 1 A 56.683 1 ATOM 11 O O . LYS 2 77 ? A 2.675 -5.620 -16.253 1.000 1 A 56.683 1 ATOM 12 C CB . LYS 2 77 ? A 5.655 -4.817 -17.150 1.000 1 A 56.683 1 ATOM 13 C CG . LYS 2 77 ? A 7.059 -4.666 -16.582 1.000 1 A 56.683 1 ATOM 14 C CD . LYS 2 77 ? A 7.649 -3.300 -16.907 1.000 1 A 56.683 1 ATOM 15 C CE . LYS 2 77 ? A 9.048 -3.143 -16.326 1.000 1 A 56.683 1 ATOM 16 N NZ . LYS 2 77 ? A 9.742 -1.938 -16.872 1.000 1 A 56.683 1 ATOM 17 N N . ARG 3 78 ? A 3.042 -6.620 -18.277 1.000 1 A 57.407 1 ATOM 18 C CA . ARG 3 78 ? A 1.658 -6.527 -18.730 1.000 1 A 57.407 1 ATOM 19 C C . ARG 3 78 ? A 0.779 -7.549 -18.017 1.000 1 A 57.407 1 ATOM 20 O O . ARG 3 78 ? A -0.377 -7.264 -17.696 1.000 1 A 57.407 1 ATOM 21 C CB . ARG 3 78 ? A 1.573 -6.729 -20.245 1.000 1 A 57.407 1 ATOM 22 C CG . ARG 3 78 ? A 1.919 -5.487 -21.052 1.000 1 A 57.407 1 ATOM 23 C CD . ARG 3 78 ? A 1.841 -5.749 -22.549 1.000 1 A 57.407 1 ATOM 24 N NE . ARG 3 78 ? A 1.038 -4.737 -23.231 1.000 1 A 57.407 1 ATOM 25 C CZ . ARG 3 78 ? A 1.031 -4.535 -24.546 1.000 1 A 57.407 1 ATOM 26 N NH1 . ARG 3 78 ? A 1.787 -5.274 -25.350 1.000 1 A 57.407 1 ATOM 27 N NH2 . ARG 3 78 ? A 0.263 -3.586 -25.061 1.000 1 A 57.407 1 ATOM 28 N N . LEU 4 79 ? A 1.388 -8.697 -17.509 1.000 1 A 59.149 1 ATOM 29 C CA . LEU 4 79 ? A 0.580 -9.749 -16.903 1.000 1 A 59.149 1 ATOM 30 C C . LEU 4 79 ? A 0.349 -9.471 -15.421 1.000 1 A 59.149 1 ATOM 31 O O . LEU 4 79 ? A -0.706 -9.807 -14.880 1.000 1 A 59.149 1 ATOM 32 C CB . LEU 4 79 ? A 1.255 -11.112 -17.079 1.000 1 A 59.149 1 ATOM 33 C CG . LEU 4 79 ? A 1.271 -11.682 -18.498 1.000 1 A 59.149 1 ATOM 34 C CD1 . LEU 4 79 ? A 2.246 -12.851 -18.589 1.000 1 A 59.149 1 ATOM 35 C CD2 . LEU 4 79 ? A -0.131 -12.114 -18.916 1.000 1 A 59.149 1 ATOM 36 N N . LEU 5 80 ? A 1.326 -8.675 -14.729 1.000 1 A 58.027 1 ATOM 37 C CA . LEU 5 80 ? A 1.183 -8.340 -13.317 1.000 1 A 58.027 1 ATOM 38 C C . LEU 5 80 ? A 0.051 -7.340 -13.108 1.000 1 A 58.027 1 ATOM 39 O O . LEU 5 80 ? A -0.724 -7.463 -12.156 1.000 1 A 58.027 1 ATOM 40 C CB . LEU 5 80 ? A 2.492 -7.768 -12.766 1.000 1 A 58.027 1 ATOM 41 C CG . LEU 5 80 ? A 3.500 -8.783 -12.224 1.000 1 A 58.027 1 ATOM 42 C CD1 . LEU 5 80 ? A 4.896 -8.171 -12.179 1.000 1 A 58.027 1 ATOM 43 C CD2 . LEU 5 80 ? A 3.079 -9.268 -10.841 1.000 1 A 58.027 1 ATOM 44 N N . LEU 6 81 ? A -0.043 -6.478 -14.114 1.000 1 A 57.987 1 ATOM 45 C CA . LEU 6 81 ? A -1.067 -5.453 -13.948 1.000 1 A 57.987 1 ATOM 46 C C . LEU 6 81 ? A -2.462 -6.044 -14.121 1.000 1 A 57.987 1 ATOM 47 O O . LEU 6 81 ? A -3.397 -5.658 -13.416 1.000 1 A 57.987 1 ATOM 48 C CB . LEU 6 81 ? A -0.854 -4.315 -14.950 1.000 1 A 57.987 1 ATOM 49 C CG . LEU 6 81 ? A -0.531 -2.942 -14.358 1.000 1 A 57.987 1 ATOM 50 C CD1 . LEU 6 81 ? A 0.979 -2.745 -14.271 1.000 1 A 57.987 1 ATOM 51 C CD2 . LEU 6 81 ? A -1.173 -1.837 -15.190 1.000 1 A 57.987 1 ATOM 52 N N . GLN 7 82 ? A -2.539 -7.080 -15.001 1.000 1 A 65.176 1 ATOM 53 C CA . GLN 7 82 ? A -3.816 -7.738 -15.253 1.000 1 A 65.176 1 ATOM 54 C C . GLN 7 82 ? A -4.280 -8.525 -14.031 1.000 1 A 65.176 1 ATOM 55 O O . GLN 7 82 ? A -5.468 -8.525 -13.700 1.000 1 A 65.176 1 ATOM 56 C CB . GLN 7 82 ? A -3.713 -8.664 -16.466 1.000 1 A 65.176 1 ATOM 57 C CG . GLN 7 82 ? A -5.056 -9.186 -16.958 1.000 1 A 65.176 1 ATOM 58 C CD . GLN 7 82 ? A -4.943 -9.972 -18.250 1.000 1 A 65.176 1 ATOM 59 O OE1 . GLN 7 82 ? A -3.841 -10.208 -18.754 1.000 1 A 65.176 1 ATOM 60 N NE2 . GLN 7 82 ? A -6.083 -10.384 -18.795 1.000 1 A 65.176 1 ATOM 61 N N . ARG 8 83 ? A -3.268 -9.122 -13.297 1.000 1 A 58.523 1 ATOM 62 C CA . ARG 8 83 ? A -3.592 -9.979 -12.161 1.000 1 A 58.523 1 ATOM 63 C C . ARG 8 83 ? A -3.966 -9.149 -10.937 1.000 1 A 58.523 1 ATOM 64 O O . ARG 8 83 ? A -4.878 -9.510 -10.191 1.000 1 A 58.523 1 ATOM 65 C CB . ARG 8 83 ? A -2.416 -10.900 -11.829 1.000 1 A 58.523 1 ATOM 66 C CG . ARG 8 83 ? A -2.817 -12.346 -11.582 1.000 1 A 58.523 1 ATOM 67 C CD . ARG 8 83 ? A -1.603 -13.258 -11.478 1.000 1 A 58.523 1 ATOM 68 N NE . ARG 8 83 ? A -1.981 -14.667 -11.533 1.000 1 A 58.523 1 ATOM 69 C CZ . ARG 8 83 ? A -1.123 -15.678 -11.642 1.000 1 A 58.523 1 ATOM 70 N NH1 . ARG 8 83 ? A 0.184 -15.454 -11.710 1.000 1 A 58.523 1 ATOM 71 N NH2 . ARG 8 83 ? A -1.576 -16.923 -11.683 1.000 1 A 58.523 1 ATOM 72 N N . LEU 9 84 ? A -3.257 -7.989 -10.765 1.000 1 A 58.447 1 ATOM 73 C CA . LEU 9 84 ? A -3.584 -7.097 -9.657 1.000 1 A 58.447 1 ATOM 74 C C . LEU 9 84 ? A -4.932 -6.422 -9.883 1.000 1 A 58.447 1 ATOM 75 O O . LEU 9 84 ? A -5.722 -6.274 -8.948 1.000 1 A 58.447 1 ATOM 76 C CB . LEU 9 84 ? A -2.492 -6.038 -9.481 1.000 1 A 58.447 1 ATOM 77 C CG . LEU 9 84 ? A -2.387 -5.396 -8.097 1.000 1 A 58.447 1 ATOM 78 C CD1 . LEU 9 84 ? A -1.888 -6.415 -7.077 1.000 1 A 58.447 1 ATOM 79 C CD2 . LEU 9 84 ? A -1.469 -4.180 -8.140 1.000 1 A 58.447 1 ATOM 80 N N . TYR 10 85 ? A -5.206 -6.248 -11.208 1.000 1 A 55.961 1 ATOM 81 C CA . TYR 10 85 ? A -6.465 -5.557 -11.461 1.000 1 A 55.961 1 ATOM 82 C C . TYR 10 85 ? A -7.608 -6.550 -11.634 1.000 1 A 55.961 1 ATOM 83 O O . TYR 10 85 ? A -8.780 -6.184 -11.518 1.000 1 A 55.961 1 ATOM 84 C CB . TYR 10 85 ? A -6.352 -4.670 -12.704 1.000 1 A 55.961 1 ATOM 85 C CG . TYR 10 85 ? A -5.531 -3.421 -12.486 1.000 1 A 55.961 1 ATOM 86 C CD1 . TYR 10 85 ? A -6.072 -2.314 -11.835 1.000 1 A 55.961 1 ATOM 87 C CD2 . TYR 10 85 ? A -4.216 -3.346 -12.931 1.000 1 A 55.961 1 ATOM 88 C CE1 . TYR 10 85 ? A -5.320 -1.161 -11.633 1.000 1 A 55.961 1 ATOM 89 C CE2 . TYR 10 85 ? A -3.455 -2.198 -12.735 1.000 1 A 55.961 1 ATOM 90 C CZ . TYR 10 85 ? A -4.015 -1.112 -12.086 1.000 1 A 55.961 1 ATOM 91 O OH . TYR 10 85 ? A -3.267 0.027 -11.889 1.000 1 A 55.961 1 ATOM 92 N N . SER 11 86 ? A -7.171 -7.936 -11.959 1.000 1 A 56.170 1 ATOM 93 C CA . SER 11 86 ? A -8.259 -8.893 -12.136 1.000 1 A 56.170 1 ATOM 94 C C . SER 11 86 ? A -8.758 -9.416 -10.793 1.000 1 A 56.170 1 ATOM 95 O O . SER 11 86 ? A -9.708 -10.201 -10.741 1.000 1 A 56.170 1 ATOM 96 C CB . SER 11 86 ? A -7.808 -10.062 -13.012 1.000 1 A 56.170 1 ATOM 97 O OG . SER 11 86 ? A -6.729 -10.756 -12.409 1.000 1 A 56.170 1 ATOM 98 N N . MET 12 87 ? A -7.806 -9.058 -9.685 1.000 1 A 49.893 1 ATOM 99 C CA . MET 12 87 ? A -8.438 -9.348 -8.401 1.000 1 A 49.893 1 ATOM 100 C C . MET 12 87 ? A -9.683 -8.490 -8.202 1.000 1 A 49.893 1 ATOM 101 O O . MET 12 87 ? A -9.595 -7.262 -8.157 1.000 1 A 49.893 1 ATOM 102 C CB . MET 12 87 ? A -7.455 -9.118 -7.253 1.000 1 A 49.893 1 ATOM 103 C CG . MET 12 87 ? A -7.478 -10.213 -6.198 1.000 1 A 49.893 1 ATOM 104 S SD . MET 12 87 ? A -6.118 -10.042 -4.978 1.000 1 A 49.893 1 ATOM 105 C CE . MET 12 87 ? A -5.677 -8.301 -5.232 1.000 1 A 49.893 1 ATOM 106 N N . ASP 13 88 ? A -10.565 -8.604 -9.079 1.000 1 A 54.832 1 ATOM 107 C CA . ASP 13 88 ? A -11.875 -7.994 -8.871 1.000 1 A 54.832 1 ATOM 108 C C . ASP 13 88 ? A -12.254 -7.998 -7.392 1.000 1 A 54.832 1 ATOM 109 O O . ASP 13 88 ? A -12.474 -9.059 -6.805 1.000 1 A 54.832 1 ATOM 110 C CB . ASP 13 88 ? A -12.942 -8.724 -9.690 1.000 1 A 54.832 1 ATOM 111 C CG . ASP 13 88 ? A -14.261 -7.973 -9.748 1.000 1 A 54.832 1 ATOM 112 O OD1 . ASP 13 88 ? A -14.370 -6.885 -9.143 1.000 1 A 54.832 1 ATOM 113 O OD2 . ASP 13 88 ? A -15.200 -8.475 -10.403 1.000 1 A 54.832 1 ATOM 114 N N . LEU 14 89 ? A -11.712 -7.158 -6.658 1.000 1 A 57.202 1 ATOM 115 C CA . LEU 14 89 ? A -12.131 -6.965 -5.274 1.000 1 A 57.202 1 ATOM 116 C C . LEU 14 89 ? A -13.646 -6.819 -5.179 1.000 1 A 57.202 1 ATOM 117 O O . LEU 14 89 ? A -14.197 -6.719 -4.080 1.000 1 A 57.202 1 ATOM 118 C CB . LEU 14 89 ? A -11.449 -5.732 -4.674 1.000 1 A 57.202 1 ATOM 119 C CG . LEU 14 89 ? A -9.923 -5.779 -4.582 1.000 1 A 57.202 1 ATOM 120 C CD1 . LEU 14 89 ? A -9.377 -4.422 -4.149 1.000 1 A 57.202 1 ATOM 121 C CD2 . LEU 14 89 ? A -9.478 -6.873 -3.618 1.000 1 A 57.202 1 ATOM 122 N N . ARG 15 90 ? A -14.253 -6.752 -6.463 1.000 1 A 60.050 1 ATOM 123 C CA . ARG 15 90 ? A -15.706 -6.657 -6.375 1.000 1 A 60.050 1 ATOM 124 C C . ARG 15 90 ? A -16.333 -8.029 -6.152 1.000 1 A 60.050 1 ATOM 125 O O . ARG 15 90 ? A -17.504 -8.130 -5.781 1.000 1 A 60.050 1 ATOM 126 C CB . ARG 15 90 ? A -16.281 -6.018 -7.640 1.000 1 A 60.050 1 ATOM 127 C CG . ARG 15 90 ? A -15.830 -4.583 -7.866 1.000 1 A 60.050 1 ATOM 128 C CD . ARG 15 90 ? A -16.428 -3.997 -9.137 1.000 1 A 60.050 1 ATOM 129 N NE . ARG 15 90 ? A -15.400 -3.706 -10.132 1.000 1 A 60.050 1 ATOM 130 C CZ . ARG 15 90 ? A -15.642 -3.320 -11.382 1.000 1 A 60.050 1 ATOM 131 N NH1 . ARG 15 90 ? A -16.888 -3.171 -11.816 1.000 1 A 60.050 1 ATOM 132 N NH2 . ARG 15 90 ? A -14.631 -3.081 -12.204 1.000 1 A 60.050 1 ATOM 133 N N . SER 16 91 ? A -15.473 -9.126 -6.451 1.000 1 A 55.340 1 ATOM 134 C CA . SER 16 91 ? A -16.110 -10.426 -6.269 1.000 1 A 55.340 1 ATOM 135 C C . SER 16 91 ? A -16.088 -10.853 -4.805 1.000 1 A 55.340 1 ATOM 136 O O . SER 16 91 ? A -16.728 -11.838 -4.430 1.000 1 A 55.340 1 ATOM 137 C CB . SER 16 91 ? A -15.421 -11.487 -7.128 1.000 1 A 55.340 1 ATOM 138 O OG . SER 16 91 ? A -14.117 -11.757 -6.643 1.000 1 A 55.340 1 ATOM 139 N N . SER 17 92 ? A -15.518 -10.043 -3.968 1.000 1 A 54.973 1 ATOM 140 C CA . SER 17 92 ? A -15.579 -10.462 -2.572 1.000 1 A 54.973 1 ATOM 141 C C . SER 17 92 ? A -16.837 -9.932 -1.891 1.000 1 A 54.973 1 ATOM 142 O O . SER 17 92 ? A -17.184 -10.367 -0.791 1.000 1 A 54.973 1 ATOM 143 C CB . SER 17 92 ? A -14.340 -9.985 -1.813 1.000 1 A 54.973 1 ATOM 144 O OG . SER 17 92 ? A -13.358 -9.496 -2.711 1.000 1 A 54.973 1 ATOM 145 N N . HIS 18 93 ? A -17.580 -9.214 -2.695 1.000 1 A 52.407 1 ATOM 146 C CA . HIS 18 93 ? A -18.705 -8.636 -1.969 1.000 1 A 52.407 1 ATOM 147 C C . HIS 18 93 ? A -20.013 -9.330 -2.336 1.000 1 A 52.407 1 ATOM 148 O O . HIS 18 93 ? A -21.039 -9.114 -1.687 1.000 1 A 52.407 1 ATOM 149 C CB . HIS 18 93 ? A -18.810 -7.136 -2.250 1.000 1 A 52.407 1 ATOM 150 C CG . HIS 18 93 ? A -19.887 -6.453 -1.468 1.000 1 A 52.407 1 ATOM 151 N ND1 . HIS 18 93 ? A -21.203 -6.861 -1.500 1.000 1 A 52.407 1 ATOM 152 C CD2 . HIS 18 93 ? A -19.839 -5.391 -0.630 1.000 1 A 52.407 1 ATOM 153 C CE1 . HIS 18 93 ? A -21.920 -6.076 -0.714 1.000 1 A 52.407 1 ATOM 154 N NE2 . HIS 18 93 ? A -21.117 -5.176 -0.174 1.000 1 A 52.407 1 ATOM 155 N N . LYS 19 94 ? A -19.993 -10.532 -2.929 1.000 1 A 49.150 1 ATOM 156 C CA . LYS 19 94 ? A -21.306 -11.167 -3.000 1.000 1 A 49.150 1 ATOM 157 C C . LYS 19 94 ? A -21.298 -12.523 -2.299 1.000 1 A 49.150 1 ATOM 158 O O . LYS 19 94 ? A -22.296 -13.246 -2.324 1.000 1 A 49.150 1 ATOM 159 C CB . LYS 19 94 ? A -21.745 -11.332 -4.455 1.000 1 A 49.150 1 ATOM 160 C CG . LYS 19 94 ? A -21.867 -10.021 -5.217 1.000 1 A 49.150 1 ATOM 161 C CD . LYS 19 94 ? A -23.021 -9.175 -4.693 1.000 1 A 49.150 1 ATOM 162 C CE . LYS 19 94 ? A -22.992 -7.768 -5.274 1.000 1 A 49.150 1 ATOM 163 N NZ . LYS 19 94 ? A -24.019 -6.887 -4.642 1.000 1 A 49.150 1 ATOM 164 N N . ALA 20 95 ? A -20.308 -12.753 -1.404 1.000 1 A 51.828 1 ATOM 165 C CA . ALA 20 95 ? A -20.517 -14.000 -0.674 1.000 1 A 51.828 1 ATOM 166 C C . ALA 20 95 ? A -21.239 -13.748 0.647 1.000 1 A 51.828 1 ATOM 167 O O . ALA 20 95 ? A -20.814 -12.909 1.444 1.000 1 A 51.828 1 ATOM 168 C CB . ALA 20 95 ? A -19.183 -14.699 -0.422 1.000 1 A 51.828 1 ATOM 169 N N . LYS 21 96 ? A -22.461 -13.241 0.630 1.000 1 A 50.843 1 ATOM 170 C CA . LYS 21 96 ? A -23.451 -13.448 1.683 1.000 1 A 50.843 1 ATOM 171 C C . LYS 21 96 ? A -23.063 -14.620 2.580 1.000 1 A 50.843 1 ATOM 172 O O . LYS 21 96 ? A -23.930 -15.322 3.103 1.000 1 A 50.843 1 ATOM 173 C CB . LYS 21 96 ? A -24.836 -13.688 1.078 1.000 1 A 50.843 1 ATOM 174 C CG . LYS 21 96 ? A -25.504 -12.430 0.544 1.000 1 A 50.843 1 ATOM 175 C CD . LYS 21 96 ? A -26.367 -11.761 1.606 1.000 1 A 50.843 1 ATOM 176 C CE . LYS 21 96 ? A -26.978 -10.463 1.095 1.000 1 A 50.843 1 ATOM 177 N NZ . LYS 21 96 ? A -27.739 -9.750 2.164 1.000 1 A 50.843 1 ATOM 178 N N . GLY 22 97 ? A -21.764 -14.718 3.096 1.000 1 A 51.847 1 ATOM 179 C CA . GLY 22 97 ? A -21.546 -15.755 4.092 1.000 1 A 51.847 1 ATOM 180 C C . GLY 22 97 ? A -20.451 -15.410 5.084 1.000 1 A 51.847 1 ATOM 181 O O . GLY 22 97 ? A -19.555 -14.621 4.777 1.000 1 A 51.847 1 ATOM 182 N N . LYS 23 98 ? A -20.809 -14.670 6.145 1.000 1 A 52.829 1 ATOM 183 C CA . LYS 23 98 ? A -20.195 -14.387 7.439 1.000 1 A 52.829 1 ATOM 184 C C . LYS 23 98 ? A -18.729 -14.808 7.455 1.000 1 A 52.829 1 ATOM 185 O O . LYS 23 98 ? A -18.125 -14.933 8.523 1.000 1 A 52.829 1 ATOM 186 C CB . LYS 23 98 ? A -20.956 -15.096 8.560 1.000 1 A 52.829 1 ATOM 187 C CG . LYS 23 98 ? A -21.511 -16.458 8.168 1.000 1 A 52.829 1 ATOM 188 C CD . LYS 23 98 ? A -22.261 -17.110 9.322 1.000 1 A 52.829 1 ATOM 189 C CE . LYS 23 98 ? A -22.834 -18.463 8.924 1.000 1 A 52.829 1 ATOM 190 N NZ . LYS 23 98 ? A -23.821 -18.963 9.927 1.000 1 A 52.829 1 ATOM 191 N N . GLU 24 99 ? A -18.020 -14.677 6.281 1.000 1 A 55.743 1 ATOM 192 C CA . GLU 24 99 ? A -16.604 -14.964 6.491 1.000 1 A 55.743 1 ATOM 193 C C . GLU 24 99 ? A -15.756 -13.706 6.328 1.000 1 A 55.743 1 ATOM 194 O O . GLU 24 99 ? A -15.829 -13.031 5.300 1.000 1 A 55.743 1 ATOM 195 C CB . GLU 24 99 ? A -16.127 -16.049 5.522 1.000 1 A 55.743 1 ATOM 196 C CG . GLU 24 99 ? A -16.710 -17.426 5.805 1.000 1 A 55.743 1 ATOM 197 C CD . GLU 24 99 ? A -16.321 -18.468 4.768 1.000 1 A 55.743 1 ATOM 198 O OE1 . GLU 24 99 ? A -16.699 -19.651 4.924 1.000 1 A 55.743 1 ATOM 199 O OE2 . GLU 24 99 ? A -15.631 -18.097 3.792 1.000 1 A 55.743 1 ATOM 200 N N . LYS 25 100 ? A -15.939 -12.730 7.229 1.000 1 A 46.698 1 ATOM 201 C CA . LYS 25 100 ? A -15.107 -11.543 7.405 1.000 1 A 46.698 1 ATOM 202 C C . LYS 25 100 ? A -13.672 -11.806 6.958 1.000 1 A 46.698 1 ATOM 203 O O . LYS 25 100 ? A -13.060 -12.795 7.367 1.000 1 A 46.698 1 ATOM 204 C CB . LYS 25 100 ? A -15.126 -11.085 8.864 1.000 1 A 46.698 1 ATOM 205 C CG . LYS 25 100 ? A -16.515 -10.758 9.392 1.000 1 A 46.698 1 ATOM 206 C CD . LYS 25 100 ? A -16.453 -10.138 10.782 1.000 1 A 46.698 1 ATOM 207 C CE . LYS 25 100 ? A -17.844 -9.923 11.363 1.000 1 A 46.698 1 ATOM 208 N NZ . LYS 25 100 ? A -17.799 -9.139 12.633 1.000 1 A 46.698 1 ATOM 209 N N . LEU 26 101 ? A -13.405 -11.950 5.768 1.000 1 A 52.267 1 ATOM 210 C CA . LEU 26 101 ? A -12.036 -11.970 5.264 1.000 1 A 52.267 1 ATOM 211 C C . LEU 26 101 ? A -11.133 -11.076 6.107 1.000 1 A 52.267 1 ATOM 212 O O . LEU 26 101 ? A -11.449 -9.906 6.334 1.000 1 A 52.267 1 ATOM 213 C CB . LEU 26 101 ? A -11.998 -11.521 3.801 1.000 1 A 52.267 1 ATOM 214 C CG . LEU 26 101 ? A -12.679 -12.444 2.789 1.000 1 A 52.267 1 ATOM 215 C CD1 . LEU 26 101 ? A -12.767 -11.764 1.427 1.000 1 A 52.267 1 ATOM 216 C CD2 . LEU 26 101 ? A -11.930 -13.768 2.685 1.000 1 A 52.267 1 ATOM 217 N N . CYS 27 102 ? A -10.645 -11.540 7.204 1.000 1 A 43.221 1 ATOM 218 C CA . CYS 27 102 ? A -9.679 -10.907 8.096 1.000 1 A 43.221 1 ATOM 219 C C . CYS 27 102 ? A -8.317 -10.783 7.425 1.000 1 A 43.221 1 ATOM 220 O O . CYS 27 102 ? A -7.799 -11.759 6.878 1.000 1 A 43.221 1 ATOM 221 C CB . CYS 27 102 ? A -9.549 -11.701 9.395 1.000 1 A 43.221 1 ATOM 222 S SG . CYS 27 102 ? A -11.108 -11.904 10.284 1.000 1 A 43.221 1 ATOM 223 N N . PHE 28 103 ? A -8.095 -9.652 6.688 1.000 1 A 43.739 1 ATOM 224 C CA . PHE 28 103 ? A -6.755 -9.307 6.226 1.000 1 A 43.739 1 ATOM 225 C C . PHE 28 103 ? A -5.881 -8.855 7.389 1.000 1 A 43.739 1 ATOM 226 O O . PHE 28 103 ? A -5.337 -7.749 7.371 1.000 1 A 43.739 1 ATOM 227 C CB . PHE 28 103 ? A -6.819 -8.209 5.160 1.000 1 A 43.739 1 ATOM 228 C CG . PHE 28 103 ? A -7.486 -8.642 3.882 1.000 1 A 43.739 1 ATOM 229 C CD1 . PHE 28 103 ? A -6.799 -9.408 2.948 1.000 1 A 43.739 1 ATOM 230 C CD2 . PHE 28 103 ? A -8.801 -8.283 3.614 1.000 1 A 43.739 1 ATOM 231 C CE1 . PHE 28 103 ? A -7.414 -9.810 1.764 1.000 1 A 43.739 1 ATOM 232 C CE2 . PHE 28 103 ? A -9.421 -8.681 2.434 1.000 1 A 43.739 1 ATOM 233 C CZ . PHE 28 103 ? A -8.726 -9.443 1.510 1.000 1 A 43.739 1 ATOM 234 N N . SER 29 104 ? A -5.896 -9.593 8.563 1.000 1 A 41.401 1 ATOM 235 C CA . SER 29 104 ? A -4.949 -9.090 9.553 1.000 1 A 41.401 1 ATOM 236 C C . SER 29 104 ? A -3.733 -10.003 9.667 1.000 1 A 41.401 1 ATOM 237 O O . SER 29 104 ? A -3.844 -11.219 9.496 1.000 1 A 41.401 1 ATOM 238 C CB . SER 29 104 ? A -5.623 -8.953 10.919 1.000 1 A 41.401 1 ATOM 239 O OG . SER 29 104 ? A -6.513 -10.031 11.151 1.000 1 A 41.401 1 ATOM 240 N N . LEU 30 105 ? A -2.569 -9.698 9.144 1.000 1 A 46.661 1 ATOM 241 C CA . LEU 30 105 ? A -1.256 -10.318 9.282 1.000 1 A 46.661 1 ATOM 242 C C . LEU 30 105 ? A -1.158 -11.098 10.589 1.000 1 A 46.661 1 ATOM 243 O O . LEU 30 105 ? A -0.296 -11.968 10.734 1.000 1 A 46.661 1 ATOM 244 C CB . LEU 30 105 ? A -0.153 -9.258 9.222 1.000 1 A 46.661 1 ATOM 245 C CG . LEU 30 105 ? A 0.010 -8.524 7.891 1.000 1 A 46.661 1 ATOM 246 C CD1 . LEU 30 105 ? A 1.052 -7.417 8.020 1.000 1 A 46.661 1 ATOM 247 C CD2 . LEU 30 105 ? A 0.395 -9.500 6.785 1.000 1 A 46.661 1 ATOM 248 N N . THR 31 106 ? A -2.239 -11.061 11.491 1.000 1 A 45.004 1 ATOM 249 C CA . THR 31 106 ? A -2.024 -11.735 12.767 1.000 1 A 45.004 1 ATOM 250 C C . THR 31 106 ? A -3.178 -12.684 13.079 1.000 1 A 45.004 1 ATOM 251 O O . THR 31 106 ? A -3.199 -13.316 14.136 1.000 1 A 45.004 1 ATOM 252 C CB . THR 31 106 ? A -1.866 -10.720 13.914 1.000 1 A 45.004 1 ATOM 253 O OG1 . THR 31 106 ? A -2.068 -9.396 13.405 1.000 1 A 45.004 1 ATOM 254 C CG2 . THR 31 106 ? A -0.476 -10.806 14.536 1.000 1 A 45.004 1 ATOM 255 N N . CYS 32 107 ? A -3.876 -13.258 12.126 1.000 1 A 38.368 1 ATOM 256 C CA . CYS 32 107 ? A -4.891 -14.182 12.620 1.000 1 A 38.368 1 ATOM 257 C C . CYS 32 107 ? A -4.292 -15.556 12.895 1.000 1 A 38.368 1 ATOM 258 O O . CYS 32 107 ? A -3.526 -16.077 12.082 1.000 1 A 38.368 1 ATOM 259 C CB . CYS 32 107 ? A -6.037 -14.306 11.616 1.000 1 A 38.368 1 ATOM 260 S SG . CYS 32 107 ? A -7.339 -13.075 11.840 1.000 1 A 38.368 1 ATOM 261 N N . PRO 33 108 ? A -4.282 -16.032 14.172 1.000 1 A 45.445 1 ATOM 262 C CA . PRO 33 108 ? A -3.883 -17.382 14.578 1.000 1 A 45.445 1 ATOM 263 C C . PRO 33 108 ? A -4.723 -18.470 13.914 1.000 1 A 45.445 1 ATOM 264 O O . PRO 33 108 ? A -5.933 -18.303 13.743 1.000 1 A 45.445 1 ATOM 265 C CB . PRO 33 108 ? A -4.100 -17.373 16.094 1.000 1 A 45.445 1 ATOM 266 C CG . PRO 33 108 ? A -4.657 -16.018 16.392 1.000 1 A 45.445 1 ATOM 267 C CD . PRO 33 108 ? A -4.975 -15.337 15.092 1.000 1 A 45.445 1 ATOM 268 N N . LEU 34 109 ? A -4.295 -19.062 12.849 1.000 1 A 43.523 1 ATOM 269 C CA . LEU 34 109 ? A -4.547 -20.351 12.214 1.000 1 A 43.523 1 ATOM 270 C C . LEU 34 109 ? A -5.273 -21.294 13.167 1.000 1 A 43.523 1 ATOM 271 O O . LEU 34 109 ? A -4.814 -21.524 14.288 1.000 1 A 43.523 1 ATOM 272 C CB . LEU 34 109 ? A -3.233 -20.987 11.750 1.000 1 A 43.523 1 ATOM 273 C CG . LEU 34 109 ? A -3.277 -21.739 10.420 1.000 1 A 43.523 1 ATOM 274 C CD1 . LEU 34 109 ? A -3.420 -20.759 9.261 1.000 1 A 43.523 1 ATOM 275 C CD2 . LEU 34 109 ? A -2.028 -22.598 10.250 1.000 1 A 43.523 1 ATOM 276 N N . GLY 35 110 ? A -6.563 -21.065 13.602 1.000 1 A 42.669 1 ATOM 277 C CA . GLY 35 110 ? A -7.185 -22.310 14.023 1.000 1 A 42.669 1 ATOM 278 C C . GLY 35 110 ? A -8.084 -22.149 15.234 1.000 1 A 42.669 1 ATOM 279 O O . GLY 35 110 ? A -7.622 -21.760 16.309 1.000 1 A 42.669 1 ATOM 280 N N . SER 36 111 ? A -9.189 -21.533 15.155 1.000 1 A 38.526 1 ATOM 281 C CA . SER 36 111 ? A -10.038 -21.898 16.284 1.000 1 A 38.526 1 ATOM 282 C C . SER 36 111 ? A -11.501 -21.570 16.005 1.000 1 A 38.526 1 ATOM 283 O O . SER 36 111 ? A -11.860 -20.402 15.842 1.000 1 A 38.526 1 ATOM 284 C CB . SER 36 111 ? A -9.579 -21.180 17.554 1.000 1 A 38.526 1 ATOM 285 O OG . SER 36 111 ? A -10.169 -19.895 17.646 1.000 1 A 38.526 1 ATOM 286 N N . GLY 37 112 ? A -12.154 -22.167 15.191 1.000 1 A 40.587 1 ATOM 287 C CA . GLY 37 112 ? A -13.605 -22.103 15.262 1.000 1 A 40.587 1 ATOM 288 C C . GLY 37 112 ? A -14.242 -23.426 15.643 1.000 1 A 40.587 1 ATOM 289 O O . GLY 37 112 ? A -13.923 -24.465 15.061 1.000 1 A 40.587 1 ATOM 290 N N . SER 38 113 ? A -14.342 -23.819 16.899 1.000 1 A 37.311 1 ATOM 291 C CA . SER 38 113 ? A -15.236 -24.140 18.006 1.000 1 A 37.311 1 ATOM 292 C C . SER 38 113 ? A -16.482 -24.871 17.517 1.000 1 A 37.311 1 ATOM 293 O O . SER 38 113 ? A -17.232 -24.347 16.691 1.000 1 A 37.311 1 ATOM 294 C CB . SER 38 113 ? A -15.642 -22.868 18.754 1.000 1 A 37.311 1 ATOM 295 O OG . SER 38 113 ? A -16.663 -23.144 19.697 1.000 1 A 37.311 1 ATOM 296 N N . PRO 39 114 ? A -16.604 -26.257 17.730 1.000 1 A 44.204 1 ATOM 297 C CA . PRO 39 114 ? A -17.827 -27.042 17.542 1.000 1 A 44.204 1 ATOM 298 C C . PRO 39 114 ? A -18.699 -27.084 18.794 1.000 1 A 44.204 1 ATOM 299 O O . PRO 39 114 ? A -18.183 -27.219 19.906 1.000 1 A 44.204 1 ATOM 300 C CB . PRO 39 114 ? A -17.300 -28.437 17.196 1.000 1 A 44.204 1 ATOM 301 C CG . PRO 39 114 ? A -15.994 -28.541 17.915 1.000 1 A 44.204 1 ATOM 302 C CD . PRO 39 114 ? A -15.544 -27.158 18.290 1.000 1 A 44.204 1 ATOM 303 N N . GLU 40 115 ? A -19.427 -26.081 19.095 1.000 1 A 29.912 1 ATOM 304 C CA . GLU 40 115 ? A -20.305 -26.066 20.261 1.000 1 A 29.912 1 ATOM 305 C C . GLU 40 115 ? A -21.757 -25.832 19.855 1.000 1 A 29.912 1 ATOM 306 O O . GLU 40 115 ? A -22.083 -24.802 19.261 1.000 1 A 29.912 1 ATOM 307 C CB . GLU 40 115 ? A -19.858 -24.993 21.256 1.000 1 A 29.912 1 ATOM 308 C CG . GLU 40 115 ? A -19.615 -25.521 22.663 1.000 1 A 29.912 1 ATOM 309 C CD . GLU 40 115 ? A -19.086 -24.464 23.618 1.000 1 A 29.912 1 ATOM 310 O OE1 . GLU 40 115 ? A -19.135 -24.680 24.851 1.000 1 A 29.912 1 ATOM 311 O OE2 . GLU 40 115 ? A -18.619 -23.410 23.131 1.000 1 A 29.912 1 ATOM 312 N N . GLY 41 116 ? A -22.475 -26.883 19.509 1.000 1 A 32.520 1 ATOM 313 C CA . GLY 41 116 ? A -23.858 -26.899 19.960 1.000 1 A 32.520 1 ATOM 314 C C . GLY 41 116 ? A -24.645 -28.082 19.428 1.000 1 A 32.520 1 ATOM 315 O O . GLY 41 116 ? A -24.646 -28.342 18.223 1.000 1 A 32.520 1 ATOM 316 N N . VAL 42 117 ? A -24.778 -29.175 20.147 1.000 1 A 31.285 1 ATOM 317 C CA . VAL 42 117 ? A -26.093 -29.617 20.601 1.000 1 A 31.285 1 ATOM 318 C C . VAL 42 117 ? A -26.173 -31.141 20.546 1.000 1 A 31.285 1 ATOM 319 O O . VAL 42 117 ? A -25.824 -31.751 19.533 1.000 1 A 31.285 1 ATOM 320 C CB . VAL 42 117 ? A -27.225 -28.992 19.755 1.000 1 A 31.285 1 ATOM 321 C CG1 . VAL 42 117 ? A -28.575 -29.606 20.123 1.000 1 A 31.285 1 ATOM 322 C CG2 . VAL 42 117 ? A -27.255 -27.477 19.941 1.000 1 A 31.285 1 ATOM 323 N N . VAL 43 118 ? A -26.007 -31.845 21.680 1.000 1 A 33.890 1 ATOM 324 C CA . VAL 43 118 ? A -27.046 -32.683 22.271 1.000 1 A 33.890 1 ATOM 325 C C . VAL 43 118 ? A -26.420 -33.947 22.856 1.000 1 A 33.890 1 ATOM 326 O O . VAL 43 118 ? A -25.559 -34.569 22.229 1.000 1 A 33.890 1 ATOM 327 C CB . VAL 43 118 ? A -28.131 -33.055 21.236 1.000 1 A 33.890 1 ATOM 328 C CG1 . VAL 43 118 ? A -29.471 -33.307 21.926 1.000 1 A 33.890 1 ATOM 329 C CG2 . VAL 43 118 ? A -28.267 -31.954 20.186 1.000 1 A 33.890 1 ATOM 330 N N . LYS 44 119 ? A -26.364 -34.052 24.192 1.000 1 A 33.609 1 ATOM 331 C CA . LYS 44 119 ? A -27.108 -34.894 25.125 1.000 1 A 33.609 1 ATOM 332 C C . LYS 44 119 ? A -26.571 -36.322 25.124 1.000 1 A 33.609 1 ATOM 333 O O . LYS 44 119 ? A -26.376 -36.917 24.062 1.000 1 A 33.609 1 ATOM 334 C CB . LYS 44 119 ? A -28.597 -34.893 24.778 1.000 1 A 33.609 1 ATOM 335 C CG . LYS 44 119 ? A -29.399 -33.816 25.493 1.000 1 A 33.609 1 ATOM 336 C CD . LYS 44 119 ? A -30.191 -34.390 26.661 1.000 1 A 33.609 1 ATOM 337 C CE . LYS 44 119 ? A -30.951 -33.304 27.410 1.000 1 A 33.609 1 ATOM 338 N NZ . LYS 44 119 ? A -31.700 -33.857 28.577 1.000 1 A 33.609 1 ATOM 339 N N . ALA 45 120 ? A -25.847 -36.719 26.184 1.000 1 A 32.177 1 ATOM 340 C CA . ALA 45 120 ? A -26.080 -37.740 27.201 1.000 1 A 32.177 1 ATOM 341 C C . ALA 45 120 ? A -25.634 -39.115 26.711 1.000 1 A 32.177 1 ATOM 342 O O . ALA 45 120 ? A -26.112 -39.599 25.682 1.000 1 A 32.177 1 ATOM 343 C CB . ALA 45 120 ? A -27.555 -37.772 27.595 1.000 1 A 32.177 1 ATOM 344 N N . GLY 46 121 ? A -24.531 -39.528 27.048 1.000 1 A 28.980 1 ATOM 345 C CA . GLY 46 121 ? A -24.341 -40.887 27.530 1.000 1 A 28.980 1 ATOM 346 C C . GLY 46 121 ? A -23.337 -41.676 26.711 1.000 1 A 28.980 1 ATOM 347 O O . GLY 46 121 ? A -23.377 -41.652 25.479 1.000 1 A 28.980 1 ATOM 348 N N . ALA 47 122 ? A -22.071 -41.711 27.164 1.000 1 A 30.946 1 ATOM 349 C CA . ALA 47 122 ? A -21.202 -42.854 27.430 1.000 1 A 30.946 1 ATOM 350 C C . ALA 47 122 ? A -20.718 -43.491 26.130 1.000 1 A 30.946 1 ATOM 351 O O . ALA 47 122 ? A -21.516 -43.759 25.229 1.000 1 A 30.946 1 ATOM 352 C CB . ALA 47 122 ? A -21.930 -43.888 28.286 1.000 1 A 30.946 1 ATOM 353 N N . PRO 48 123 ? A -19.434 -43.773 25.884 1.000 1 A 43.153 1 ATOM 354 C CA . PRO 48 123 ? A -18.442 -43.893 24.813 1.000 1 A 43.153 1 ATOM 355 C C . PRO 48 123 ? A -18.290 -45.325 24.307 1.000 1 A 43.153 1 ATOM 356 O O . PRO 48 123 ? A -18.550 -46.277 25.048 1.000 1 A 43.153 1 ATOM 357 C CB . PRO 48 123 ? A -17.149 -43.407 25.474 1.000 1 A 43.153 1 ATOM 358 C CG . PRO 48 123 ? A -17.247 -43.872 26.891 1.000 1 A 43.153 1 ATOM 359 C CD . PRO 48 123 ? A -18.607 -44.474 27.103 1.000 1 A 43.153 1 ATOM 360 N N . GLU 49 124 ? A -18.683 -45.684 23.118 1.000 1 A 32.759 1 ATOM 361 C CA . GLU 49 124 ? A -18.110 -46.871 22.489 1.000 1 A 32.759 1 ATOM 362 C C . GLU 49 124 ? A -18.524 -46.972 21.023 1.000 1 A 32.759 1 ATOM 363 O O . GLU 49 124 ? A -19.714 -46.933 20.705 1.000 1 A 32.759 1 ATOM 364 C CB . GLU 49 124 ? A -18.531 -48.135 23.243 1.000 1 A 32.759 1 ATOM 365 C CG . GLU 49 124 ? A -17.798 -49.391 22.794 1.000 1 A 32.759 1 ATOM 366 C CD . GLU 49 124 ? A -18.563 -50.671 23.092 1.000 1 A 32.759 1 ATOM 367 O OE1 . GLU 49 124 ? A -18.217 -51.731 22.524 1.000 1 A 32.759 1 ATOM 368 O OE2 . GLU 49 124 ? A -19.517 -50.612 23.900 1.000 1 A 32.759 1 ATOM 369 N N . LEU 50 125 ? A -17.810 -46.380 20.025 1.000 1 A 35.218 1 ATOM 370 C CA . LEU 50 125 ? A -17.374 -47.163 18.874 1.000 1 A 35.218 1 ATOM 371 C C . LEU 50 125 ? A -18.343 -47.001 17.708 1.000 1 A 35.218 1 ATOM 372 O O . LEU 50 125 ? A -19.518 -47.358 17.818 1.000 1 A 35.218 1 ATOM 373 C CB . LEU 50 125 ? A -17.250 -48.642 19.248 1.000 1 A 35.218 1 ATOM 374 C CG . LEU 50 125 ? A -16.526 -49.538 18.241 1.000 1 A 35.218 1 ATOM 375 C CD1 . LEU 50 125 ? A -15.019 -49.317 18.323 1.000 1 A 35.218 1 ATOM 376 C CD2 . LEU 50 125 ? A -16.871 -51.003 18.483 1.000 1 A 35.218 1 ATOM 377 N N . VAL 51 126 ? A -18.302 -45.970 16.924 1.000 1 A 35.925 1 ATOM 378 C CA . VAL 51 126 ? A -18.511 -46.175 15.495 1.000 1 A 35.925 1 ATOM 379 C C . VAL 51 126 ? A -18.107 -44.918 14.728 1.000 1 A 35.925 1 ATOM 380 O O . VAL 51 126 ? A -18.656 -43.838 14.959 1.000 1 A 35.925 1 ATOM 381 C CB . VAL 51 126 ? A -19.979 -46.541 15.183 1.000 1 A 35.925 1 ATOM 382 C CG1 . VAL 51 126 ? A -20.270 -46.383 13.692 1.000 1 A 35.925 1 ATOM 383 C CG2 . VAL 51 126 ? A -20.283 -47.965 15.643 1.000 1 A 35.925 1 ATOM 384 N N . ASP 52 127 ? A -16.867 -44.528 14.721 1.000 1 A 35.968 1 ATOM 385 C CA . ASP 52 127 ? A -15.956 -43.989 13.716 1.000 1 A 35.968 1 ATOM 386 C C . ASP 52 127 ? A -16.623 -43.932 12.344 1.000 1 A 35.968 1 ATOM 387 O O . ASP 52 127 ? A -16.764 -44.956 11.673 1.000 1 A 35.968 1 ATOM 388 C CB . ASP 52 127 ? A -14.678 -44.827 13.645 1.000 1 A 35.968 1 ATOM 389 C CG . ASP 52 127 ? A -13.425 -43.985 13.482 1.000 1 A 35.968 1 ATOM 390 O OD1 . ASP 52 127 ? A -13.517 -42.739 13.525 1.000 1 A 35.968 1 ATOM 391 O OD2 . ASP 52 127 ? A -12.335 -44.573 13.307 1.000 1 A 35.968 1 ATOM 392 N N . LYS 53 128 ? A -17.827 -43.271 12.205 1.000 1 A 38.866 1 ATOM 393 C CA . LYS 53 128 ? A -18.279 -42.808 10.896 1.000 1 A 38.866 1 ATOM 394 C C . LYS 53 128 ? A -18.224 -41.286 10.802 1.000 1 A 38.866 1 ATOM 395 O O . LYS 53 128 ? A -18.933 -40.588 11.530 1.000 1 A 38.866 1 ATOM 396 C CB . LYS 53 128 ? A -19.700 -43.299 10.613 1.000 1 A 38.866 1 ATOM 397 C CG . LYS 53 128 ? A -19.836 -44.814 10.582 1.000 1 A 38.866 1 ATOM 398 C CD . LYS 53 128 ? A -19.915 -45.339 9.155 1.000 1 A 38.866 1 ATOM 399 C CE . LYS 53 128 ? A -20.288 -46.815 9.120 1.000 1 A 38.866 1 ATOM 400 N NZ . LYS 53 128 ? A -19.747 -47.495 7.905 1.000 1 A 38.866 1 ATOM 401 N N . GLY 54 129 ? A -17.053 -40.678 10.869 1.000 1 A 35.359 1 ATOM 402 C CA . GLY 54 129 ? A -16.429 -39.454 10.394 1.000 1 A 35.359 1 ATOM 403 C C . GLY 54 129 ? A -17.373 -38.572 9.599 1.000 1 A 35.359 1 ATOM 404 O O . GLY 54 129 ? A -18.152 -39.067 8.781 1.000 1 A 35.359 1 ATOM 405 N N . PRO 55 130 ? A -17.770 -37.452 10.195 1.000 1 A 45.814 1 ATOM 406 C CA . PRO 55 130 ? A -18.605 -36.335 9.746 1.000 1 A 45.814 1 ATOM 407 C C . PRO 55 130 ? A -17.943 -35.510 8.644 1.000 1 A 45.814 1 ATOM 408 O O . PRO 55 130 ? A -16.733 -35.273 8.687 1.000 1 A 45.814 1 ATOM 409 C CB . PRO 55 130 ? A -18.790 -35.500 11.016 1.000 1 A 45.814 1 ATOM 410 C CG . PRO 55 130 ? A -18.089 -36.273 12.087 1.000 1 A 45.814 1 ATOM 411 C CD . PRO 55 130 ? A -17.210 -37.301 11.435 1.000 1 A 45.814 1 ATOM 412 N N . LEU 56 131 ? A -18.243 -35.886 7.374 1.000 1 A 41.683 1 ATOM 413 C CA . LEU 56 131 ? A -18.552 -35.187 6.132 1.000 1 A 41.683 1 ATOM 414 C C . LEU 56 131 ? A -17.965 -33.779 6.141 1.000 1 A 41.683 1 ATOM 415 O O . LEU 56 131 ? A -18.465 -32.898 6.845 1.000 1 A 41.683 1 ATOM 416 C CB . LEU 56 131 ? A -20.066 -35.120 5.916 1.000 1 A 41.683 1 ATOM 417 C CG . LEU 56 131 ? A -20.689 -36.272 5.126 1.000 1 A 41.683 1 ATOM 418 C CD1 . LEU 56 131 ? A -21.826 -36.905 5.921 1.000 1 A 41.683 1 ATOM 419 C CD2 . LEU 56 131 ? A -21.186 -35.783 3.770 1.000 1 A 41.683 1 ATOM 420 N N . VAL 57 132 ? A -16.608 -33.641 6.447 1.000 1 A 45.832 1 ATOM 421 C CA . VAL 57 132 ? A -15.717 -32.517 6.177 1.000 1 A 45.832 1 ATOM 422 C C . VAL 57 132 ? A -15.794 -32.140 4.699 1.000 1 A 45.832 1 ATOM 423 O O . VAL 57 132 ? A -15.802 -33.013 3.829 1.000 1 A 45.832 1 ATOM 424 C CB . VAL 57 132 ? A -14.258 -32.843 6.568 1.000 1 A 45.832 1 ATOM 425 C CG1 . VAL 57 132 ? A -13.341 -31.660 6.267 1.000 1 A 45.832 1 ATOM 426 C CG2 . VAL 57 132 ? A -14.175 -33.225 8.045 1.000 1 A 45.832 1 ATOM 427 N N . PRO 58 133 ? A -16.494 -31.015 4.374 1.000 1 A 48.438 1 ATOM 428 C CA . PRO 58 133 ? A -16.399 -30.529 2.996 1.000 1 A 48.438 1 ATOM 429 C C . PRO 58 133 ? A -14.967 -30.537 2.465 1.000 1 A 48.438 1 ATOM 430 O O . PRO 58 133 ? A -14.057 -30.028 3.125 1.000 1 A 48.438 1 ATOM 431 C CB . PRO 58 133 ? A -16.939 -29.100 3.087 1.000 1 A 48.438 1 ATOM 432 C CG . PRO 58 133 ? A -17.179 -28.875 4.545 1.000 1 A 48.438 1 ATOM 433 C CD . PRO 58 133 ? A -16.536 -29.994 5.313 1.000 1 A 48.438 1 ATOM 434 N N . THR 59 134 ? A -14.513 -31.709 2.126 1.000 1 A 47.479 1 ATOM 435 C CA . THR 59 134 ? A -13.454 -32.197 1.251 1.000 1 A 47.479 1 ATOM 436 C C . THR 59 134 ? A -13.045 -31.124 0.246 1.000 1 A 47.479 1 ATOM 437 O O . THR 59 134 ? A -13.892 -30.565 -0.453 1.000 1 A 47.479 1 ATOM 438 C CB . THR 59 134 ? A -13.892 -33.468 0.499 1.000 1 A 47.479 1 ATOM 439 O OG1 . THR 59 134 ? A -14.293 -34.463 1.449 1.000 1 A 47.479 1 ATOM 440 C CG2 . THR 59 134 ? A -12.754 -34.023 -0.352 1.000 1 A 47.479 1 ATOM 441 N N . LEU 60 135 ? A -12.417 -30.089 0.648 1.000 1 A 52.980 1 ATOM 442 C CA . LEU 60 135 ? A -11.638 -29.337 -0.330 1.000 1 A 52.980 1 ATOM 443 C C . LEU 60 135 ? A -11.150 -30.247 -1.452 1.000 1 A 52.980 1 ATOM 444 O O . LEU 60 135 ? A -10.778 -31.397 -1.207 1.000 1 A 52.980 1 ATOM 445 C CB . LEU 60 135 ? A -10.445 -28.655 0.345 1.000 1 A 52.980 1 ATOM 446 C CG . LEU 60 135 ? A -10.745 -27.362 1.106 1.000 1 A 52.980 1 ATOM 447 C CD1 . LEU 60 135 ? A -9.607 -27.038 2.068 1.000 1 A 52.980 1 ATOM 448 C CD2 . LEU 60 135 ? A -10.975 -26.210 0.134 1.000 1 A 52.980 1 ATOM 449 N N . PRO 61 136 ? A -11.676 -30.101 -2.761 1.000 1 A 60.356 1 ATOM 450 C CA . PRO 61 136 ? A -11.378 -30.965 -3.905 1.000 1 A 60.356 1 ATOM 451 C C . PRO 61 136 ? A -9.882 -31.220 -4.077 1.000 1 A 60.356 1 ATOM 452 O O . PRO 61 136 ? A -9.480 -31.981 -4.961 1.000 1 A 60.356 1 ATOM 453 C CB . PRO 61 136 ? A -11.938 -30.181 -5.094 1.000 1 A 60.356 1 ATOM 454 C CG . PRO 61 136 ? A -11.953 -28.757 -4.640 1.000 1 A 60.356 1 ATOM 455 C CD . PRO 61 136 ? A -11.885 -28.734 -3.140 1.000 1 A 60.356 1 ATOM 456 N N . PHE 62 137 ? A -9.011 -31.095 -3.108 1.000 1 A 51.122 1 ATOM 457 C CA . PHE 62 137 ? A -7.682 -31.693 -3.166 1.000 1 A 51.122 1 ATOM 458 C C . PHE 62 137 ? A -7.162 -31.993 -1.765 1.000 1 A 51.122 1 ATOM 459 O O . PHE 62 137 ? A -7.342 -31.191 -0.846 1.000 1 A 51.122 1 ATOM 460 C CB . PHE 62 137 ? A -6.706 -30.770 -3.901 1.000 1 A 51.122 1 ATOM 461 C CG . PHE 62 137 ? A -6.750 -29.341 -3.429 1.000 1 A 51.122 1 ATOM 462 C CD1 . PHE 62 137 ? A -7.604 -28.423 -4.027 1.000 1 A 51.122 1 ATOM 463 C CD2 . PHE 62 137 ? A -5.936 -28.917 -2.387 1.000 1 A 51.122 1 ATOM 464 C CE1 . PHE 62 137 ? A -7.646 -27.100 -3.592 1.000 1 A 51.122 1 ATOM 465 C CE2 . PHE 62 137 ? A -5.972 -27.597 -1.947 1.000 1 A 51.122 1 ATOM 466 C CZ . PHE 62 137 ? A -6.827 -26.690 -2.552 1.000 1 A 51.122 1 ATOM 467 N N . PRO 63 138 ? A -6.995 -33.130 -1.414 1.000 1 A 49.394 1 ATOM 468 C CA . PRO 63 138 ? A -6.480 -33.718 -0.175 1.000 1 A 49.394 1 ATOM 469 C C . PRO 63 138 ? A -5.230 -33.008 0.339 1.000 1 A 49.394 1 ATOM 470 O O . PRO 63 138 ? A -4.345 -32.661 -0.448 1.000 1 A 49.394 1 ATOM 471 C CB . PRO 63 138 ? A -6.164 -35.161 -0.574 1.000 1 A 49.394 1 ATOM 472 C CG . PRO 63 138 ? A -6.575 -35.260 -2.008 1.000 1 A 49.394 1 ATOM 473 C CD . PRO 63 138 ? A -6.887 -33.880 -2.511 1.000 1 A 49.394 1 ATOM 474 N N . LEU 64 139 ? A -5.384 -32.020 1.244 1.000 1 A 53.882 1 ATOM 475 C CA . LEU 64 139 ? A -4.228 -31.512 1.976 1.000 1 A 53.882 1 ATOM 476 C C . LEU 64 139 ? A -3.462 -32.651 2.640 1.000 1 A 53.882 1 ATOM 477 O O . LEU 64 139 ? A -3.991 -33.330 3.522 1.000 1 A 53.882 1 ATOM 478 C CB . LEU 64 139 ? A -4.667 -30.493 3.031 1.000 1 A 53.882 1 ATOM 479 C CG . LEU 64 139 ? A -5.301 -29.204 2.506 1.000 1 A 53.882 1 ATOM 480 C CD1 . LEU 64 139 ? A -5.870 -28.385 3.660 1.000 1 A 53.882 1 ATOM 481 C CD2 . LEU 64 139 ? A -4.281 -28.389 1.717 1.000 1 A 53.882 1 ATOM 482 N N . ARG 65 140 ? A -3.113 -33.735 1.854 1.000 1 A 51.939 1 ATOM 483 C CA . ARG 65 140 ? A -2.167 -34.805 2.153 1.000 1 A 51.939 1 ATOM 484 C C . ARG 65 140 ? A -1.459 -34.555 3.480 1.000 1 A 51.939 1 ATOM 485 O O . ARG 65 140 ? A -1.030 -33.434 3.760 1.000 1 A 51.939 1 ATOM 486 C CB . ARG 65 140 ? A -1.138 -34.943 1.028 1.000 1 A 51.939 1 ATOM 487 C CG . ARG 65 140 ? A -1.720 -35.456 -0.279 1.000 1 A 51.939 1 ATOM 488 C CD . ARG 65 140 ? A -0.716 -36.302 -1.050 1.000 1 A 51.939 1 ATOM 489 N NE . ARG 65 140 ? A -1.351 -37.026 -2.147 1.000 1 A 51.939 1 ATOM 490 C CZ . ARG 65 140 ? A -1.152 -36.773 -3.438 1.000 1 A 51.939 1 ATOM 491 N NH1 . ARG 65 140 ? A -0.327 -35.805 -3.820 1.000 1 A 51.939 1 ATOM 492 N NH2 . ARG 65 140 ? A -1.782 -37.494 -4.354 1.000 1 A 51.939 1 ATOM 493 N N . LYS 66 141 ? A -1.904 -35.031 4.568 1.000 1 A 53.710 1 ATOM 494 C CA . LYS 66 141 ? A -1.232 -35.599 5.733 1.000 1 A 53.710 1 ATOM 495 C C . LYS 66 141 ? A 0.275 -35.691 5.508 1.000 1 A 53.710 1 ATOM 496 O O . LYS 66 141 ? A 0.724 -36.189 4.474 1.000 1 A 53.710 1 ATOM 497 C CB . LYS 66 141 ? A -1.798 -36.982 6.059 1.000 1 A 53.710 1 ATOM 498 C CG . LYS 66 141 ? A -3.237 -36.961 6.553 1.000 1 A 53.710 1 ATOM 499 C CD . LYS 66 141 ? A -3.788 -38.370 6.731 1.000 1 A 53.710 1 ATOM 500 C CE . LYS 66 141 ? A -5.256 -38.351 7.135 1.000 1 A 53.710 1 ATOM 501 N NZ . LYS 66 141 ? A -5.802 -39.731 7.303 1.000 1 A 53.710 1 ATOM 502 N N . PRO 67 142 ? A 1.076 -34.735 5.946 1.000 1 A 54.562 1 ATOM 503 C CA . PRO 67 142 ? A 2.538 -34.694 5.867 1.000 1 A 54.562 1 ATOM 504 C C . PRO 67 142 ? A 3.180 -36.060 6.094 1.000 1 A 54.562 1 ATOM 505 O O . PRO 67 142 ? A 2.797 -36.780 7.020 1.000 1 A 54.562 1 ATOM 506 C CB . PRO 67 142 ? A 2.924 -33.716 6.980 1.000 1 A 54.562 1 ATOM 507 C CG . PRO 67 142 ? A 1.755 -33.717 7.911 1.000 1 A 54.562 1 ATOM 508 C CD . PRO 67 142 ? A 0.574 -34.306 7.194 1.000 1 A 54.562 1 ATOM 509 N N . ARG 68 143 ? A 3.214 -36.876 5.141 1.000 1 A 52.047 1 ATOM 510 C CA . ARG 68 143 ? A 4.087 -38.042 5.037 1.000 1 A 52.047 1 ATOM 511 C C . ARG 68 143 ? A 5.504 -37.707 5.490 1.000 1 A 52.047 1 ATOM 512 O O . ARG 68 143 ? A 6.026 -36.636 5.173 1.000 1 A 52.047 1 ATOM 513 C CB . ARG 68 143 ? A 4.107 -38.573 3.602 1.000 1 A 52.047 1 ATOM 514 C CG . ARG 68 143 ? A 2.797 -39.207 3.162 1.000 1 A 52.047 1 ATOM 515 C CD . ARG 68 143 ? A 3.022 -40.311 2.137 1.000 1 A 52.047 1 ATOM 516 N NE . ARG 68 143 ? A 1.817 -41.110 1.933 1.000 1 A 52.047 1 ATOM 517 C CZ . ARG 68 143 ? A 1.561 -41.829 0.844 1.000 1 A 52.047 1 ATOM 518 N NH1 . ARG 68 143 ? A 2.424 -41.864 -0.165 1.000 1 A 52.047 1 ATOM 519 N NH2 . ARG 68 143 ? A 0.433 -42.519 0.762 1.000 1 A 52.047 1 ATOM 520 N N . LYS 69 144 ? A 5.856 -37.726 6.760 1.000 1 A 57.041 1 ATOM 521 C CA . LYS 69 144 ? A 7.145 -38.039 7.369 1.000 1 A 57.041 1 ATOM 522 C C . LYS 69 144 ? A 8.200 -38.329 6.305 1.000 1 A 57.041 1 ATOM 523 O O . LYS 69 144 ? A 8.017 -39.213 5.466 1.000 1 A 57.041 1 ATOM 524 C CB . LYS 69 144 ? A 7.016 -39.233 8.317 1.000 1 A 57.041 1 ATOM 525 C CG . LYS 69 144 ? A 6.099 -38.983 9.506 1.000 1 A 57.041 1 ATOM 526 C CD . LYS 69 144 ? A 5.979 -40.219 10.388 1.000 1 A 57.041 1 ATOM 527 C CE . LYS 69 144 ? A 4.991 -40.000 11.526 1.000 1 A 57.041 1 ATOM 528 N NZ . LYS 69 144 ? A 4.881 -41.204 12.403 1.000 1 A 57.041 1 ATOM 529 N N . ALA 70 145 ? A 8.588 -37.357 5.499 1.000 1 A 48.312 1 ATOM 530 C CA . ALA 70 145 ? A 9.963 -37.497 5.026 1.000 1 A 48.312 1 ATOM 531 C C . ALA 70 145 ? A 10.278 -36.467 3.945 1.000 1 A 48.312 1 ATOM 532 O O . ALA 70 145 ? A 9.852 -36.612 2.797 1.000 1 A 48.312 1 ATOM 533 C CB . ALA 70 145 ? A 10.203 -38.909 4.498 1.000 1 A 48.312 1 ATOM 534 N N . HIS 71 146 ? A 10.202 -35.159 4.218 1.000 1 A 46.041 1 ATOM 535 C CA . HIS 71 146 ? A 11.044 -34.378 3.319 1.000 1 A 46.041 1 ATOM 536 C C . HIS 71 146 ? A 12.147 -33.656 4.085 1.000 1 A 46.041 1 ATOM 537 O O . HIS 71 146 ? A 11.866 -32.805 4.932 1.000 1 A 46.041 1 ATOM 538 C CB . HIS 71 146 ? A 10.201 -33.368 2.537 1.000 1 A 46.041 1 ATOM 539 C CG . HIS 71 146 ? A 9.646 -33.913 1.259 1.000 1 A 46.041 1 ATOM 540 N ND1 . HIS 71 146 ? A 10.444 -34.413 0.254 1.000 1 A 46.041 1 ATOM 541 C CD2 . HIS 71 146 ? A 8.369 -34.037 0.827 1.000 1 A 46.041 1 ATOM 542 C CE1 . HIS 71 146 ? A 9.680 -34.821 -0.745 1.000 1 A 46.041 1 ATOM 543 N NE2 . HIS 71 146 ? A 8.416 -34.604 -0.423 1.000 1 A 46.041 1 ATOM 544 N N . LYS 72 147 ? A 13.063 -34.417 4.709 1.000 1 A 54.896 1 ATOM 545 C CA . LYS 72 147 ? A 14.495 -34.172 4.855 1.000 1 A 54.896 1 ATOM 546 C C . LYS 72 147 ? A 15.054 -33.437 3.641 1.000 1 A 54.896 1 ATOM 547 O O . LYS 72 147 ? A 16.186 -32.950 3.670 1.000 1 A 54.896 1 ATOM 548 C CB . LYS 72 147 ? A 15.246 -35.488 5.063 1.000 1 A 54.896 1 ATOM 549 C CG . LYS 72 147 ? A 14.867 -36.222 6.341 1.000 1 A 54.896 1 ATOM 550 C CD . LYS 72 147 ? A 15.689 -37.492 6.521 1.000 1 A 54.896 1 ATOM 551 C CE . LYS 72 147 ? A 15.194 -38.317 7.701 1.000 1 A 54.896 1 ATOM 552 N NZ . LYS 72 147 ? A 16.112 -39.455 8.006 1.000 1 A 54.896 1 ATOM 553 N N . TYR 73 148 ? A 14.469 -32.332 3.123 1.000 1 A 44.072 1 ATOM 554 C CA . TYR 73 148 ? A 15.435 -31.538 2.371 1.000 1 A 44.072 1 ATOM 555 C C . TYR 73 148 ? A 14.872 -30.159 2.047 1.000 1 A 44.072 1 ATOM 556 O O . TYR 73 148 ? A 13.832 -30.044 1.395 1.000 1 A 44.072 1 ATOM 557 C CB . TYR 73 148 ? A 15.833 -32.257 1.079 1.000 1 A 44.072 1 ATOM 558 C CG . TYR 73 148 ? A 16.635 -33.515 1.306 1.000 1 A 44.072 1 ATOM 559 C CD1 . TYR 73 148 ? A 18.014 -33.461 1.494 1.000 1 A 44.072 1 ATOM 560 C CD2 . TYR 73 148 ? A 16.015 -34.760 1.333 1.000 1 A 44.072 1 ATOM 561 C CE1 . TYR 73 148 ? A 18.757 -34.618 1.702 1.000 1 A 44.072 1 ATOM 562 C CE2 . TYR 73 148 ? A 16.749 -35.924 1.540 1.000 1 A 44.072 1 ATOM 563 C CZ . TYR 73 148 ? A 18.117 -35.843 1.724 1.000 1 A 44.072 1 ATOM 564 O OH . TYR 73 148 ? A 18.848 -36.992 1.929 1.000 1 A 44.072 1 ATOM 565 N N . LEU 74 149 ? A 14.731 -29.255 2.951 1.000 1 A 47.357 1 ATOM 566 C CA . LEU 74 149 ? A 15.074 -27.921 2.469 1.000 1 A 47.357 1 ATOM 567 C C . LEU 74 149 ? A 15.348 -26.976 3.634 1.000 1 A 47.357 1 ATOM 568 O O . LEU 74 149 ? A 14.416 -26.434 4.232 1.000 1 A 47.357 1 ATOM 569 C CB . LEU 74 149 ? A 13.947 -27.361 1.597 1.000 1 A 47.357 1 ATOM 570 C CG . LEU 74 149 ? A 14.319 -26.201 0.672 1.000 1 A 47.357 1 ATOM 571 C CD1 . LEU 74 149 ? A 15.248 -26.684 -0.437 1.000 1 A 47.357 1 ATOM 572 C CD2 . LEU 74 149 ? A 13.066 -25.561 0.086 1.000 1 A 47.357 1 ATOM 573 N N . ARG 75 150 ? A 16.093 -27.429 4.620 1.000 1 A 51.683 1 ATOM 574 C CA . ARG 75 150 ? A 16.723 -26.573 5.620 1.000 1 A 51.683 1 ATOM 575 C C . ARG 75 150 ? A 18.042 -26.007 5.104 1.000 1 A 51.683 1 ATOM 576 O O . ARG 75 150 ? A 19.026 -26.737 4.970 1.000 1 A 51.683 1 ATOM 577 C CB . ARG 75 150 ? A 16.958 -27.346 6.920 1.000 1 A 51.683 1 ATOM 578 C CG . ARG 75 150 ? A 15.897 -27.103 7.981 1.000 1 A 51.683 1 ATOM 579 C CD . ARG 75 150 ? A 16.461 -27.250 9.387 1.000 1 A 51.683 1 ATOM 580 N NE . ARG 75 150 ? A 15.713 -28.231 10.169 1.000 1 A 51.683 1 ATOM 581 C CZ . ARG 75 150 ? A 16.060 -28.661 11.378 1.000 1 A 51.683 1 ATOM 582 N NH1 . ARG 75 150 ? A 17.157 -28.204 11.971 1.000 1 A 51.683 1 ATOM 583 N NH2 . ARG 75 150 ? A 15.306 -29.556 12.000 1.000 1 A 51.683 1 ATOM 584 N N . LEU 76 151 ? A 18.098 -25.327 4.007 1.000 1 A 50.360 1 ATOM 585 C CA . LEU 76 151 ? A 19.288 -24.655 3.496 1.000 1 A 50.360 1 ATOM 586 C C . LEU 76 151 ? A 19.458 -23.284 4.142 1.000 1 A 50.360 1 ATOM 587 O O . LEU 76 151 ? A 18.728 -22.345 3.819 1.000 1 A 50.360 1 ATOM 588 C CB . LEU 76 151 ? A 19.209 -24.508 1.974 1.000 1 A 50.360 1 ATOM 589 C CG . LEU 76 151 ? A 19.139 -25.808 1.170 1.000 1 A 50.360 1 ATOM 590 C CD1 . LEU 76 151 ? A 18.902 -25.506 -0.306 1.000 1 A 50.360 1 ATOM 591 C CD2 . LEU 76 151 ? A 20.416 -26.621 1.357 1.000 1 A 50.360 1 ATOM 592 N N . SER 77 152 ? A 19.701 -23.165 5.395 1.000 1 A 53.509 1 ATOM 593 C CA . SER 77 152 ? A 20.664 -22.124 5.736 1.000 1 A 53.509 1 ATOM 594 C C . SER 77 152 ? A 20.816 -21.985 7.247 1.000 1 A 53.509 1 ATOM 595 O O . SER 77 152 ? A 21.343 -20.982 7.734 1.000 1 A 53.509 1 ATOM 596 C CB . SER 77 152 ? A 20.242 -20.783 5.133 1.000 1 A 53.509 1 ATOM 597 O OG . SER 77 152 ? A 19.015 -20.345 5.692 1.000 1 A 53.509 1 ATOM 598 N N . ARG 78 153 ? A 20.850 -23.128 7.909 1.000 1 A 46.831 1 ATOM 599 C CA . ARG 78 153 ? A 21.433 -22.645 9.157 1.000 1 A 46.831 1 ATOM 600 C C . ARG 78 153 ? A 22.845 -23.187 9.348 1.000 1 A 46.831 1 ATOM 601 O O . ARG 78 153 ? A 23.255 -23.484 10.472 1.000 1 A 46.831 1 ATOM 602 C CB . ARG 78 153 ? A 20.555 -23.037 10.347 1.000 1 A 46.831 1 ATOM 603 C CG . ARG 78 153 ? A 19.227 -22.300 10.403 1.000 1 A 46.831 1 ATOM 604 C CD . ARG 78 153 ? A 18.455 -22.622 11.675 1.000 1 A 46.831 1 ATOM 605 N NE . ARG 78 153 ? A 18.236 -21.430 12.489 1.000 1 A 46.831 1 ATOM 606 C CZ . ARG 78 153 ? A 17.807 -21.440 13.748 1.000 1 A 46.831 1 ATOM 607 N NH1 . ARG 78 153 ? A 17.541 -22.585 14.365 1.000 1 A 46.831 1 ATOM 608 N NH2 . ARG 78 153 ? A 17.641 -20.295 14.395 1.000 1 A 46.831 1 ATOM 609 N N . LYS 79 154 ? A 23.631 -23.242 8.307 1.000 1 A 53.725 1 ATOM 610 C CA . LYS 79 154 ? A 25.021 -23.628 8.529 1.000 1 A 53.725 1 ATOM 611 C C . LYS 79 154 ? A 25.905 -22.402 8.741 1.000 1 A 53.725 1 ATOM 612 O O . LYS 79 154 ? A 27.130 -22.488 8.633 1.000 1 A 53.725 1 ATOM 613 C CB . LYS 79 154 ? A 25.543 -24.454 7.353 1.000 1 A 53.725 1 ATOM 614 C CG . LYS 79 154 ? A 26.280 -25.720 7.764 1.000 1 A 53.725 1 ATOM 615 C CD . LYS 79 154 ? A 25.979 -26.874 6.817 1.000 1 A 53.725 1 ATOM 616 C CE . LYS 79 154 ? A 27.030 -27.971 6.918 1.000 1 A 53.725 1 ATOM 617 N NZ . LYS 79 154 ? A 26.719 -29.122 6.019 1.000 1 A 53.725 1 ATOM 618 N N . LYS 80 155 ? A 25.570 -21.455 9.550 1.000 1 A 57.369 1 ATOM 619 C CA . LYS 80 155 ? A 26.661 -20.792 10.258 1.000 1 A 57.369 1 ATOM 620 C C . LYS 80 155 ? A 26.252 -20.430 11.683 1.000 1 A 57.369 1 ATOM 621 O O . LYS 80 155 ? A 27.039 -19.845 12.431 1.000 1 A 57.369 1 ATOM 622 C CB . LYS 80 155 ? A 27.106 -19.537 9.506 1.000 1 A 57.369 1 ATOM 623 C CG . LYS 80 155 ? A 27.972 -19.820 8.287 1.000 1 A 57.369 1 ATOM 624 C CD . LYS 80 155 ? A 28.519 -18.535 7.679 1.000 1 A 57.369 1 ATOM 625 C CE . LYS 80 155 ? A 29.254 -18.802 6.373 1.000 1 A 57.369 1 ATOM 626 N NZ . LYS 80 155 ? A 29.839 -17.552 5.801 1.000 1 A 57.369 1 ATOM 627 N N . PHE 81 156 ? A 25.309 -21.066 12.202 1.000 1 A 48.094 1 ATOM 628 C CA . PHE 81 156 ? A 25.441 -21.045 13.654 1.000 1 A 48.094 1 ATOM 629 C C . PHE 81 156 ? A 25.194 -22.430 14.240 1.000 1 A 48.094 1 ATOM 630 O O . PHE 81 156 ? A 24.136 -23.024 14.020 1.000 1 A 48.094 1 ATOM 631 C CB . PHE 81 156 ? A 24.468 -20.034 14.269 1.000 1 A 48.094 1 ATOM 632 C CG . PHE 81 156 ? A 24.804 -18.601 13.957 1.000 1 A 48.094 1 ATOM 633 C CD1 . PHE 81 156 ? A 25.844 -17.956 14.617 1.000 1 A 48.094 1 ATOM 634 C CD2 . PHE 81 156 ? A 24.080 -17.897 13.003 1.000 1 A 48.094 1 ATOM 635 C CE1 . PHE 81 156 ? A 26.157 -16.630 14.330 1.000 1 A 48.094 1 ATOM 636 C CE2 . PHE 81 156 ? A 24.388 -16.572 12.711 1.000 1 A 48.094 1 ATOM 637 C CZ . PHE 81 156 ? A 25.426 -15.939 13.376 1.000 1 A 48.094 1 ATOM 638 N N . PRO 82 157 ? A 26.116 -23.191 14.447 1.000 1 A 45.565 1 ATOM 639 C CA . PRO 82 157 ? A 25.874 -24.471 15.118 1.000 1 A 45.565 1 ATOM 640 C C . PRO 82 157 ? A 24.922 -24.343 16.305 1.000 1 A 45.565 1 ATOM 641 O O . PRO 82 157 ? A 24.937 -23.329 17.007 1.000 1 A 45.565 1 ATOM 642 C CB . PRO 82 157 ? A 27.269 -24.897 15.579 1.000 1 A 45.565 1 ATOM 643 C CG . PRO 82 157 ? A 28.152 -23.738 15.247 1.000 1 A 45.565 1 ATOM 644 C CD . PRO 82 157 ? A 27.294 -22.613 14.745 1.000 1 A 45.565 1 ATOM 645 N N . PRO 83 158 ? A 23.750 -24.996 16.309 1.000 1 A 54.748 1 ATOM 646 C CA . PRO 83 158 ? A 22.857 -25.032 17.469 1.000 1 A 54.748 1 ATOM 647 C C . PRO 83 158 ? A 23.565 -25.481 18.745 1.000 1 A 54.748 1 ATOM 648 O O . PRO 83 158 ? A 24.352 -26.431 18.718 1.000 1 A 54.748 1 ATOM 649 C CB . PRO 83 158 ? A 21.784 -26.043 17.057 1.000 1 A 54.748 1 ATOM 650 C CG . PRO 83 158 ? A 22.246 -26.574 15.738 1.000 1 A 54.748 1 ATOM 651 C CD . PRO 83 158 ? A 23.656 -26.112 15.506 1.000 1 A 54.748 1 ATOM 652 N N . ARG 84 159 ? A 24.324 -24.652 19.433 1.000 1 A 47.400 1 ATOM 653 C CA . ARG 84 159 ? A 24.790 -24.906 20.793 1.000 1 A 47.400 1 ATOM 654 C C . ARG 84 159 ? A 23.773 -25.731 21.575 1.000 1 A 47.400 1 ATOM 655 O O . ARG 84 159 ? A 22.582 -25.414 21.581 1.000 1 A 47.400 1 ATOM 656 C CB . ARG 84 159 ? A 25.067 -23.589 21.521 1.000 1 A 47.400 1 ATOM 657 C CG . ARG 84 159 ? A 26.442 -23.005 21.236 1.000 1 A 47.400 1 ATOM 658 C CD . ARG 84 159 ? A 27.098 -22.465 22.499 1.000 1 A 47.400 1 ATOM 659 N NE . ARG 84 159 ? A 28.270 -21.650 22.191 1.000 1 A 47.400 1 ATOM 660 C CZ . ARG 84 159 ? A 28.629 -20.557 22.858 1.000 1 A 47.400 1 ATOM 661 N NH1 . ARG 84 159 ? A 27.910 -20.123 23.887 1.000 1 A 47.400 1 ATOM 662 N NH2 . ARG 84 159 ? A 29.715 -19.891 22.493 1.000 1 A 47.400 1 ATOM 663 N N . GLY 85 160 ? A 23.776 -26.961 21.460 1.000 1 A 43.521 1 ATOM 664 C CA . GLY 85 160 ? A 23.745 -28.015 22.462 1.000 1 A 43.521 1 ATOM 665 C C . GLY 85 160 ? A 22.338 -28.421 22.856 1.000 1 A 43.521 1 ATOM 666 O O . GLY 85 160 ? A 21.386 -27.665 22.649 1.000 1 A 43.521 1 ATOM 667 N N . PRO 86 161 ? A 22.119 -29.690 23.237 1.000 1 A 48.052 1 ATOM 668 C CA . PRO 86 161 ? A 20.905 -30.439 23.570 1.000 1 A 48.052 1 ATOM 669 C C . PRO 86 161 ? A 20.531 -30.329 25.047 1.000 1 A 48.052 1 ATOM 670 O O . PRO 86 161 ? A 21.407 -30.158 25.898 1.000 1 A 48.052 1 ATOM 671 C CB . PRO 86 161 ? A 21.269 -31.880 23.206 1.000 1 A 48.052 1 ATOM 672 C CG . PRO 86 161 ? A 22.754 -31.949 23.358 1.000 1 A 48.052 1 ATOM 673 C CD . PRO 86 161 ? A 23.270 -30.566 23.633 1.000 1 A 48.052 1 ATOM 674 N N . ASN 87 162 ? A 19.617 -29.441 25.564 1.000 1 A 37.774 1 ATOM 675 C CA . ASN 87 162 ? A 18.786 -29.844 26.694 1.000 1 A 37.774 1 ATOM 676 C C . ASN 87 162 ? A 19.154 -29.079 27.962 1.000 1 A 37.774 1 ATOM 677 O O . ASN 87 162 ? A 20.287 -29.166 28.438 1.000 1 A 37.774 1 ATOM 678 C CB . ASN 87 162 ? A 18.898 -31.351 26.931 1.000 1 A 37.774 1 ATOM 679 C CG . ASN 87 162 ? A 17.876 -31.863 27.928 1.000 1 A 37.774 1 ATOM 680 O OD1 . ASN 87 162 ? A 17.922 -31.521 29.112 1.000 1 A 37.774 1 ATOM 681 N ND2 . ASN 87 162 ? A 16.947 -32.685 27.455 1.000 1 A 37.774 1 ATOM 682 N N . LEU 88 163 ? A 18.794 -27.788 28.195 1.000 1 A 37.823 1 ATOM 683 C CA . LEU 88 163 ? A 18.655 -27.369 29.585 1.000 1 A 37.823 1 ATOM 684 C C . LEU 88 163 ? A 17.459 -26.438 29.755 1.000 1 A 37.823 1 ATOM 685 O O . LEU 88 163 ? A 17.333 -25.444 29.036 1.000 1 A 37.823 1 ATOM 686 C CB . LEU 88 163 ? A 19.931 -26.673 30.066 1.000 1 A 37.823 1 ATOM 687 C CG . LEU 88 163 ? A 20.868 -27.504 30.943 1.000 1 A 37.823 1 ATOM 688 C CD1 . LEU 88 163 ? A 22.062 -27.993 30.130 1.000 1 A 37.823 1 ATOM 689 C CD2 . LEU 88 163 ? A 21.331 -26.693 32.149 1.000 1 A 37.823 1 ATOM 690 N N . GLU 89 164 ? A 16.273 -26.878 29.884 1.000 1 A 38.008 1 ATOM 691 C CA . GLU 89 164 ? A 15.641 -26.523 31.151 1.000 1 A 38.008 1 ATOM 692 C C . GLU 89 164 ? A 16.126 -25.164 31.648 1.000 1 A 38.008 1 ATOM 693 O O . GLU 89 164 ? A 17.274 -25.026 32.075 1.000 1 A 38.008 1 ATOM 694 C CB . GLU 89 164 ? A 15.914 -27.596 32.208 1.000 1 A 38.008 1 ATOM 695 C CG . GLU 89 164 ? A 14.653 -28.195 32.815 1.000 1 A 38.008 1 ATOM 696 C CD . GLU 89 164 ? A 14.361 -29.604 32.323 1.000 1 A 38.008 1 ATOM 697 O OE1 . GLU 89 164 ? A 13.251 -30.120 32.584 1.000 1 A 38.008 1 ATOM 698 O OE2 . GLU 89 164 ? A 15.251 -30.197 31.673 1.000 1 A 38.008 1 ATOM 699 N N . SER 90 165 ? A 15.933 -24.075 30.891 1.000 1 A 44.219 1 ATOM 700 C CA . SER 90 165 ? A 16.050 -22.725 31.433 1.000 1 A 44.219 1 ATOM 701 C C . SER 90 165 ? A 14.694 -22.189 31.880 1.000 1 A 44.219 1 ATOM 702 O O . SER 90 165 ? A 13.714 -22.269 31.137 1.000 1 A 44.219 1 ATOM 703 C CB . SER 90 165 ? A 16.664 -21.782 30.396 1.000 1 A 44.219 1 ATOM 704 O OG . SER 90 165 ? A 17.413 -22.509 29.437 1.000 1 A 44.219 1 ATOM 705 N N . HIS 91 166 ? A 14.135 -22.646 32.982 1.000 1 A 38.521 1 ATOM 706 C CA . HIS 91 166 ? A 13.658 -21.846 34.105 1.000 1 A 38.521 1 ATOM 707 C C . HIS 91 166 ? A 13.269 -20.442 33.656 1.000 1 A 38.521 1 ATOM 708 O O . HIS 91 166 ? A 14.132 -19.578 33.489 1.000 1 A 38.521 1 ATOM 709 C CB . HIS 91 166 ? A 14.724 -21.771 35.200 1.000 1 A 38.521 1 ATOM 710 C CG . HIS 91 166 ? A 14.946 -23.067 35.912 1.000 1 A 38.521 1 ATOM 711 N ND1 . HIS 91 166 ? A 13.935 -23.743 36.560 1.000 1 A 38.521 1 ATOM 712 C CD2 . HIS 91 166 ? A 16.065 -23.813 36.072 1.000 1 A 38.521 1 ATOM 713 C CE1 . HIS 91 166 ? A 14.425 -24.851 37.092 1.000 1 A 38.521 1 ATOM 714 N NE2 . HIS 91 166 ? A 15.715 -24.917 36.810 1.000 1 A 38.521 1 ATOM 715 N N . SER 92 167 ? A 12.356 -20.178 32.761 1.000 1 A 40.123 1 ATOM 716 C CA . SER 92 167 ? A 11.540 -18.999 33.032 1.000 1 A 40.123 1 ATOM 717 C C . SER 92 167 ? A 10.203 -19.384 33.657 1.000 1 A 40.123 1 ATOM 718 O O . SER 92 167 ? A 9.395 -20.074 33.032 1.000 1 A 40.123 1 ATOM 719 C CB . SER 92 167 ? A 11.301 -18.205 31.747 1.000 1 A 40.123 1 ATOM 720 O OG . SER 92 167 ? A 10.369 -18.869 30.911 1.000 1 A 40.123 1 ATOM 721 N N . HIS 93 168 ? A 10.131 -20.013 34.825 1.000 1 A 36.840 1 ATOM 722 C CA . HIS 93 168 ? A 9.346 -19.767 36.029 1.000 1 A 36.840 1 ATOM 723 C C . HIS 93 168 ? A 8.859 -18.323 36.085 1.000 1 A 36.840 1 ATOM 724 O O . HIS 93 168 ? A 9.638 -17.412 36.373 1.000 1 A 36.840 1 ATOM 725 C CB . HIS 93 168 ? A 10.166 -20.093 37.279 1.000 1 A 36.840 1 ATOM 726 C CG . HIS 93 168 ? A 10.394 -21.558 37.482 1.000 1 A 36.840 1 ATOM 727 N ND1 . HIS 93 168 ? A 9.372 -22.482 37.442 1.000 1 A 36.840 1 ATOM 728 C CD2 . HIS 93 168 ? A 11.528 -22.256 37.724 1.000 1 A 36.840 1 ATOM 729 C CE1 . HIS 93 168 ? A 9.870 -23.689 37.652 1.000 1 A 36.840 1 ATOM 730 N NE2 . HIS 93 168 ? A 11.176 -23.579 37.826 1.000 1 A 36.840 1 ATOM 731 N N . ARG 94 169 ? A 7.990 -17.867 35.313 1.000 1 A 39.048 1 ATOM 732 C CA . ARG 94 169 ? A 7.065 -16.931 35.942 1.000 1 A 39.048 1 ATOM 733 C C . ARG 94 169 ? A 5.618 -17.358 35.720 1.000 1 A 39.048 1 ATOM 734 O O . ARG 94 169 ? A 5.176 -17.503 34.578 1.000 1 A 39.048 1 ATOM 735 C CB . ARG 94 169 ? A 7.282 -15.515 35.402 1.000 1 A 39.048 1 ATOM 736 C CG . ARG 94 169 ? A 6.607 -14.431 36.227 1.000 1 A 39.048 1 ATOM 737 C CD . ARG 94 169 ? A 6.606 -13.091 35.504 1.000 1 A 39.048 1 ATOM 738 N NE . ARG 94 169 ? A 5.918 -12.062 36.278 1.000 1 A 39.048 1 ATOM 739 C CZ . ARG 94 169 ? A 5.866 -10.774 35.949 1.000 1 A 39.048 1 ATOM 740 N NH1 . ARG 94 169 ? A 6.463 -10.331 34.849 1.000 1 A 39.048 1 ATOM 741 N NH2 . ARG 94 169 ? A 5.213 -9.923 36.726 1.000 1 A 39.048 1 ATOM 742 N N . ARG 95 170 ? A 5.189 -18.528 36.112 1.000 1 A 36.599 1 ATOM 743 C CA . ARG 95 170 ? A 4.119 -18.761 37.076 1.000 1 A 36.599 1 ATOM 744 C C . ARG 95 170 ? A 2.750 -18.577 36.430 1.000 1 A 36.599 1 ATOM 745 O O . ARG 95 170 ? A 2.485 -17.546 35.808 1.000 1 A 36.599 1 ATOM 746 C CB . ARG 95 170 ? A 4.263 -17.824 38.277 1.000 1 A 36.599 1 ATOM 747 C CG . ARG 95 170 ? A 4.898 -18.475 39.495 1.000 1 A 36.599 1 ATOM 748 C CD . ARG 95 170 ? A 4.817 -17.577 40.722 1.000 1 A 36.599 1 ATOM 749 N NE . ARG 95 170 ? A 5.056 -18.324 41.953 1.000 1 A 36.599 1 ATOM 750 C CZ . ARG 95 170 ? A 6.076 -18.115 42.780 1.000 1 A 36.599 1 ATOM 751 N NH1 . ARG 95 170 ? A 6.976 -17.173 42.523 1.000 1 A 36.599 1 ATOM 752 N NH2 . ARG 95 170 ? A 6.198 -18.853 43.874 1.000 1 A 36.599 1 ATOM 753 N N . GLU 96 171 ? A 2.258 -19.454 35.684 1.000 1 A 36.068 1 ATOM 754 C CA . GLU 96 171 ? A 0.998 -19.961 36.220 1.000 1 A 36.068 1 ATOM 755 C C . GLU 96 171 ? A 0.152 -18.833 36.802 1.000 1 A 36.068 1 ATOM 756 O O . GLU 96 171 ? A 0.478 -18.285 37.857 1.000 1 A 36.068 1 ATOM 757 C CB . GLU 96 171 ? A 1.258 -21.027 37.288 1.000 1 A 36.068 1 ATOM 758 C CG . GLU 96 171 ? A 1.514 -22.416 36.721 1.000 1 A 36.068 1 ATOM 759 C CD . GLU 96 171 ? A 1.192 -23.533 37.700 1.000 1 A 36.068 1 ATOM 760 O OE1 . GLU 96 171 ? A 1.234 -24.720 37.303 1.000 1 A 36.068 1 ATOM 761 O OE2 . GLU 96 171 ? A 0.894 -23.219 38.874 1.000 1 A 36.068 1 ATOM 762 N N . LEU 97 172 ? A -0.058 -17.766 36.115 1.000 1 A 43.067 1 ATOM 763 C CA . LEU 97 172 ? A -1.351 -17.226 36.522 1.000 1 A 43.067 1 ATOM 764 C C . LEU 97 172 ? A -2.490 -18.107 36.023 1.000 1 A 43.067 1 ATOM 765 O O . LEU 97 172 ? A -2.752 -18.169 34.819 1.000 1 A 43.067 1 ATOM 766 C CB . LEU 97 172 ? A -1.525 -15.799 35.995 1.000 1 A 43.067 1 ATOM 767 C CG . LEU 97 172 ? A -1.201 -14.670 36.975 1.000 1 A 43.067 1 ATOM 768 C CD1 . LEU 97 172 ? A -0.356 -13.601 36.291 1.000 1 A 43.067 1 ATOM 769 C CD2 . LEU 97 172 ? A -2.483 -14.066 37.538 1.000 1 A 43.067 1 ATOM 770 N N . PHE 98 173 ? A -2.360 -19.381 36.216 1.000 1 A 36.751 1 ATOM 771 C CA . PHE 98 173 ? A -3.554 -20.043 36.730 1.000 1 A 36.751 1 ATOM 772 C C . PHE 98 173 ? A -4.251 -19.172 37.767 1.000 1 A 36.751 1 ATOM 773 O O . PHE 98 173 ? A -3.791 -19.063 38.906 1.000 1 A 36.751 1 ATOM 774 C CB . PHE 98 173 ? A -3.196 -21.402 37.340 1.000 1 A 36.751 1 ATOM 775 C CG . PHE 98 173 ? A -3.061 -22.506 36.326 1.000 1 A 36.751 1 ATOM 776 C CD1 . PHE 98 173 ? A -4.181 -23.184 35.863 1.000 1 A 36.751 1 ATOM 777 C CD2 . PHE 98 173 ? A -1.812 -22.866 35.837 1.000 1 A 36.751 1 ATOM 778 C CE1 . PHE 98 173 ? A -4.059 -24.206 34.924 1.000 1 A 36.751 1 ATOM 779 C CE2 . PHE 98 173 ? A -1.682 -23.886 34.899 1.000 1 A 36.751 1 ATOM 780 C CZ . PHE 98 173 ? A -2.806 -24.556 34.445 1.000 1 A 36.751 1 ATOM 781 N N . LEU 99 174 ? A -4.446 -17.894 37.491 1.000 1 A 38.021 1 ATOM 782 C CA . LEU 99 174 ? A -5.508 -17.214 38.224 1.000 1 A 38.021 1 ATOM 783 C C . LEU 99 174 ? A -6.854 -17.889 37.981 1.000 1 A 38.021 1 ATOM 784 O O . LEU 99 174 ? A -7.254 -18.091 36.832 1.000 1 A 38.021 1 ATOM 785 C CB . LEU 99 174 ? A -5.582 -15.741 37.815 1.000 1 A 38.021 1 ATOM 786 C CG . LEU 99 174 ? A -5.009 -14.731 38.811 1.000 1 A 38.021 1 ATOM 787 C CD1 . LEU 99 174 ? A -4.255 -13.629 38.074 1.000 1 A 38.021 1 ATOM 788 C CD2 . LEU 99 174 ? A -6.120 -14.141 39.673 1.000 1 A 38.021 1 ATOM 789 N N . GLN 100 175 ? A -7.009 -19.078 38.433 1.000 1 A 31.709 1 ATOM 790 C CA . GLN 100 175 ? A -8.097 -19.406 39.348 1.000 1 A 31.709 1 ATOM 791 C C . GLN 100 175 ? A -9.453 -19.073 38.732 1.000 1 A 31.709 1 ATOM 792 O O . GLN 100 175 ? A -9.712 -17.923 38.372 1.000 1 A 31.709 1 ATOM 793 C CB . GLN 100 175 ? A -7.927 -18.663 40.674 1.000 1 A 31.709 1 ATOM 794 C CG . GLN 100 175 ? A -8.204 -19.523 41.900 1.000 1 A 31.709 1 ATOM 795 C CD . GLN 100 175 ? A -8.424 -18.700 43.156 1.000 1 A 31.709 1 ATOM 796 O OE1 . GLN 100 175 ? A -9.445 -18.020 43.298 1.000 1 A 31.709 1 ATOM 797 N NE2 . GLN 100 175 ? A -7.467 -18.755 44.076 1.000 1 A 31.709 1 ATOM 798 N N . GLU 101 176 ? A -9.857 -19.742 37.775 1.000 1 A 30.364 1 ATOM 799 C CA . GLU 101 176 ? A -11.251 -20.177 37.758 1.000 1 A 30.364 1 ATOM 800 C C . GLU 101 176 ? A -12.007 -19.652 38.975 1.000 1 A 30.364 1 ATOM 801 O O . GLU 101 176 ? A -11.615 -19.909 40.115 1.000 1 A 30.364 1 ATOM 802 C CB . GLU 101 176 ? A -11.337 -21.704 37.704 1.000 1 A 30.364 1 ATOM 803 C CG . GLU 101 176 ? A -12.753 -22.235 37.540 1.000 1 A 30.364 1 ATOM 804 C CD . GLU 101 176 ? A -12.941 -23.631 38.112 1.000 1 A 30.364 1 ATOM 805 O OE1 . GLU 101 176 ? A -14.102 -24.076 38.259 1.000 1 A 30.364 1 ATOM 806 O OE2 . GLU 101 176 ? A -11.919 -24.285 38.417 1.000 1 A 30.364 1 ATOM 807 N N . PRO 102 177 ? A -12.675 -18.390 39.147 1.000 1 A 36.927 1 ATOM 808 C CA . PRO 102 177 ? A -13.731 -18.315 40.159 1.000 1 A 36.927 1 ATOM 809 C C . PRO 102 177 ? A -14.926 -19.208 39.831 1.000 1 A 36.927 1 ATOM 810 O O . PRO 102 177 ? A -15.190 -19.487 38.659 1.000 1 A 36.927 1 ATOM 811 C CB . PRO 102 177 ? A -14.132 -16.838 40.141 1.000 1 A 36.927 1 ATOM 812 C CG . PRO 102 177 ? A -13.767 -16.360 38.773 1.000 1 A 36.927 1 ATOM 813 C CD . PRO 102 177 ? A -12.921 -17.409 38.111 1.000 1 A 36.927 1 ATOM 814 N N . PRO 103 178 ? A -15.254 -20.207 40.651 1.000 1 A 32.653 1 ATOM 815 C CA . PRO 103 178 ? A -16.365 -21.148 40.817 1.000 1 A 32.653 1 ATOM 816 C C . PRO 103 178 ? A -17.715 -20.538 40.448 1.000 1 A 32.653 1 ATOM 817 O O . PRO 103 178 ? A -17.910 -19.328 40.593 1.000 1 A 32.653 1 ATOM 818 C CB . PRO 103 178 ? A -16.312 -21.496 42.306 1.000 1 A 32.653 1 ATOM 819 C CG . PRO 103 178 ? A -15.823 -20.251 42.973 1.000 1 A 32.653 1 ATOM 820 C CD . PRO 103 178 ? A -15.404 -19.275 41.911 1.000 1 A 32.653 1 ATOM 821 N N . ALA 104 179 ? A -18.254 -20.796 39.328 1.000 1 A 32.422 1 ATOM 822 C CA . ALA 104 179 ? A -19.652 -21.213 39.264 1.000 1 A 32.422 1 ATOM 823 C C . ALA 104 179 ? A -20.541 -20.279 40.080 1.000 1 A 32.422 1 ATOM 824 O O . ALA 104 179 ? A -20.293 -20.056 41.268 1.000 1 A 32.422 1 ATOM 825 C CB . ALA 104 179 ? A -19.803 -22.650 39.757 1.000 1 A 32.422 1 ATOM 826 N N . PRO 105 180 ? A -21.345 -19.423 39.442 1.000 1 A 40.461 1 ATOM 827 C CA . PRO 105 180 ? A -22.755 -19.746 39.678 1.000 1 A 40.461 1 ATOM 828 C C . PRO 105 180 ? A -23.515 -20.045 38.388 1.000 1 A 40.461 1 ATOM 829 O O . PRO 105 180 ? A -23.127 -19.576 37.315 1.000 1 A 40.461 1 ATOM 830 C CB . PRO 105 180 ? A -23.298 -18.483 40.352 1.000 1 A 40.461 1 ATOM 831 C CG . PRO 105 180 ? A -22.555 -17.357 39.709 1.000 1 A 40.461 1 ATOM 832 C CD . PRO 105 180 ? A -21.506 -17.934 38.801 1.000 1 A 40.461 1 ATOM 833 N N . ASP 106 181 ? A -23.664 -21.306 38.054 1.000 1 A 31.989 1 ATOM 834 C CA . ASP 106 181 ? A -24.954 -21.958 37.849 1.000 1 A 31.989 1 ATOM 835 C C . ASP 106 181 ? A -26.075 -20.930 37.714 1.000 1 A 31.989 1 ATOM 836 O O . ASP 106 181 ? A -26.367 -20.195 38.660 1.000 1 A 31.989 1 ATOM 837 C CB . ASP 106 181 ? A -25.257 -22.920 38.999 1.000 1 A 31.989 1 ATOM 838 C CG . ASP 106 181 ? A -25.702 -24.292 38.524 1.000 1 A 31.989 1 ATOM 839 O OD1 . ASP 106 181 ? A -25.689 -24.548 37.300 1.000 1 A 31.989 1 ATOM 840 O OD2 . ASP 106 181 ? A -26.071 -25.125 39.380 1.000 1 A 31.989 1 ATOM 841 N N . VAL 107 182 ? A -26.343 -20.252 36.631 1.000 1 A 39.043 1 ATOM 842 C CA . VAL 107 182 ? A -27.738 -19.963 36.313 1.000 1 A 39.043 1 ATOM 843 C C . VAL 107 182 ? A -27.925 -19.920 34.799 1.000 1 A 39.043 1 ATOM 844 O O . VAL 107 182 ? A -27.210 -19.199 34.099 1.000 1 A 39.043 1 ATOM 845 C CB . VAL 107 182 ? A -28.199 -18.630 36.946 1.000 1 A 39.043 1 ATOM 846 C CG1 . VAL 107 182 ? A -29.600 -18.260 36.462 1.000 1 A 39.043 1 ATOM 847 C CG2 . VAL 107 182 ? A -28.164 -18.723 38.470 1.000 1 A 39.043 1 ATOM 848 N N . LEU 108 183 ? A -27.891 -20.974 33.994 1.000 1 A 35.000 1 ATOM 849 C CA . LEU 108 183 ? A -28.974 -21.308 33.075 1.000 1 A 35.000 1 ATOM 850 C C . LEU 108 183 ? A -29.884 -20.106 32.848 1.000 1 A 35.000 1 ATOM 851 O O . LEU 108 183 ? A -30.597 -19.680 33.759 1.000 1 A 35.000 1 ATOM 852 C CB . LEU 108 183 ? A -29.790 -22.486 33.614 1.000 1 A 35.000 1 ATOM 853 C CG . LEU 108 183 ? A -29.106 -23.853 33.589 1.000 1 A 35.000 1 ATOM 854 C CD1 . LEU 108 183 ? A -30.008 -24.909 34.219 1.000 1 A 35.000 1 ATOM 855 C CD2 . LEU 108 183 ? A -28.738 -24.241 32.161 1.000 1 A 35.000 1 ATOM 856 N N . GLN 109 184 ? A -29.633 -19.131 31.986 1.000 1 A 32.403 1 ATOM 857 C CA . GLN 109 184 ? A -30.742 -18.498 31.280 1.000 1 A 32.403 1 ATOM 858 C C . GLN 109 184 ? A -30.339 -18.111 29.859 1.000 1 A 32.403 1 ATOM 859 O O . GLN 109 184 ? A -29.313 -17.458 29.655 1.000 1 A 32.403 1 ATOM 860 C CB . GLN 109 184 ? A -31.230 -17.265 32.041 1.000 1 A 32.403 1 ATOM 861 C CG . GLN 109 184 ? A -32.432 -17.533 32.938 1.000 1 A 32.403 1 ATOM 862 C CD . GLN 109 184 ? A -33.014 -16.264 33.533 1.000 1 A 32.403 1 ATOM 863 O OE1 . GLN 109 184 ? A -32.572 -15.155 33.217 1.000 1 A 32.403 1 ATOM 864 N NE2 . GLN 109 184 ? A -34.009 -16.418 34.400 1.000 1 A 32.403 1 ATOM 865 N N . ALA 110 185 ? A -30.298 -19.000 28.823 1.000 1 A 33.174 1 ATOM 866 C CA . ALA 110 185 ? A -31.159 -18.997 27.643 1.000 1 A 33.174 1 ATOM 867 C C . ALA 110 185 ? A -31.112 -17.647 26.933 1.000 1 A 33.174 1 ATOM 868 O O . ALA 110 185 ? A -31.259 -16.600 27.568 1.000 1 A 33.174 1 ATOM 869 C CB . ALA 110 185 ? A -32.595 -19.341 28.031 1.000 1 A 33.174 1 ATOM 870 N N . ALA 111 186 ? A -30.197 -17.417 25.995 1.000 1 A 35.033 1 ATOM 871 C CA . ALA 111 186 ? A -30.431 -17.059 24.599 1.000 1 A 35.033 1 ATOM 872 C C . ALA 111 186 ? A -31.850 -16.537 24.397 1.000 1 A 35.033 1 ATOM 873 O O . ALA 111 186 ? A -32.816 -17.300 24.475 1.000 1 A 35.033 1 ATOM 874 C CB . ALA 111 186 ? A -30.174 -18.260 23.691 1.000 1 A 35.033 1 ATOM 875 N N . GLY 112 187 ? A -32.263 -15.352 24.767 1.000 1 A 28.940 1 ATOM 876 C CA . GLY 112 187 ? A -33.373 -14.609 24.190 1.000 1 A 28.940 1 ATOM 877 C C . GLY 112 187 ? A -33.189 -13.105 24.269 1.000 1 A 28.940 1 ATOM 878 O O . GLY 112 187 ? A -32.797 -12.576 25.311 1.000 1 A 28.940 1 ATOM 879 N N . GLU 113 188 ? A -32.584 -12.461 23.306 1.000 1 A 29.320 1 ATOM 880 C CA . GLU 113 188 ? A -33.275 -11.348 22.661 1.000 1 A 29.320 1 ATOM 881 C C . GLU 113 188 ? A -32.967 -10.027 23.360 1.000 1 A 29.320 1 ATOM 882 O O . GLU 113 188 ? A -33.309 -9.844 24.531 1.000 1 A 29.320 1 ATOM 883 C CB . GLU 113 188 ? A -34.786 -11.593 22.641 1.000 1 A 29.320 1 ATOM 884 C CG . GLU 113 188 ? A -35.505 -10.907 21.488 1.000 1 A 29.320 1 ATOM 885 C CD . GLU 113 188 ? A -36.964 -11.316 21.362 1.000 1 A 29.320 1 ATOM 886 O OE1 . GLU 113 188 ? A -37.639 -10.872 20.406 1.000 1 A 29.320 1 ATOM 887 O OE2 . GLU 113 188 ? A -37.437 -12.086 22.228 1.000 1 A 29.320 1 ATOM 888 N N . TRP 114 189 ? A -31.699 -9.502 23.288 1.000 1 A 35.594 1 ATOM 889 C CA . TRP 114 189 ? A -31.397 -8.168 23.796 1.000 1 A 35.594 1 ATOM 890 C C . TRP 114 189 ? A -31.907 -7.094 22.842 1.000 1 A 35.594 1 ATOM 891 O O . TRP 114 189 ? A -31.481 -7.027 21.686 1.000 1 A 35.594 1 ATOM 892 C CB . TRP 114 189 ? A -29.889 -8.004 24.011 1.000 1 A 35.594 1 ATOM 893 C CG . TRP 114 189 ? A -29.335 -8.854 25.114 1.000 1 A 35.594 1 ATOM 894 C CD1 . TRP 114 189 ? A -28.702 -10.059 24.988 1.000 1 A 35.594 1 ATOM 895 C CD2 . TRP 114 189 ? A -29.370 -8.564 26.515 1.000 1 A 35.594 1 ATOM 896 N NE1 . TRP 114 189 ? A -28.340 -10.536 26.226 1.000 1 A 35.594 1 ATOM 897 C CE2 . TRP 114 189 ? A -28.738 -9.638 27.180 1.000 1 A 35.594 1 ATOM 898 C CE3 . TRP 114 189 ? A -29.873 -7.498 27.273 1.000 1 A 35.594 1 ATOM 899 C CZ2 . TRP 114 189 ? A -28.596 -9.676 28.569 1.000 1 A 35.594 1 ATOM 900 C CZ3 . TRP 114 189 ? A -29.731 -7.538 28.656 1.000 1 A 35.594 1 ATOM 901 C CH2 . TRP 114 189 ? A -29.097 -8.621 29.287 1.000 1 A 35.594 1 ATOM 902 N N . GLU 115 190 ? A -33.306 -6.911 22.465 1.000 1 A 32.597 1 ATOM 903 C CA . GLU 115 190 ? A -34.093 -5.699 22.260 1.000 1 A 32.597 1 ATOM 904 C C . GLU 115 190 ? A -33.611 -4.568 23.165 1.000 1 A 32.597 1 ATOM 905 O O . GLU 115 190 ? A -33.462 -4.755 24.374 1.000 1 A 32.597 1 ATOM 906 C CB . GLU 115 190 ? A -35.578 -5.973 22.508 1.000 1 A 32.597 1 ATOM 907 C CG . GLU 115 190 ? A -36.497 -5.391 21.443 1.000 1 A 32.597 1 ATOM 908 C CD . GLU 115 190 ? A -36.903 -3.953 21.723 1.000 1 A 32.597 1 ATOM 909 O OE1 . GLU 115 190 ? A -37.427 -3.281 20.806 1.000 1 A 32.597 1 ATOM 910 O OE2 . GLU 115 190 ? A -36.695 -3.494 22.868 1.000 1 A 32.597 1 ATOM 911 N N . PRO 116 191 ? A -33.241 -3.351 22.606 1.000 1 A 43.604 1 ATOM 912 C CA . PRO 116 191 ? A -32.731 -2.093 23.156 1.000 1 A 43.604 1 ATOM 913 C C . PRO 116 191 ? A -33.827 -1.239 23.789 1.000 1 A 43.604 1 ATOM 914 O O . PRO 116 191 ? A -34.912 -1.098 23.219 1.000 1 A 43.604 1 ATOM 915 C CB . PRO 116 191 ? A -32.128 -1.393 21.936 1.000 1 A 43.604 1 ATOM 916 C CG . PRO 116 191 ? A -32.739 -2.083 20.759 1.000 1 A 43.604 1 ATOM 917 C CD . PRO 116 191 ? A -33.828 -2.993 21.252 1.000 1 A 43.604 1 ATOM 918 N N . ALA 117 192 ? A -33.933 -1.231 25.076 1.000 1 A 36.301 1 ATOM 919 C CA . ALA 117 192 ? A -34.761 -0.267 25.797 1.000 1 A 36.301 1 ATOM 920 C C . ALA 117 192 ? A -34.005 0.328 26.982 1.000 1 A 36.301 1 ATOM 921 O O . ALA 117 192 ? A -33.356 -0.397 27.739 1.000 1 A 36.301 1 ATOM 922 C CB . ALA 117 192 ? A -36.054 -0.926 26.272 1.000 1 A 36.301 1 ATOM 923 N N . ALA 118 193 ? A -33.479 1.629 26.888 1.000 1 A 32.691 1 ATOM 924 C CA . ALA 118 193 ? A -33.945 2.770 27.671 1.000 1 A 32.691 1 ATOM 925 C C . ALA 118 193 ? A -33.111 2.943 28.937 1.000 1 A 32.691 1 ATOM 926 O O . ALA 118 193 ? A -32.996 2.018 29.744 1.000 1 A 32.691 1 ATOM 927 C CB . ALA 118 193 ? A -35.421 2.603 28.028 1.000 1 A 32.691 1 ATOM 928 N N . GLN 119 194 ? A -32.073 3.800 28.903 1.000 1 A 32.183 1 ATOM 929 C CA . GLN 119 194 ? A -31.792 5.002 29.682 1.000 1 A 32.183 1 ATOM 930 C C . GLN 119 194 ? A -31.388 4.650 31.111 1.000 1 A 32.183 1 ATOM 931 O O . GLN 119 194 ? A -31.969 3.752 31.722 1.000 1 A 32.183 1 ATOM 932 C CB . GLN 119 194 ? A -33.006 5.931 29.693 1.000 1 A 32.183 1 ATOM 933 C CG . GLN 119 194 ? A -32.918 7.072 28.689 1.000 1 A 32.183 1 ATOM 934 C CD . GLN 119 194 ? A -32.832 8.434 29.353 1.000 1 A 32.183 1 ATOM 935 O OE1 . GLN 119 194 ? A -33.476 8.681 30.377 1.000 1 A 32.183 1 ATOM 936 N NE2 . GLN 119 194 ? A -32.037 9.327 28.774 1.000 1 A 32.183 1 ATOM 937 N N . PRO 120 195 ? A -30.717 5.588 31.937 1.000 1 A 47.430 1 ATOM 938 C CA . PRO 120 195 ? A -29.451 6.072 32.493 1.000 1 A 47.430 1 ATOM 939 C C . PRO 120 195 ? A -29.305 5.766 33.982 1.000 1 A 47.430 1 ATOM 940 O O . PRO 120 195 ? A -30.226 5.222 34.597 1.000 1 A 47.430 1 ATOM 941 C CB . PRO 120 195 ? A -29.513 7.582 32.250 1.000 1 A 47.430 1 ATOM 942 C CG . PRO 120 195 ? A -30.957 7.935 32.406 1.000 1 A 47.430 1 ATOM 943 C CD . PRO 120 195 ? A -31.741 6.667 32.592 1.000 1 A 47.430 1 ATOM 944 N N . PRO 121 196 ? A -28.121 6.255 34.775 1.000 1 A 41.684 1 ATOM 945 C CA . PRO 121 196 ? A -27.292 7.452 34.941 1.000 1 A 41.684 1 ATOM 946 C C . PRO 121 196 ? A -25.926 7.143 35.550 1.000 1 A 41.684 1 ATOM 947 O O . PRO 121 196 ? A -25.707 6.040 36.057 1.000 1 A 41.684 1 ATOM 948 C CB . PRO 121 196 ? A -28.123 8.330 35.879 1.000 1 A 41.684 1 ATOM 949 C CG . PRO 121 196 ? A -28.810 7.368 36.794 1.000 1 A 41.684 1 ATOM 950 C CD . PRO 121 196 ? A -28.514 5.972 36.327 1.000 1 A 41.684 1 ATOM 951 N N . GLU 122 197 ? A -24.894 7.629 35.086 1.000 1 A 29.625 1 ATOM 952 C CA . GLU 122 197 ? A -24.006 8.561 35.774 1.000 1 A 29.625 1 ATOM 953 C C . GLU 122 197 ? A -23.485 7.965 37.078 1.000 1 A 29.625 1 ATOM 954 O O . GLU 122 197 ? A -24.269 7.594 37.954 1.000 1 A 29.625 1 ATOM 955 C CB . GLU 122 197 ? A -24.724 9.884 36.049 1.000 1 A 29.625 1 ATOM 956 C CG . GLU 122 197 ? A -24.559 10.915 34.942 1.000 1 A 29.625 1 ATOM 957 C CD . GLU 122 197 ? A -24.890 12.331 35.387 1.000 1 A 29.625 1 ATOM 958 O OE1 . GLU 122 197 ? A -24.399 13.296 34.758 1.000 1 A 29.625 1 ATOM 959 O OE2 . GLU 122 197 ? A -25.647 12.477 36.373 1.000 1 A 29.625 1 ATOM 960 N N . GLU 123 198 ? A -22.282 7.277 37.098 1.000 1 A 40.405 1 ATOM 961 C CA . GLU 123 198 ? A -21.441 7.239 38.291 1.000 1 A 40.405 1 ATOM 962 C C . GLU 123 198 ? A -20.018 6.806 37.949 1.000 1 A 40.405 1 ATOM 963 O O . GLU 123 198 ? A -19.813 5.760 37.330 1.000 1 A 40.405 1 ATOM 964 C CB . GLU 123 198 ? A -22.039 6.299 39.340 1.000 1 A 40.405 1 ATOM 965 C CG . GLU 123 198 ? A -21.426 6.453 40.725 1.000 1 A 40.405 1 ATOM 966 C CD . GLU 123 198 ? A -22.003 5.488 41.748 1.000 1 A 40.405 1 ATOM 967 O OE1 . GLU 123 198 ? A -21.253 5.026 42.638 1.000 1 A 40.405 1 ATOM 968 O OE2 . GLU 123 198 ? A -23.215 5.189 41.658 1.000 1 A 40.405 1 ATOM 969 N N . GLU 124 199 ? A -19.117 7.717 37.613 1.000 1 A 31.524 1 ATOM 970 C CA . GLU 124 199 ? A -17.856 8.173 38.189 1.000 1 A 31.524 1 ATOM 971 C C . GLU 124 199 ? A -17.215 7.086 39.047 1.000 1 A 31.524 1 ATOM 972 O O . GLU 124 199 ? A -17.834 6.585 39.988 1.000 1 A 31.524 1 ATOM 973 C CB . GLU 124 199 ? A -18.071 9.440 39.021 1.000 1 A 31.524 1 ATOM 974 C CG . GLU 124 199 ? A -17.937 10.729 38.224 1.000 1 A 31.524 1 ATOM 975 C CD . GLU 124 199 ? A -17.376 11.883 39.039 1.000 1 A 31.524 1 ATOM 976 O OE1 . GLU 124 199 ? A -16.887 12.869 38.441 1.000 1 A 31.524 1 ATOM 977 O OE2 . GLU 124 199 ? A -17.425 11.801 40.287 1.000 1 A 31.524 1 ATOM 978 N N . ALA 125 200 ? A -16.307 6.234 38.580 1.000 1 A 41.194 1 ATOM 979 C CA . ALA 125 200 ? A -15.221 5.754 39.431 1.000 1 A 41.194 1 ATOM 980 C C . ALA 125 200 ? A -14.264 4.861 38.646 1.000 1 A 41.194 1 ATOM 981 O O . ALA 125 200 ? A -14.696 3.954 37.931 1.000 1 A 41.194 1 ATOM 982 C CB . ALA 125 200 ? A -15.781 4.999 40.634 1.000 1 A 41.194 1 ATOM 983 N N . ASP 126 201 ? A -13.326 5.413 37.965 1.000 1 A 33.916 1 ATOM 984 C CA . ASP 126 201 ? A -11.897 5.179 38.153 1.000 1 A 33.916 1 ATOM 985 C C . ASP 126 201 ? A -11.562 3.695 38.021 1.000 1 A 33.916 1 ATOM 986 O O . ASP 126 201 ? A -11.835 2.909 38.930 1.000 1 A 33.916 1 ATOM 987 C CB . ASP 126 201 ? A -11.443 5.703 39.517 1.000 1 A 33.916 1 ATOM 988 C CG . ASP 126 201 ? A -10.534 6.915 39.414 1.000 1 A 33.916 1 ATOM 989 O OD1 . ASP 126 201 ? A -9.910 7.121 38.350 1.000 1 A 33.916 1 ATOM 990 O OD2 . ASP 126 201 ? A -10.439 7.670 40.405 1.000 1 A 33.916 1 ATOM 991 N N . ALA 127 202 ? A -11.608 3.049 36.870 1.000 1 A 41.294 1 ATOM 992 C CA . ALA 127 202 ? A -10.837 1.816 36.731 1.000 1 A 41.294 1 ATOM 993 C C . ALA 127 202 ? A -9.890 1.893 35.537 1.000 1 A 41.294 1 ATOM 994 O O . ALA 127 202 ? A -10.333 2.010 34.392 1.000 1 A 41.294 1 ATOM 995 C CB . ALA 127 202 ? A -11.772 0.617 36.588 1.000 1 A 41.294 1 ATOM 996 N N . ASP 128 203 ? A -8.947 2.754 35.622 1.000 1 A 37.537 1 ATOM 997 C CA . ASP 128 203 ? A -7.504 2.678 35.418 1.000 1 A 37.537 1 ATOM 998 C C . ASP 128 203 ? A -7.000 1.246 35.587 1.000 1 A 37.537 1 ATOM 999 O O . ASP 128 203 ? A -7.017 0.703 36.693 1.000 1 A 37.537 1 ATOM 1000 C CB . ASP 128 203 ? A -6.775 3.609 36.389 1.000 1 A 37.537 1 ATOM 1001 C CG . ASP 128 203 ? A -5.480 4.162 35.822 1.000 1 A 37.537 1 ATOM 1002 O OD1 . ASP 128 203 ? A -5.248 4.039 34.600 1.000 1 A 37.537 1 ATOM 1003 O OD2 . ASP 128 203 ? A -4.682 4.722 36.604 1.000 1 A 37.537 1 ATOM 1004 N N . LEU 129 204 ? A -7.321 0.212 34.696 1.000 1 A 44.098 1 ATOM 1005 C CA . LEU 129 204 ? A -6.285 -0.806 34.553 1.000 1 A 44.098 1 ATOM 1006 C C . LEU 129 204 ? A -6.700 -1.864 33.536 1.000 1 A 44.098 1 ATOM 1007 O O . LEU 129 204 ? A -7.750 -2.494 33.682 1.000 1 A 44.098 1 ATOM 1008 C CB . LEU 129 204 ? A -5.992 -1.466 35.903 1.000 1 A 44.098 1 ATOM 1009 C CG . LEU 129 204 ? A -5.010 -0.732 36.817 1.000 1 A 44.098 1 ATOM 1010 C CD1 . LEU 129 204 ? A -5.303 -1.056 38.279 1.000 1 A 44.098 1 ATOM 1011 C CD2 . LEU 129 204 ? A -3.573 -1.097 36.462 1.000 1 A 44.098 1 ATOM 1012 N N . ALA 130 205 ? A -6.697 -1.619 32.286 1.000 1 A 51.281 1 ATOM 1013 C CA . ALA 130 205 ? A -6.299 -2.778 31.491 1.000 1 A 51.281 1 ATOM 1014 C C . ALA 130 205 ? A -6.646 -2.579 30.019 1.000 1 A 51.281 1 ATOM 1015 O O . ALA 130 205 ? A -7.202 -3.475 29.379 1.000 1 A 51.281 1 ATOM 1016 C CB . ALA 130 205 ? A -6.965 -4.044 32.025 1.000 1 A 51.281 1 ATOM 1017 N N . GLU 131 206 ? A -6.265 -1.497 29.374 1.000 1 A 50.628 1 ATOM 1018 C CA . GLU 131 206 ? A -6.795 -1.481 28.014 1.000 1 A 50.628 1 ATOM 1019 C C . GLU 131 206 ? A -5.721 -1.075 27.008 1.000 1 A 50.628 1 ATOM 1020 O O . GLU 131 206 ? A -5.091 -0.026 27.154 1.000 1 A 50.628 1 ATOM 1021 C CB . GLU 131 206 ? A -7.993 -0.534 27.914 1.000 1 A 50.628 1 ATOM 1022 C CG . GLU 131 206 ? A -8.791 -0.684 26.627 1.000 1 A 50.628 1 ATOM 1023 C CD . GLU 131 206 ? A -9.980 0.259 26.545 1.000 1 A 50.628 1 ATOM 1024 O OE1 . GLU 131 206 ? A -10.653 0.298 25.489 1.000 1 A 50.628 1 ATOM 1025 O OE2 . GLU 131 206 ? A -10.241 0.967 27.543 1.000 1 A 50.628 1 ATOM 1026 N N . GLY 132 207 ? A -4.613 -1.823 26.891 1.000 1 A 65.971 1 ATOM 1027 C CA . GLY 132 207 ? A -3.799 -1.816 25.686 1.000 1 A 65.971 1 ATOM 1028 C C . GLY 132 207 ? A -4.471 -1.124 24.515 1.000 1 A 65.971 1 ATOM 1029 O O . GLY 132 207 ? A -5.690 -0.940 24.513 1.000 1 A 65.971 1 ATOM 1030 N N . PRO 133 208 ? A -3.765 -0.067 23.998 1.000 1 A 63.240 1 ATOM 1031 C CA . PRO 133 208 ? A -4.410 0.726 22.949 1.000 1 A 63.240 1 ATOM 1032 C C . PRO 133 208 ? A -5.210 -0.131 21.970 1.000 1 A 63.240 1 ATOM 1033 O O . PRO 133 208 ? A -4.845 -1.279 21.708 1.000 1 A 63.240 1 ATOM 1034 C CB . PRO 133 208 ? A -3.231 1.403 22.244 1.000 1 A 63.240 1 ATOM 1035 C CG . PRO 133 208 ? A -2.015 0.828 22.895 1.000 1 A 63.240 1 ATOM 1036 C CD . PRO 133 208 ? A -2.455 -0.143 23.953 1.000 1 A 63.240 1 ATOM 1037 N N . PRO 134 209 ? A -6.478 0.006 21.967 1.000 1 A 65.513 1 ATOM 1038 C CA . PRO 134 209 ? A -7.346 -0.630 20.973 1.000 1 A 65.513 1 ATOM 1039 C C . PRO 134 209 ? A -6.674 -0.775 19.609 1.000 1 A 65.513 1 ATOM 1040 O O . PRO 134 209 ? A -5.773 -0.002 19.275 1.000 1 A 65.513 1 ATOM 1041 C CB . PRO 134 209 ? A -8.545 0.318 20.893 1.000 1 A 65.513 1 ATOM 1042 C CG . PRO 134 209 ? A -8.254 1.387 21.896 1.000 1 A 65.513 1 ATOM 1043 C CD . PRO 134 209 ? A -6.875 1.162 22.446 1.000 1 A 65.513 1 ATOM 1044 N N . PRO 135 210 ? A -6.577 -2.020 19.027 1.000 1 A 63.660 1 ATOM 1045 C CA . PRO 135 210 ? A -6.153 -2.257 17.645 1.000 1 A 63.660 1 ATOM 1046 C C . PRO 135 210 ? A -6.606 -1.153 16.692 1.000 1 A 63.660 1 ATOM 1047 O O . PRO 135 210 ? A -7.676 -0.569 16.882 1.000 1 A 63.660 1 ATOM 1048 C CB . PRO 135 210 ? A -6.819 -3.589 17.295 1.000 1 A 63.660 1 ATOM 1049 C CG . PRO 135 210 ? A -7.714 -3.886 18.455 1.000 1 A 63.660 1 ATOM 1050 C CD . PRO 135 210 ? A -7.481 -2.847 19.514 1.000 1 A 63.660 1 ATOM 1051 N N . TRP 136 211 ? A -5.667 -0.207 16.224 1.000 1 A 53.238 1 ATOM 1052 C CA . TRP 136 211 ? A -5.916 0.883 15.287 1.000 1 A 53.238 1 ATOM 1053 C C . TRP 136 211 ? A -6.762 0.408 14.111 1.000 1 A 53.238 1 ATOM 1054 O O . TRP 136 211 ? A -6.423 -0.579 13.453 1.000 1 A 53.238 1 ATOM 1055 C CB . TRP 136 211 ? A -4.595 1.468 14.779 1.000 1 A 53.238 1 ATOM 1056 C CG . TRP 136 211 ? A -4.762 2.607 13.818 1.000 1 A 53.238 1 ATOM 1057 C CD1 . TRP 136 211 ? A -5.425 3.782 14.041 1.000 1 A 53.238 1 ATOM 1058 C CD2 . TRP 136 211 ? A -4.261 2.676 12.480 1.000 1 A 53.238 1 ATOM 1059 N NE1 . TRP 136 211 ? A -5.366 4.578 12.920 1.000 1 A 53.238 1 ATOM 1060 C CE2 . TRP 136 211 ? A -4.658 3.923 11.949 1.000 1 A 53.238 1 ATOM 1061 C CE3 . TRP 136 211 ? A -3.514 1.803 11.677 1.000 1 A 53.238 1 ATOM 1062 C CZ2 . TRP 136 211 ? A -4.331 4.320 10.650 1.000 1 A 53.238 1 ATOM 1063 C CZ3 . TRP 136 211 ? A -3.191 2.200 10.384 1.000 1 A 53.238 1 ATOM 1064 C CH2 . TRP 136 211 ? A -3.600 3.447 9.886 1.000 1 A 53.238 1 ATOM 1065 N N . THR 137 212 ? A -8.080 0.424 14.114 1.000 1 A 60.670 1 ATOM 1066 C CA . THR 137 212 ? A -9.008 0.268 12.999 1.000 1 A 60.670 1 ATOM 1067 C C . THR 137 212 ? A -9.318 1.619 12.360 1.000 1 A 60.670 1 ATOM 1068 O O . THR 137 212 ? A -9.610 2.590 13.061 1.000 1 A 60.670 1 ATOM 1069 C CB . THR 137 212 ? A -10.318 -0.402 13.453 1.000 1 A 60.670 1 ATOM 1070 O OG1 . THR 137 212 ? A -10.028 -1.357 14.481 1.000 1 A 60.670 1 ATOM 1071 C CG2 . THR 137 212 ? A -11.002 -1.115 12.291 1.000 1 A 60.670 1 ATOM 1072 N N . PRO 138 213 ? A -8.891 1.738 11.105 1.000 1 A 58.581 1 ATOM 1073 C CA . PRO 138 213 ? A -9.258 3.016 10.490 1.000 1 A 58.581 1 ATOM 1074 C C . PRO 138 213 ? A -10.750 3.320 10.605 1.000 1 A 58.581 1 ATOM 1075 O O . PRO 138 213 ? A -11.578 2.410 10.507 1.000 1 A 58.581 1 ATOM 1076 C CB . PRO 138 213 ? A -8.849 2.834 9.026 1.000 1 A 58.581 1 ATOM 1077 C CG . PRO 138 213 ? A -8.523 1.381 8.899 1.000 1 A 58.581 1 ATOM 1078 C CD . PRO 138 213 ? A -8.495 0.776 10.274 1.000 1 A 58.581 1 ATOM 1079 N N . ALA 139 214 ? A -11.182 4.254 11.434 1.000 1 A 64.326 1 ATOM 1080 C CA . ALA 139 214 ? A -12.519 4.760 11.735 1.000 1 A 64.326 1 ATOM 1081 C C . ALA 139 214 ? A -13.333 4.951 10.458 1.000 1 A 64.326 1 ATOM 1082 O O . ALA 139 214 ? A -14.551 4.758 10.457 1.000 1 A 64.326 1 ATOM 1083 C CB . ALA 139 214 ? A -12.429 6.074 12.507 1.000 1 A 64.326 1 ATOM 1084 N N . LEU 140 215 ? A -12.586 4.851 9.272 1.000 1 A 60.612 1 ATOM 1085 C CA . LEU 140 215 ? A -13.368 5.227 8.100 1.000 1 A 60.612 1 ATOM 1086 C C . LEU 140 215 ? A -13.551 4.038 7.163 1.000 1 A 60.612 1 ATOM 1087 O O . LEU 140 215 ? A -12.677 3.172 7.075 1.000 1 A 60.612 1 ATOM 1088 C CB . LEU 140 215 ? A -12.694 6.382 7.353 1.000 1 A 60.612 1 ATOM 1089 C CG . LEU 140 215 ? A -12.672 7.732 8.070 1.000 1 A 60.612 1 ATOM 1090 C CD1 . LEU 140 215 ? A -11.662 8.666 7.412 1.000 1 A 60.612 1 ATOM 1091 C CD2 . LEU 140 215 ? A -14.062 8.358 8.075 1.000 1 A 60.612 1 ATOM 1092 N N . PRO 141 216 ? A -14.889 3.825 6.749 1.000 1 A 64.963 1 ATOM 1093 C CA . PRO 141 216 ? A -15.154 2.772 5.765 1.000 1 A 64.963 1 ATOM 1094 C C . PRO 141 216 ? A -14.267 2.886 4.527 1.000 1 A 64.963 1 ATOM 1095 O O . PRO 141 216 ? A -13.822 3.983 4.181 1.000 1 A 64.963 1 ATOM 1096 C CB . PRO 141 216 ? A -16.626 2.989 5.405 1.000 1 A 64.963 1 ATOM 1097 C CG . PRO 141 216 ? A -16.902 4.412 5.768 1.000 1 A 64.963 1 ATOM 1098 C CD . PRO 141 216 ? A -15.901 4.845 6.800 1.000 1 A 64.963 1 ATOM 1099 N N . SER 142 217 ? A -13.517 1.824 4.135 1.000 1 A 61.028 1 ATOM 1100 C CA . SER 142 217 ? A -12.693 1.702 2.937 1.000 1 A 61.028 1 ATOM 1101 C C . SER 142 217 ? A -13.357 2.371 1.738 1.000 1 A 61.028 1 ATOM 1102 O O . SER 142 217 ? A -12.699 2.655 0.735 1.000 1 A 61.028 1 ATOM 1103 C CB . SER 142 217 ? A -12.418 0.231 2.622 1.000 1 A 61.028 1 ATOM 1104 O OG . SER 142 217 ? A -13.630 -0.496 2.520 1.000 1 A 61.028 1 ATOM 1105 N N . SER 143 218 ? A -14.724 2.689 1.800 1.000 1 A 66.321 1 ATOM 1106 C CA . SER 143 218 ? A -15.413 3.281 0.658 1.000 1 A 66.321 1 ATOM 1107 C C . SER 143 218 ? A -15.005 4.737 0.459 1.000 1 A 66.321 1 ATOM 1108 O O . SER 143 218 ? A -15.141 5.281 -0.638 1.000 1 A 66.321 1 ATOM 1109 C CB . SER 143 218 ? A -16.929 3.188 0.839 1.000 1 A 66.321 1 ATOM 1110 O OG . SER 143 218 ? A -17.334 3.844 2.029 1.000 1 A 66.321 1 ATOM 1111 N N . GLU 144 219 ? A -14.346 5.312 1.483 1.000 1 A 69.554 1 ATOM 1112 C CA . GLU 144 219 ? A -14.047 6.740 1.451 1.000 1 A 69.554 1 ATOM 1113 C C . GLU 144 219 ? A -12.629 6.997 0.950 1.000 1 A 69.554 1 ATOM 1114 O O . GLU 144 219 ? A -12.296 8.118 0.559 1.000 1 A 69.554 1 ATOM 1115 C CB . GLU 144 219 ? A -14.235 7.360 2.838 1.000 1 A 69.554 1 ATOM 1116 C CG . GLU 144 219 ? A -14.477 8.862 2.813 1.000 1 A 69.554 1 ATOM 1117 C CD . GLU 144 219 ? A -15.089 9.393 4.099 1.000 1 A 69.554 1 ATOM 1118 O OE1 . GLU 144 219 ? A -15.441 10.594 4.154 1.000 1 A 69.554 1 ATOM 1119 O OE2 . GLU 144 219 ? A -15.217 8.603 5.061 1.000 1 A 69.554 1 ATOM 1120 N N . VAL 145 220 ? A -11.889 5.860 0.945 1.000 1 A 71.752 1 ATOM 1121 C CA . VAL 145 220 ? A -10.502 6.031 0.525 1.000 1 A 71.752 1 ATOM 1122 C C . VAL 145 220 ? A -10.295 5.392 -0.846 1.000 1 A 71.752 1 ATOM 1123 O O . VAL 145 220 ? A -10.643 4.227 -1.055 1.000 1 A 71.752 1 ATOM 1124 C CB . VAL 145 220 ? A -9.520 5.422 1.551 1.000 1 A 71.752 1 ATOM 1125 C CG1 . VAL 145 220 ? A -8.076 5.599 1.086 1.000 1 A 71.752 1 ATOM 1126 C CG2 . VAL 145 220 ? A -9.724 6.056 2.925 1.000 1 A 71.752 1 ATOM 1127 N N . THR 146 221 ? A -10.137 6.221 -1.821 1.000 1 A 78.050 1 ATOM 1128 C CA . THR 146 221 ? A -9.838 5.674 -3.140 1.000 1 A 78.050 1 ATOM 1129 C C . THR 146 221 ? A -8.372 5.900 -3.500 1.000 1 A 78.050 1 ATOM 1130 O O . THR 146 221 ? A -7.812 6.958 -3.207 1.000 1 A 78.050 1 ATOM 1131 C CB . THR 146 221 ? A -10.737 6.302 -4.221 1.000 1 A 78.050 1 ATOM 1132 O OG1 . THR 146 221 ? A -10.618 7.729 -4.165 1.000 1 A 78.050 1 ATOM 1133 C CG2 . THR 146 221 ? A -12.198 5.917 -4.012 1.000 1 A 78.050 1 ATOM 1134 N N . VAL 147 222 ? A -7.707 4.745 -3.781 1.000 1 A 79.038 1 ATOM 1135 C CA . VAL 147 222 ? A -6.349 4.860 -4.304 1.000 1 A 79.038 1 ATOM 1136 C C . VAL 147 222 ? A -6.390 5.395 -5.734 1.000 1 A 79.038 1 ATOM 1137 O O . VAL 147 222 ? A -6.949 4.755 -6.627 1.000 1 A 79.038 1 ATOM 1138 C CB . VAL 147 222 ? A -5.608 3.505 -4.263 1.000 1 A 79.038 1 ATOM 1139 C CG1 . VAL 147 222 ? A -4.191 3.648 -4.816 1.000 1 A 79.038 1 ATOM 1140 C CG2 . VAL 147 222 ? A -5.576 2.958 -2.837 1.000 1 A 79.038 1 ATOM 1141 N N . THR 148 223 ? A -5.967 6.603 -5.854 1.000 1 A 83.611 1 ATOM 1142 C CA . THR 148 223 ? A -6.027 7.310 -7.129 1.000 1 A 83.611 1 ATOM 1143 C C . THR 148 223 ? A -4.860 6.907 -8.026 1.000 1 A 83.611 1 ATOM 1144 O O . THR 148 223 ? A -5.034 6.721 -9.232 1.000 1 A 83.611 1 ATOM 1145 C CB . THR 148 223 ? A -6.015 8.836 -6.922 1.000 1 A 83.611 1 ATOM 1146 O OG1 . THR 148 223 ? A -7.036 9.193 -5.982 1.000 1 A 83.611 1 ATOM 1147 C CG2 . THR 148 223 ? A -6.269 9.571 -8.234 1.000 1 A 83.611 1 ATOM 1148 N N . ASP 149 224 ? A -3.697 6.668 -7.534 1.000 1 A 83.860 1 ATOM 1149 C CA . ASP 149 224 ? A -2.545 6.377 -8.382 1.000 1 A 83.860 1 ATOM 1150 C C . ASP 149 224 ? A -1.481 5.597 -7.614 1.000 1 A 83.860 1 ATOM 1151 O O . ASP 149 224 ? A -1.243 5.858 -6.433 1.000 1 A 83.860 1 ATOM 1152 C CB . ASP 149 224 ? A -1.949 7.671 -8.940 1.000 1 A 83.860 1 ATOM 1153 C CG . ASP 149 224 ? A -2.848 8.347 -9.960 1.000 1 A 83.860 1 ATOM 1154 O OD1 . ASP 149 224 ? A -3.654 7.653 -10.617 1.000 1 A 83.860 1 ATOM 1155 O OD2 . ASP 149 224 ? A -2.747 9.584 -10.111 1.000 1 A 83.860 1 ATOM 1156 N N . ILE 150 225 ? A -0.989 4.499 -8.362 1.000 1 A 81.827 1 ATOM 1157 C CA . ILE 150 225 ? A 0.127 3.734 -7.815 1.000 1 A 81.827 1 ATOM 1158 C C . ILE 150 225 ? A 1.340 3.862 -8.734 1.000 1 A 81.827 1 ATOM 1159 O O . ILE 150 225 ? A 1.251 3.580 -9.932 1.000 1 A 81.827 1 ATOM 1160 C CB . ILE 150 225 ? A -0.247 2.247 -7.624 1.000 1 A 81.827 1 ATOM 1161 C CG1 . ILE 150 225 ? A -1.491 2.119 -6.738 1.000 1 A 81.827 1 ATOM 1162 C CG2 . ILE 150 225 ? A 0.930 1.466 -7.032 1.000 1 A 81.827 1 ATOM 1163 C CD1 . ILE 150 225 ? A -2.058 0.708 -6.668 1.000 1 A 81.827 1 ATOM 1164 N N . THR 151 226 ? A 2.294 4.540 -8.198 1.000 1 A 82.712 1 ATOM 1165 C CA . THR 151 226 ? A 3.561 4.555 -8.920 1.000 1 A 82.712 1 ATOM 1166 C C . THR 151 226 ? A 4.584 3.652 -8.236 1.000 1 A 82.712 1 ATOM 1167 O O . THR 151 226 ? A 4.315 3.099 -7.168 1.000 1 A 82.712 1 ATOM 1168 C CB . THR 151 226 ? A 4.125 5.984 -9.030 1.000 1 A 82.712 1 ATOM 1169 O OG1 . THR 151 226 ? A 4.482 6.452 -7.723 1.000 1 A 82.712 1 ATOM 1170 C CG2 . THR 151 226 ? A 3.098 6.935 -9.635 1.000 1 A 82.712 1 ATOM 1171 N N . ALA 152 227 ? A 5.672 3.226 -8.946 1.000 1 A 78.175 1 ATOM 1172 C CA . ALA 152 227 ? A 6.737 2.393 -8.395 1.000 1 A 78.175 1 ATOM 1173 C C . ALA 152 227 ? A 7.273 2.980 -7.092 1.000 1 A 78.175 1 ATOM 1174 O O . ALA 152 227 ? A 7.648 2.240 -6.179 1.000 1 A 78.175 1 ATOM 1175 C CB . ALA 152 227 ? A 7.868 2.236 -9.408 1.000 1 A 78.175 1 ATOM 1176 N N . ASN 153 228 ? A 7.052 4.170 -6.852 1.000 1 A 79.465 1 ATOM 1177 C CA . ASN 153 228 ? A 7.722 4.834 -5.739 1.000 1 A 79.465 1 ATOM 1178 C C . ASN 153 228 ? A 6.719 5.468 -4.779 1.000 1 A 79.465 1 ATOM 1179 O O . ASN 153 228 ? A 7.090 5.915 -3.692 1.000 1 A 79.465 1 ATOM 1180 C CB . ASN 153 228 ? A 8.703 5.889 -6.255 1.000 1 A 79.465 1 ATOM 1181 C CG . ASN 153 228 ? A 9.789 5.298 -7.131 1.000 1 A 79.465 1 ATOM 1182 O OD1 . ASN 153 228 ? A 10.313 4.217 -6.847 1.000 1 A 79.465 1 ATOM 1183 N ND2 . ASN 153 228 ? A 10.134 6.001 -8.203 1.000 1 A 79.465 1 ATOM 1184 N N . SER 154 229 ? A 5.424 5.342 -5.207 1.000 1 A 81.480 1 ATOM 1185 C CA . SER 154 229 ? A 4.473 6.054 -4.360 1.000 1 A 81.480 1 ATOM 1186 C C . SER 154 229 ? A 3.042 5.602 -4.634 1.000 1 A 81.480 1 ATOM 1187 O O . SER 154 229 ? A 2.760 5.022 -5.684 1.000 1 A 81.480 1 ATOM 1188 C CB . SER 154 229 ? A 4.589 7.564 -4.575 1.000 1 A 81.480 1 ATOM 1189 O OG . SER 154 229 ? A 4.220 7.914 -5.898 1.000 1 A 81.480 1 ATOM 1190 N N . ILE 155 230 ? A 2.257 5.723 -3.599 1.000 1 A 85.548 1 ATOM 1191 C CA . ILE 155 230 ? A 0.820 5.493 -3.704 1.000 1 A 85.548 1 ATOM 1192 C C . ILE 155 230 ? A 0.065 6.766 -3.326 1.000 1 A 85.548 1 ATOM 1193 O O . ILE 155 230 ? A 0.351 7.382 -2.297 1.000 1 A 85.548 1 ATOM 1194 C CB . ILE 155 230 ? A 0.370 4.317 -2.808 1.000 1 A 85.548 1 ATOM 1195 C CG1 . ILE 155 230 ? A 1.120 3.036 -3.191 1.000 1 A 85.548 1 ATOM 1196 C CG2 . ILE 155 230 ? A -1.145 4.114 -2.905 1.000 1 A 85.548 1 ATOM 1197 C CD1 . ILE 155 230 ? A 0.968 1.905 -2.183 1.000 1 A 85.548 1 ATOM 1198 N N . THR 156 231 ? A -0.787 7.191 -4.168 1.000 1 A 84.104 1 ATOM 1199 C CA . THR 156 231 ? A -1.614 8.365 -3.913 1.000 1 A 84.104 1 ATOM 1200 C C . THR 156 231 ? A -3.046 7.956 -3.580 1.000 1 A 84.104 1 ATOM 1201 O O . THR 156 231 ? A -3.687 7.238 -4.351 1.000 1 A 84.104 1 ATOM 1202 C CB . THR 156 231 ? A -1.618 9.319 -5.122 1.000 1 A 84.104 1 ATOM 1203 O OG1 . THR 156 231 ? A -0.266 9.612 -5.496 1.000 1 A 84.104 1 ATOM 1204 C CG2 . THR 156 231 ? A -2.335 10.624 -4.791 1.000 1 A 84.104 1 ATOM 1205 N N . VAL 157 232 ? A -3.447 8.316 -2.389 1.000 1 A 83.913 1 ATOM 1206 C CA . VAL 157 232 ? A -4.796 7.989 -1.940 1.000 1 A 83.913 1 ATOM 1207 C C . VAL 157 232 ? A -5.618 9.268 -1.800 1.000 1 A 83.913 1 ATOM 1208 O O . VAL 157 232 ? A -5.097 10.305 -1.381 1.000 1 A 83.913 1 ATOM 1209 C CB . VAL 157 232 ? A -4.777 7.218 -0.601 1.000 1 A 83.913 1 ATOM 1210 C CG1 . VAL 157 232 ? A -6.193 6.817 -0.190 1.000 1 A 83.913 1 ATOM 1211 C CG2 . VAL 157 232 ? A -3.879 5.987 -0.708 1.000 1 A 83.913 1 ATOM 1212 N N . THR 158 233 ? A -6.719 9.289 -2.385 1.000 1 A 78.050 1 ATOM 1213 C CA . THR 158 233 ? A -7.658 10.398 -2.265 1.000 1 A 78.050 1 ATOM 1214 C C . THR 158 233 ? A -8.789 10.047 -1.302 1.000 1 A 78.050 1 ATOM 1215 O O . THR 158 233 ? A -9.406 8.987 -1.421 1.000 1 A 78.050 1 ATOM 1216 C CB . THR 158 233 ? A -8.248 10.782 -3.635 1.000 1 A 78.050 1 ATOM 1217 O OG1 . THR 158 233 ? A -7.184 10.920 -4.585 1.000 1 A 78.050 1 ATOM 1218 C CG2 . THR 158 233 ? A -9.015 12.097 -3.554 1.000 1 A 78.050 1 ATOM 1219 N N . PHE 159 234 ? A -8.877 10.773 -0.244 1.000 1 A 72.191 1 ATOM 1220 C CA . PHE 159 234 ? A -9.969 10.604 0.707 1.000 1 A 72.191 1 ATOM 1221 C C . PHE 159 234 ? A -11.171 11.452 0.308 1.000 1 A 72.191 1 ATOM 1222 O O . PHE 159 234 ? A -11.029 12.640 0.014 1.000 1 A 72.191 1 ATOM 1223 C CB . PHE 159 234 ? A -9.512 10.974 2.122 1.000 1 A 72.191 1 ATOM 1224 C CG . PHE 159 234 ? A -8.376 10.130 2.633 1.000 1 A 72.191 1 ATOM 1225 C CD1 . PHE 159 234 ? A -8.621 9.019 3.430 1.000 1 A 72.191 1 ATOM 1226 C CD2 . PHE 159 234 ? A -7.062 10.449 2.316 1.000 1 A 72.191 1 ATOM 1227 C CE1 . PHE 159 234 ? A -7.571 8.236 3.904 1.000 1 A 72.191 1 ATOM 1228 C CE2 . PHE 159 234 ? A -6.007 9.672 2.787 1.000 1 A 72.191 1 ATOM 1229 C CZ . PHE 159 234 ? A -6.264 8.566 3.581 1.000 1 A 72.191 1 ATOM 1230 N N . ARG 160 235 ? A -12.167 10.864 -0.134 1.000 1 A 67.086 1 ATOM 1231 C CA . ARG 160 235 ? A -13.401 11.610 -0.360 1.000 1 A 67.086 1 ATOM 1232 C C . ARG 160 235 ? A -14.033 12.036 0.961 1.000 1 A 67.086 1 ATOM 1233 O O . ARG 160 235 ? A -14.311 11.197 1.821 1.000 1 A 67.086 1 ATOM 1234 C CB . ARG 160 235 ? A -14.394 10.774 -1.170 1.000 1 A 67.086 1 ATOM 1235 C CG . ARG 160 235 ? A -15.530 11.584 -1.776 1.000 1 A 67.086 1 ATOM 1236 C CD . ARG 160 235 ? A -16.439 10.721 -2.640 1.000 1 A 67.086 1 ATOM 1237 N NE . ARG 160 235 ? A -17.501 11.509 -3.259 1.000 1 A 67.086 1 ATOM 1238 C CZ . ARG 160 235 ? A -18.632 11.007 -3.745 1.000 1 A 67.086 1 ATOM 1239 N NH1 . ARG 160 235 ? A -18.872 9.701 -3.693 1.000 1 A 67.086 1 ATOM 1240 N NH2 . ARG 160 235 ? A -19.532 11.815 -4.287 1.000 1 A 67.086 1 ATOM 1241 N N . GLU 161 236 ? A -13.388 12.924 1.671 1.000 1 A 59.722 1 ATOM 1242 C CA . GLU 161 236 ? A -13.898 13.451 2.933 1.000 1 A 59.722 1 ATOM 1243 C C . GLU 161 236 ? A -15.414 13.615 2.890 1.000 1 A 59.722 1 ATOM 1244 O O . GLU 161 236 ? A -15.949 14.252 1.979 1.000 1 A 59.722 1 ATOM 1245 C CB . GLU 161 236 ? A -13.233 14.789 3.265 1.000 1 A 59.722 1 ATOM 1246 C CG . GLU 161 236 ? A -13.635 15.356 4.619 1.000 1 A 59.722 1 ATOM 1247 C CD . GLU 161 236 ? A -12.970 16.687 4.933 1.000 1 A 59.722 1 ATOM 1248 O OE1 . GLU 161 236 ? A -13.147 17.203 6.060 1.000 1 A 59.722 1 ATOM 1249 O OE2 . GLU 161 236 ? A -12.266 17.218 4.045 1.000 1 A 59.722 1 ATOM 1250 N N . ALA 162 237 ? A -16.222 12.558 3.054 1.000 1 A 50.630 1 ATOM 1251 C CA . ALA 162 237 ? A -17.669 12.521 3.253 1.000 1 A 50.630 1 ATOM 1252 C C . ALA 162 237 ? A -18.111 13.580 4.260 1.000 1 A 50.630 1 ATOM 1253 O O . ALA 162 237 ? A -17.401 13.859 5.229 1.000 1 A 50.630 1 ATOM 1254 C CB . ALA 162 237 ? A -18.106 11.134 3.718 1.000 1 A 50.630 1 ATOM 1255 N N . GLN 163 238 ? A -18.230 14.865 4.042 1.000 1 A 47.636 1 ATOM 1256 C CA . GLN 163 238 ? A -19.132 15.843 4.640 1.000 1 A 47.636 1 ATOM 1257 C C . GLN 163 238 ? A -19.348 15.557 6.124 1.000 1 A 47.636 1 ATOM 1258 O O . GLN 163 238 ? A -19.823 16.419 6.865 1.000 1 A 47.636 1 ATOM 1259 C CB . GLN 163 238 ? A -20.475 15.854 3.907 1.000 1 A 47.636 1 ATOM 1260 C CG . GLN 163 238 ? A -20.485 16.722 2.656 1.000 1 A 47.636 1 ATOM 1261 C CD . GLN 163 238 ? A -21.881 16.938 2.103 1.000 1 A 47.636 1 ATOM 1262 O OE1 . GLN 163 238 ? A -22.871 16.484 2.685 1.000 1 A 47.636 1 ATOM 1263 N NE2 . GLN 163 238 ? A -21.970 17.632 0.973 1.000 1 A 47.636 1 ATOM 1264 N N . ALA 164 239 ? A -18.573 14.715 6.831 1.000 1 A 47.163 1 ATOM 1265 C CA . ALA 164 239 ? A -18.837 14.648 8.266 1.000 1 A 47.163 1 ATOM 1266 C C . ALA 164 239 ? A -17.550 14.819 9.068 1.000 1 A 47.163 1 ATOM 1267 O O . ALA 164 239 ? A -17.469 14.390 10.222 1.000 1 A 47.163 1 ATOM 1268 C CB . ALA 164 239 ? A -19.511 13.326 8.623 1.000 1 A 47.163 1 ATOM 1269 N N . ALA 165 240 ? A -16.351 15.242 8.417 1.000 1 A 45.366 1 ATOM 1270 C CA . ALA 165 240 ? A -15.111 15.515 9.139 1.000 1 A 45.366 1 ATOM 1271 C C . ALA 165 240 ? A -15.342 16.515 10.268 1.000 1 A 45.366 1 ATOM 1272 O O . ALA 165 240 ? A -14.650 17.532 10.356 1.000 1 A 45.366 1 ATOM 1273 C CB . ALA 165 240 ? A -14.042 16.036 8.182 1.000 1 A 45.366 1 ATOM 1274 N N . GLU 166 241 ? A -16.650 16.619 10.820 1.000 1 A 44.251 1 ATOM 1275 C CA . GLU 166 241 ? A -16.657 17.180 12.168 1.000 1 A 44.251 1 ATOM 1276 C C . GLU 166 241 ? A -16.005 16.228 13.166 1.000 1 A 44.251 1 ATOM 1277 O O . GLU 166 241 ? A -16.389 15.060 13.259 1.000 1 A 44.251 1 ATOM 1278 C CB . GLU 166 241 ? A -18.088 17.504 12.607 1.000 1 A 44.251 1 ATOM 1279 C CG . GLU 166 241 ? A -18.166 18.450 13.797 1.000 1 A 44.251 1 ATOM 1280 C CD . GLU 166 241 ? A -19.588 18.859 14.146 1.000 1 A 44.251 1 ATOM 1281 O OE1 . GLU 166 241 ? A -19.777 19.632 15.113 1.000 1 A 44.251 1 ATOM 1282 O OE2 . GLU 166 241 ? A -20.520 18.403 13.447 1.000 1 A 44.251 1 ATOM 1283 N N . GLY 167 242 ? A -14.782 15.715 12.950 1.000 1 A 47.163 1 ATOM 1284 C CA . GLY 167 242 ? A -14.194 15.003 14.074 1.000 1 A 47.163 1 ATOM 1285 C C . GLY 167 242 ? A -12.768 14.554 13.815 1.000 1 A 47.163 1 ATOM 1286 O O . GLY 167 242 ? A -12.093 14.058 14.720 1.000 1 A 47.163 1 ATOM 1287 N N . PHE 168 243 ? A -12.345 14.639 12.404 1.000 1 A 50.171 1 ATOM 1288 C CA . PHE 168 243 ? A -10.979 14.201 12.140 1.000 1 A 50.171 1 ATOM 1289 C C . PHE 168 243 ? A -9.976 15.256 12.589 1.000 1 A 50.171 1 ATOM 1290 O O . PHE 168 243 ? A -8.900 14.924 13.092 1.000 1 A 50.171 1 ATOM 1291 C CB . PHE 168 243 ? A -10.789 13.896 10.651 1.000 1 A 50.171 1 ATOM 1292 C CG . PHE 168 243 ? A -9.548 13.100 10.348 1.000 1 A 50.171 1 ATOM 1293 C CD1 . PHE 168 243 ? A -8.403 13.727 9.872 1.000 1 A 50.171 1 ATOM 1294 C CD2 . PHE 168 243 ? A -9.527 11.725 10.539 1.000 1 A 50.171 1 ATOM 1295 C CE1 . PHE 168 243 ? A -7.253 12.993 9.591 1.000 1 A 50.171 1 ATOM 1296 C CE2 . PHE 168 243 ? A -8.382 10.985 10.260 1.000 1 A 50.171 1 ATOM 1297 C CZ . PHE 168 243 ? A -7.246 11.621 9.785 1.000 1 A 50.171 1 ATOM 1298 N N . PHE 169 244 ? A -10.476 16.532 12.860 1.000 1 A 51.718 1 ATOM 1299 C CA . PHE 169 244 ? A -9.561 17.496 13.461 1.000 1 A 51.718 1 ATOM 1300 C C . PHE 169 244 ? A -10.113 18.012 14.785 1.000 1 A 51.718 1 ATOM 1301 O O . PHE 169 244 ? A -9.537 18.917 15.393 1.000 1 A 51.718 1 ATOM 1302 C CB . PHE 169 244 ? A -9.308 18.666 12.506 1.000 1 A 51.718 1 ATOM 1303 C CG . PHE 169 244 ? A -8.532 18.287 11.274 1.000 1 A 51.718 1 ATOM 1304 C CD1 . PHE 169 244 ? A -7.150 18.151 11.320 1.000 1 A 51.718 1 ATOM 1305 C CD2 . PHE 169 244 ? A -9.185 18.067 10.068 1.000 1 A 51.718 1 ATOM 1306 C CE1 . PHE 169 244 ? A -6.429 17.800 10.182 1.000 1 A 51.718 1 ATOM 1307 C CE2 . PHE 169 244 ? A -8.471 17.716 8.926 1.000 1 A 51.718 1 ATOM 1308 C CZ . PHE 169 244 ? A -7.093 17.584 8.984 1.000 1 A 51.718 1 ATOM 1309 N N . ARG 170 245 ? A -11.080 17.278 15.482 1.000 1 A 46.227 1 ATOM 1310 C CA . ARG 170 245 ? A -11.484 17.951 16.712 1.000 1 A 46.227 1 ATOM 1311 C C . ARG 170 245 ? A -10.801 17.330 17.926 1.000 1 A 46.227 1 ATOM 1312 O O . ARG 170 245 ? A -10.834 16.112 18.108 1.000 1 A 46.227 1 ATOM 1313 C CB . ARG 170 245 ? A -13.004 17.895 16.881 1.000 1 A 46.227 1 ATOM 1314 C CG . ARG 170 245 ? A -13.769 18.714 15.853 1.000 1 A 46.227 1 ATOM 1315 C CD . ARG 170 245 ? A -14.875 19.537 16.498 1.000 1 A 46.227 1 ATOM 1316 N NE . ARG 170 245 ? A -15.190 20.727 15.712 1.000 1 A 46.227 1 ATOM 1317 C CZ . ARG 170 245 ? A -16.089 21.645 16.054 1.000 1 A 46.227 1 ATOM 1318 N NH1 . ARG 170 245 ? A -16.784 21.528 17.180 1.000 1 A 46.227 1 ATOM 1319 N NH2 . ARG 170 245 ? A -16.296 22.689 15.265 1.000 1 A 46.227 1 ATOM 1320 N N . ASP 171 246 ? A -9.482 17.488 18.158 1.000 1 A 45.077 1 ATOM 1321 C CA . ASP 171 246 ? A -9.202 17.745 19.568 1.000 1 A 45.077 1 ATOM 1322 C C . ASP 171 246 ? A -7.732 18.101 19.780 1.000 1 A 45.077 1 ATOM 1323 O O . ASP 171 246 ? A -7.027 17.424 20.531 1.000 1 A 45.077 1 ATOM 1324 C CB . ASP 171 246 ? A -9.578 16.531 20.420 1.000 1 A 45.077 1 ATOM 1325 C CG . ASP 171 246 ? A -11.005 16.587 20.936 1.000 1 A 45.077 1 ATOM 1326 O OD1 . ASP 171 246 ? A -11.655 17.648 20.817 1.000 1 A 45.077 1 ATOM 1327 O OD2 . ASP 171 246 ? A -11.482 15.563 21.470 1.000 1 A 45.077 1 ATOM 1328 N N . ARG 172 247 ? A -7.136 19.060 18.994 1.000 1 A 50.380 1 ATOM 1329 C CA . ARG 172 247 ? A -6.042 19.661 19.749 1.000 1 A 50.380 1 ATOM 1330 C C . ARG 172 247 ? A -6.495 20.938 20.449 1.000 1 A 50.380 1 ATOM 1331 O O . ARG 172 247 ? A -5.696 21.611 21.103 1.000 1 A 50.380 1 ATOM 1332 C CB . ARG 172 247 ? A -4.855 19.961 18.830 1.000 1 A 50.380 1 ATOM 1333 C CG . ARG 172 247 ? A -4.227 18.722 18.211 1.000 1 A 50.380 1 ATOM 1334 C CD . ARG 172 247 ? A -2.993 19.066 17.390 1.000 1 A 50.380 1 ATOM 1335 N NE . ARG 172 247 ? A -2.458 17.893 16.703 1.000 1 A 50.380 1 ATOM 1336 C CZ . ARG 172 247 ? A -1.235 17.808 16.188 1.000 1 A 50.380 1 ATOM 1337 N NH1 . ARG 172 247 ? A -0.391 18.830 16.273 1.000 1 A 50.380 1 ATOM 1338 N NH2 . ARG 172 247 ? A -0.852 16.693 15.584 1.000 1 A 50.380 1 ATOM 1339 N N . SER 173 248 ? A -7.807 21.084 20.692 1.000 1 A 51.296 1 ATOM 1340 C CA . SER 173 248 ? A -7.901 22.202 21.626 1.000 1 A 51.296 1 ATOM 1341 C C . SER 173 248 ? A -8.317 21.729 23.015 1.000 1 A 51.296 1 ATOM 1342 O O . SER 173 248 ? A -8.568 22.545 23.905 1.000 1 A 51.296 1 ATOM 1343 C CB . SER 173 248 ? A -8.894 23.247 21.115 1.000 1 A 51.296 1 ATOM 1344 O OG . SER 173 248 ? A -10.183 22.680 20.958 1.000 1 A 51.296 1 ATOM 1345 N N . GLY 174 249 ? A -7.902 20.539 23.623 1.000 1 A 48.519 1 ATOM 1346 C CA . GLY 174 249 ? A -8.166 20.368 25.042 1.000 1 A 48.519 1 ATOM 1347 C C . GLY 174 249 ? A -6.966 20.687 25.915 1.000 1 A 48.519 1 ATOM 1348 O O . GLY 174 249 ? A -5.828 20.390 25.546 1.000 1 A 48.519 1 ATOM 1349 N N . LYS 175 250 ? A -6.674 21.974 26.271 1.000 1 A 42.977 1 ATOM 1350 C CA . LYS 175 250 ? A -6.183 22.552 27.518 1.000 1 A 42.977 1 ATOM 1351 C C . LYS 175 250 ? A -4.962 21.794 28.032 1.000 1 A 42.977 1 ATOM 1352 O O . LYS 175 250 ? A -5.024 20.583 28.254 1.000 1 A 42.977 1 ATOM 1353 C CB . LYS 175 250 ? A -7.285 22.552 28.580 1.000 1 A 42.977 1 ATOM 1354 C CG . LYS 175 250 ? A -8.425 23.516 28.288 1.000 1 A 42.977 1 ATOM 1355 C CD . LYS 175 250 ? A -9.407 23.588 29.451 1.000 1 A 42.977 1 ATOM 1356 C CE . LYS 175 250 ? A -10.511 24.603 29.189 1.000 1 A 42.977 1 ATOM 1357 N NZ . LYS 175 250 ? A -11.554 24.575 30.258 1.000 1 A 42.977 1 ATOM 1358 N N . PHE 176 251 ? A -3.808 21.973 27.611 1.000 1 A 40.917 1 ATOM 1359 C CA . PHE 176 251 ? A -2.694 22.152 28.535 1.000 1 A 40.917 1 ATOM 1360 C C . PHE 176 251 ? A -2.493 23.628 28.861 1.000 1 A 40.917 1 ATOM 1361 O O . PHE 176 251 ? A -2.584 24.482 27.976 1.000 1 A 40.917 1 ATOM 1362 C CB . PHE 176 251 ? A -1.407 21.564 27.949 1.000 1 A 40.917 1 ATOM 1363 C CG . PHE 176 251 ? A -1.342 20.061 28.014 1.000 1 A 40.917 1 ATOM 1364 C CD1 . PHE 176 251 ? A -0.945 19.418 29.180 1.000 1 A 40.917 1 ATOM 1365 C CD2 . PHE 176 251 ? A -1.679 19.292 26.908 1.000 1 A 40.917 1 ATOM 1366 C CE1 . PHE 176 251 ? A -0.885 18.028 29.243 1.000 1 A 40.917 1 ATOM 1367 C CE2 . PHE 176 251 ? A -1.621 17.902 26.963 1.000 1 A 40.917 1 ATOM 1368 C CZ . PHE 176 251 ? A -1.222 17.272 28.131 1.000 1 A 40.917 1 ATOM 1369 N N . ALA 1 1121 ? B 24.761 43.779 3.816 1.000 2 B 34.918 1 ATOM 1370 C CA . ALA 1 1121 ? B 26.019 43.346 4.418 1.000 2 B 34.918 1 ATOM 1371 C C . ALA 1 1121 ? B 25.806 42.140 5.328 1.000 2 B 34.918 1 ATOM 1372 O O . ALA 1 1121 ? B 25.239 42.268 6.416 1.000 2 B 34.918 1 ATOM 1373 C CB . ALA 1 1121 ? B 26.656 44.493 5.200 1.000 2 B 34.918 1 ATOM 1374 N N . SER 2 1122 ? B 25.746 40.871 4.920 1.000 2 B 40.559 1 ATOM 1375 C CA . SER 2 1122 ? B 26.175 39.583 5.456 1.000 2 B 40.559 1 ATOM 1376 C C . SER 2 1122 ? B 26.493 38.597 4.336 1.000 2 B 40.559 1 ATOM 1377 O O . SER 2 1122 ? B 25.635 38.299 3.503 1.000 2 B 40.559 1 ATOM 1378 C CB . SER 2 1122 ? B 25.100 38.998 6.372 1.000 2 B 40.559 1 ATOM 1379 O OG . SER 2 1122 ? B 23.886 38.807 5.666 1.000 2 B 40.559 1 ATOM 1380 N N . ASP 3 1123 ? B 27.691 38.663 3.802 1.000 2 B 36.301 1 ATOM 1381 C CA . ASP 3 1123 ? B 28.947 37.919 3.821 1.000 2 B 36.301 1 ATOM 1382 C C . ASP 3 1123 ? B 28.696 36.416 3.723 1.000 2 B 36.301 1 ATOM 1383 O O . ASP 3 1123 ? B 28.059 35.830 4.601 1.000 2 B 36.301 1 ATOM 1384 C CB . ASP 3 1123 ? B 29.741 38.239 5.089 1.000 2 B 36.301 1 ATOM 1385 C CG . ASP 3 1123 ? B 30.864 39.233 4.850 1.000 2 B 36.301 1 ATOM 1386 O OD1 . ASP 3 1123 ? B 31.193 39.511 3.677 1.000 2 B 36.301 1 ATOM 1387 O OD2 . ASP 3 1123 ? B 31.427 39.740 5.845 1.000 2 B 36.301 1 ATOM 1388 N N . MET 4 1124 ? B 28.753 35.851 2.555 1.000 2 B 46.790 1 ATOM 1389 C CA . MET 4 1124 ? B 29.780 34.936 2.065 1.000 2 B 46.790 1 ATOM 1390 C C . MET 4 1124 ? B 29.153 33.661 1.511 1.000 2 B 46.790 1 ATOM 1391 O O . MET 4 1124 ? B 28.339 33.022 2.181 1.000 2 B 46.790 1 ATOM 1392 C CB . MET 4 1124 ? B 30.770 34.591 3.178 1.000 2 B 46.790 1 ATOM 1393 C CG . MET 4 1124 ? B 32.227 34.741 2.770 1.000 2 B 46.790 1 ATOM 1394 S SD . MET 4 1124 ? B 32.434 35.766 1.263 1.000 2 B 46.790 1 ATOM 1395 C CE . MET 4 1124 ? B 33.374 37.158 1.948 1.000 2 B 46.790 1 ATOM 1396 N N . PRO 5 1125 ? B 29.770 32.914 0.563 1.000 2 B 44.020 1 ATOM 1397 C CA . PRO 5 1125 ? B 29.855 32.223 -0.726 1.000 2 B 44.020 1 ATOM 1398 C C . PRO 5 1125 ? B 30.040 30.715 -0.575 1.000 2 B 44.020 1 ATOM 1399 O O . PRO 5 1125 ? B 30.439 30.241 0.491 1.000 2 B 44.020 1 ATOM 1400 C CB . PRO 5 1125 ? B 31.080 32.860 -1.387 1.000 2 B 44.020 1 ATOM 1401 C CG . PRO 5 1125 ? B 32.024 33.132 -0.260 1.000 2 B 44.020 1 ATOM 1402 C CD . PRO 5 1125 ? B 31.332 32.806 1.032 1.000 2 B 44.020 1 ATOM 1403 N N . HIS 6 1126 ? B 29.427 29.886 -1.390 1.000 2 B 40.607 1 ATOM 1404 C CA . HIS 6 1126 ? B 30.014 28.953 -2.344 1.000 2 B 40.607 1 ATOM 1405 C C . HIS 6 1126 ? B 29.064 27.798 -2.642 1.000 2 B 40.607 1 ATOM 1406 O O . HIS 6 1126 ? B 28.705 27.036 -1.741 1.000 2 B 40.607 1 ATOM 1407 C CB . HIS 6 1126 ? B 31.346 28.414 -1.818 1.000 2 B 40.607 1 ATOM 1408 C CG . HIS 6 1126 ? B 32.503 29.330 -2.065 1.000 2 B 40.607 1 ATOM 1409 N ND1 . HIS 6 1126 ? B 32.701 29.970 -3.269 1.000 2 B 40.607 1 ATOM 1410 C CD2 . HIS 6 1126 ? B 33.521 29.713 -1.259 1.000 2 B 40.607 1 ATOM 1411 C CE1 . HIS 6 1126 ? B 33.795 30.709 -3.193 1.000 2 B 40.607 1 ATOM 1412 N NE2 . HIS 6 1126 ? B 34.312 30.571 -1.984 1.000 2 B 40.607 1 ATOM 1413 N N . SER 7 1127 ? B 28.354 27.755 -3.654 1.000 2 B 33.372 1 ATOM 1414 C CA . SER 7 1127 ? B 28.347 27.041 -4.927 1.000 2 B 33.372 1 ATOM 1415 C C . SER 7 1127 ? B 28.396 25.531 -4.713 1.000 2 B 33.372 1 ATOM 1416 O O . SER 7 1127 ? B 29.147 25.043 -3.866 1.000 2 B 33.372 1 ATOM 1417 C CB . SER 7 1127 ? B 29.528 27.479 -5.795 1.000 2 B 33.372 1 ATOM 1418 O OG . SER 7 1127 ? B 30.198 26.355 -6.337 1.000 2 B 33.372 1 ATOM 1419 N N . PRO 8 1128 ? B 27.876 24.702 -5.744 1.000 2 B 44.670 1 ATOM 1420 C CA . PRO 8 1128 ? B 27.565 24.707 -7.175 1.000 2 B 44.670 1 ATOM 1421 C C . PRO 8 1128 ? B 26.404 23.782 -7.530 1.000 2 B 44.670 1 ATOM 1422 O O . PRO 8 1128 ? B 26.138 22.814 -6.812 1.000 2 B 44.670 1 ATOM 1423 C CB . PRO 8 1128 ? B 28.866 24.222 -7.820 1.000 2 B 44.670 1 ATOM 1424 C CG . PRO 8 1128 ? B 29.435 23.244 -6.844 1.000 2 B 44.670 1 ATOM 1425 C CD . PRO 8 1128 ? B 28.564 23.229 -5.620 1.000 2 B 44.670 1 ATOM 1426 N N . THR 9 1129 ? B 25.411 24.217 -8.222 1.000 2 B 34.749 1 ATOM 1427 C CA . THR 9 1129 ? B 24.975 24.031 -9.602 1.000 2 B 34.749 1 ATOM 1428 C C . THR 9 1129 ? B 24.934 22.548 -9.961 1.000 2 B 34.749 1 ATOM 1429 O O . THR 9 1129 ? B 25.970 21.881 -9.984 1.000 2 B 34.749 1 ATOM 1430 C CB . THR 9 1129 ? B 25.897 24.775 -10.585 1.000 2 B 34.749 1 ATOM 1431 O OG1 . THR 9 1129 ? B 27.145 25.058 -9.939 1.000 2 B 34.749 1 ATOM 1432 C CG2 . THR 9 1129 ? B 25.268 26.085 -11.046 1.000 2 B 34.749 1 ATOM 1433 N N . LEU 10 1130 ? B 23.884 21.857 -9.667 1.000 2 B 41.184 1 ATOM 1434 C CA . LEU 10 1130 ? B 23.503 20.723 -10.502 1.000 2 B 41.184 1 ATOM 1435 C C . LEU 10 1130 ? B 22.265 21.050 -11.330 1.000 2 B 41.184 1 ATOM 1436 O O . LEU 10 1130 ? B 21.156 21.120 -10.795 1.000 2 B 41.184 1 ATOM 1437 C CB . LEU 10 1130 ? B 23.243 19.485 -9.640 1.000 2 B 41.184 1 ATOM 1438 C CG . LEU 10 1130 ? B 24.469 18.844 -8.987 1.000 2 B 41.184 1 ATOM 1439 C CD1 . LEU 10 1130 ? B 24.045 17.696 -8.077 1.000 2 B 41.184 1 ATOM 1440 C CD2 . LEU 10 1130 ? B 25.448 18.357 -10.050 1.000 2 B 41.184 1 ATOM 1441 N N . ARG 11 1131 ? B 22.262 22.069 -12.165 1.000 2 B 39.605 1 ATOM 1442 C CA . ARG 11 1131 ? B 21.370 22.360 -13.283 1.000 2 B 39.605 1 ATOM 1443 C C . ARG 11 1131 ? B 21.706 21.494 -14.492 1.000 2 B 39.605 1 ATOM 1444 O O . ARG 11 1131 ? B 22.845 21.493 -14.964 1.000 2 B 39.605 1 ATOM 1445 C CB . ARG 11 1131 ? B 21.448 23.841 -13.662 1.000 2 B 39.605 1 ATOM 1446 C CG . ARG 11 1131 ? B 20.643 24.753 -12.750 1.000 2 B 39.605 1 ATOM 1447 C CD . ARG 11 1131 ? B 19.902 25.826 -13.537 1.000 2 B 39.605 1 ATOM 1448 N NE . ARG 11 1131 ? B 18.839 26.438 -12.745 1.000 2 B 39.605 1 ATOM 1449 C CZ . ARG 11 1131 ? B 18.763 27.733 -12.452 1.000 2 B 39.605 1 ATOM 1450 N NH1 . ARG 11 1131 ? B 19.690 28.582 -12.881 1.000 2 B 39.605 1 ATOM 1451 N NH2 . ARG 11 1131 ? B 17.752 28.184 -11.723 1.000 2 B 39.605 1 ATOM 1452 N N . VAL 12 1132 ? B 21.282 20.315 -14.589 1.000 2 B 40.129 1 ATOM 1453 C CA . VAL 12 1132 ? B 21.027 19.399 -15.695 1.000 2 B 40.129 1 ATOM 1454 C C . VAL 12 1132 ? B 19.985 20.001 -16.636 1.000 2 B 40.129 1 ATOM 1455 O O . VAL 12 1132 ? B 18.874 20.329 -16.213 1.000 2 B 40.129 1 ATOM 1456 C CB . VAL 12 1132 ? B 20.553 18.017 -15.191 1.000 2 B 40.129 1 ATOM 1457 C CG1 . VAL 12 1132 ? B 21.742 17.081 -14.984 1.000 2 B 40.129 1 ATOM 1458 C CG2 . VAL 12 1132 ? B 19.755 18.167 -13.897 1.000 2 B 40.129 1 ATOM 1459 N N . ASP 13 1133 ? B 20.285 21.043 -17.356 1.000 2 B 34.818 1 ATOM 1460 C CA . ASP 13 1133 ? B 20.031 21.551 -18.700 1.000 2 B 34.818 1 ATOM 1461 C C . ASP 13 1133 ? B 19.648 20.421 -19.652 1.000 2 B 34.818 1 ATOM 1462 O O . ASP 13 1133 ? B 20.488 19.594 -20.013 1.000 2 B 34.818 1 ATOM 1463 C CB . ASP 13 1133 ? B 21.258 22.294 -19.234 1.000 2 B 34.818 1 ATOM 1464 C CG . ASP 13 1133 ? B 20.969 23.744 -19.579 1.000 2 B 34.818 1 ATOM 1465 O OD1 . ASP 13 1133 ? B 19.805 24.078 -19.889 1.000 2 B 34.818 1 ATOM 1466 O OD2 . ASP 13 1133 ? B 21.915 24.561 -19.545 1.000 2 B 34.818 1 ATOM 1467 N N . ARG 14 1134 ? B 18.457 19.840 -19.665 1.000 2 B 42.065 1 ATOM 1468 C CA . ARG 14 1134 ? B 17.942 19.102 -20.814 1.000 2 B 42.065 1 ATOM 1469 C C . ARG 14 1134 ? B 16.904 19.924 -21.571 1.000 2 B 42.065 1 ATOM 1470 O O . ARG 14 1134 ? B 15.832 20.223 -21.040 1.000 2 B 42.065 1 ATOM 1471 C CB . ARG 14 1134 ? B 17.332 17.771 -20.370 1.000 2 B 42.065 1 ATOM 1472 C CG . ARG 14 1134 ? B 18.207 16.563 -20.666 1.000 2 B 42.065 1 ATOM 1473 C CD . ARG 14 1134 ? B 17.586 15.275 -20.146 1.000 2 B 42.065 1 ATOM 1474 N NE . ARG 14 1134 ? B 18.027 14.115 -20.915 1.000 2 B 42.065 1 ATOM 1475 C CZ . ARG 14 1134 ? B 18.150 12.884 -20.426 1.000 2 B 42.065 1 ATOM 1476 N NH1 . ARG 14 1134 ? B 17.865 12.627 -19.154 1.000 2 B 42.065 1 ATOM 1477 N NH2 . ARG 14 1134 ? B 18.561 11.901 -21.214 1.000 2 B 42.065 1 ATOM 1478 N N . LYS 15 1135 ? B 17.176 21.124 -22.127 1.000 2 B 46.688 1 ATOM 1479 C CA . LYS 15 1135 ? B 16.452 21.893 -23.134 1.000 2 B 46.688 1 ATOM 1480 C C . LYS 15 1135 ? B 16.609 21.272 -24.519 1.000 2 B 46.688 1 ATOM 1481 O O . LYS 15 1135 ? B 17.724 21.164 -25.034 1.000 2 B 46.688 1 ATOM 1482 C CB . LYS 15 1135 ? B 16.937 23.344 -23.153 1.000 2 B 46.688 1 ATOM 1483 C CG . LYS 15 1135 ? B 16.547 24.142 -21.917 1.000 2 B 46.688 1 ATOM 1484 C CD . LYS 15 1135 ? B 15.082 24.556 -21.958 1.000 2 B 46.688 1 ATOM 1485 C CE . LYS 15 1135 ? B 14.679 25.314 -20.701 1.000 2 B 46.688 1 ATOM 1486 N NZ . LYS 15 1135 ? B 13.212 25.593 -20.667 1.000 2 B 46.688 1 ATOM 1487 N N . ARG 16 1136 ? B 15.898 20.175 -24.884 1.000 2 B 51.269 1 ATOM 1488 C CA . ARG 16 1136 ? B 15.465 19.867 -26.243 1.000 2 B 51.269 1 ATOM 1489 C C . ARG 16 1136 ? B 14.456 20.895 -26.743 1.000 2 B 51.269 1 ATOM 1490 O O . ARG 16 1136 ? B 13.480 21.201 -26.054 1.000 2 B 51.269 1 ATOM 1491 C CB . ARG 16 1136 ? B 14.860 18.463 -26.310 1.000 2 B 51.269 1 ATOM 1492 C CG . ARG 16 1136 ? B 15.582 17.526 -27.266 1.000 2 B 51.269 1 ATOM 1493 C CD . ARG 16 1136 ? B 14.895 16.170 -27.352 1.000 2 B 51.269 1 ATOM 1494 N NE . ARG 16 1136 ? B 15.701 15.118 -26.738 1.000 2 B 51.269 1 ATOM 1495 C CZ . ARG 16 1136 ? B 15.273 13.883 -26.491 1.000 2 B 51.269 1 ATOM 1496 N NH1 . ARG 16 1136 ? B 14.034 13.520 -26.801 1.000 2 B 51.269 1 ATOM 1497 N NH2 . ARG 16 1136 ? B 16.090 13.005 -25.928 1.000 2 B 51.269 1 ATOM 1498 N N . LYS 17 1137 ? B 14.847 22.079 -27.237 1.000 2 B 45.023 1 ATOM 1499 C CA . LYS 17 1137 ? B 14.318 23.035 -28.205 1.000 2 B 45.023 1 ATOM 1500 C C . LYS 17 1137 ? B 13.628 22.321 -29.364 1.000 2 B 45.023 1 ATOM 1501 O O . LYS 17 1137 ? B 14.218 21.443 -29.998 1.000 2 B 45.023 1 ATOM 1502 C CB . LYS 17 1137 ? B 15.434 23.937 -28.735 1.000 2 B 45.023 1 ATOM 1503 C CG . LYS 17 1137 ? B 16.185 24.694 -27.651 1.000 2 B 45.023 1 ATOM 1504 C CD . LYS 17 1137 ? B 15.364 25.858 -27.110 1.000 2 B 45.023 1 ATOM 1505 C CE . LYS 17 1137 ? B 16.018 26.483 -25.885 1.000 2 B 45.023 1 ATOM 1506 N NZ . LYS 17 1137 ? B 15.107 27.452 -25.205 1.000 2 B 45.023 1 ATOM 1507 N N . VAL 18 1138 ? B 12.324 22.033 -29.319 1.000 2 B 39.595 1 ATOM 1508 C CA . VAL 18 1138 ? B 11.385 21.796 -30.410 1.000 2 B 39.595 1 ATOM 1509 C C . VAL 18 1138 ? B 10.939 23.128 -31.008 1.000 2 B 39.595 1 ATOM 1510 O O . VAL 18 1138 ? B 10.467 24.012 -30.289 1.000 2 B 39.595 1 ATOM 1511 C CB . VAL 18 1138 ? B 10.156 20.987 -29.936 1.000 2 B 39.595 1 ATOM 1512 C CG1 . VAL 18 1138 ? B 8.958 21.241 -30.849 1.000 2 B 39.595 1 ATOM 1513 C CG2 . VAL 18 1138 ? B 10.487 19.496 -29.886 1.000 2 B 39.595 1 ATOM 1514 N N . SER 19 1139 ? B 11.755 23.892 -31.703 1.000 2 B 40.697 1 ATOM 1515 C CA . SER 19 1139 ? B 11.416 24.997 -32.594 1.000 2 B 40.697 1 ATOM 1516 C C . SER 19 1139 ? B 11.399 24.547 -34.051 1.000 2 B 40.697 1 ATOM 1517 O O . SER 19 1139 ? B 12.334 23.889 -34.513 1.000 2 B 40.697 1 ATOM 1518 C CB . SER 19 1139 ? B 12.406 26.150 -32.419 1.000 2 B 40.697 1 ATOM 1519 O OG . SER 19 1139 ? B 12.011 26.994 -31.351 1.000 2 B 40.697 1 ATOM 1520 N N . GLY 20 1140 ? B 10.198 24.352 -34.571 1.000 2 B 30.265 1 ATOM 1521 C CA . GLY 20 1140 ? B 9.650 25.215 -35.606 1.000 2 B 30.265 1 ATOM 1522 C C . GLY 20 1140 ? B 10.109 24.839 -37.002 1.000 2 B 30.265 1 ATOM 1523 O O . GLY 20 1140 ? B 11.311 24.783 -37.272 1.000 2 B 30.265 1 ATOM 1524 N N . ASP 21 1141 ? B 9.195 24.050 -37.743 1.000 2 B 37.234 1 ATOM 1525 C CA . ASP 21 1141 ? B 9.175 24.292 -39.182 1.000 2 B 37.234 1 ATOM 1526 C C . ASP 21 1141 ? B 7.883 23.772 -39.808 1.000 2 B 37.234 1 ATOM 1527 O O . ASP 21 1141 ? B 7.417 22.682 -39.468 1.000 2 B 37.234 1 ATOM 1528 C CB . ASP 21 1141 ? B 10.385 23.639 -39.853 1.000 2 B 37.234 1 ATOM 1529 C CG . ASP 21 1141 ? B 10.964 24.480 -40.978 1.000 2 B 37.234 1 ATOM 1530 O OD1 . ASP 21 1141 ? B 10.426 25.571 -41.263 1.000 2 B 37.234 1 ATOM 1531 O OD2 . ASP 21 1141 ? B 11.966 24.045 -41.586 1.000 2 B 37.234 1 ATOM 1532 N N . SER 22 1142 ? B 6.876 24.630 -40.223 1.000 2 B 37.768 1 ATOM 1533 C CA . SER 22 1142 ? B 6.568 25.100 -41.570 1.000 2 B 37.768 1 ATOM 1534 C C . SER 22 1142 ? B 5.235 24.542 -42.058 1.000 2 B 37.768 1 ATOM 1535 O O . SER 22 1142 ? B 4.965 23.348 -41.912 1.000 2 B 37.768 1 ATOM 1536 C CB . SER 22 1142 ? B 7.681 24.708 -42.543 1.000 2 B 37.768 1 ATOM 1537 O OG . SER 22 1142 ? B 7.241 23.693 -43.429 1.000 2 B 37.768 1 ATOM 1538 N N . SER 23 1143 ? B 4.074 25.286 -42.041 1.000 2 B 30.628 1 ATOM 1539 C CA . SER 23 1143 ? B 3.207 25.950 -43.009 1.000 2 B 30.628 1 ATOM 1540 C C . SER 23 1143 ? B 2.744 24.982 -44.092 1.000 2 B 30.628 1 ATOM 1541 O O . SER 23 1143 ? B 3.561 24.292 -44.705 1.000 2 B 30.628 1 ATOM 1542 C CB . SER 23 1143 ? B 3.927 27.138 -43.649 1.000 2 B 30.628 1 ATOM 1543 O OG . SER 23 1143 ? B 5.095 26.710 -44.328 1.000 2 B 30.628 1 ATOM 1544 N N . HIS 24 1144 ? B 1.392 24.525 -44.154 1.000 2 B 34.015 1 ATOM 1545 C CA . HIS 24 1144 ? B 0.739 24.443 -45.455 1.000 2 B 34.015 1 ATOM 1546 C C . HIS 24 1144 ? B -0.691 23.930 -45.323 1.000 2 B 34.015 1 ATOM 1547 O O . HIS 24 1144 ? B -0.941 22.951 -44.617 1.000 2 B 34.015 1 ATOM 1548 C CB . HIS 24 1144 ? B 1.536 23.540 -46.399 1.000 2 B 34.015 1 ATOM 1549 C CG . HIS 24 1144 ? B 1.420 23.926 -47.839 1.000 2 B 34.015 1 ATOM 1550 N ND1 . HIS 24 1144 ? B 0.262 23.752 -48.565 1.000 2 B 34.015 1 ATOM 1551 C CD2 . HIS 24 1144 ? B 2.319 24.482 -48.686 1.000 2 B 34.015 1 ATOM 1552 C CE1 . HIS 24 1144 ? B 0.455 24.183 -49.801 1.000 2 B 34.015 1 ATOM 1553 N NE2 . HIS 24 1144 ? B 1.694 24.631 -49.900 1.000 2 B 34.015 1 ATOM 1554 N N . THR 25 1145 ? B -1.796 24.743 -45.326 1.000 2 B 35.590 1 ATOM 1555 C CA . THR 25 1145 ? B -2.816 24.966 -46.344 1.000 2 B 35.590 1 ATOM 1556 C C . THR 25 1145 ? B -4.214 24.806 -45.753 1.000 2 B 35.590 1 ATOM 1557 O O . THR 25 1145 ? B -4.502 23.810 -45.087 1.000 2 B 35.590 1 ATOM 1558 C CB . THR 25 1145 ? B -2.644 23.999 -47.530 1.000 2 B 35.590 1 ATOM 1559 O OG1 . THR 25 1145 ? B -2.265 22.709 -47.036 1.000 2 B 35.590 1 ATOM 1560 C CG2 . THR 25 1145 ? B -1.571 24.497 -48.494 1.000 2 B 35.590 1 ATOM 1561 N N . GLU 26 1146 ? B -4.869 25.818 -45.398 1.000 2 B 29.417 1 ATOM 1562 C CA . GLU 26 1146 ? B -6.145 26.482 -45.651 1.000 2 B 29.417 1 ATOM 1563 C C . GLU 26 1146 ? B -6.830 25.908 -46.887 1.000 2 B 29.417 1 ATOM 1564 O O . GLU 26 1146 ? B -6.279 25.958 -47.989 1.000 2 B 29.417 1 ATOM 1565 C CB . GLU 26 1146 ? B -5.942 27.991 -45.815 1.000 2 B 29.417 1 ATOM 1566 C CG . GLU 26 1146 ? B -5.690 28.723 -44.505 1.000 2 B 29.417 1 ATOM 1567 C CD . GLU 26 1146 ? B -5.768 30.236 -44.638 1.000 2 B 29.417 1 ATOM 1568 O OE1 . GLU 26 1146 ? B -6.328 30.897 -43.734 1.000 2 B 29.417 1 ATOM 1569 O OE2 . GLU 26 1146 ? B -5.267 30.764 -45.656 1.000 2 B 29.417 1 ATOM 1570 N N . THR 27 1147 ? B -7.757 24.881 -46.936 1.000 2 B 42.678 1 ATOM 1571 C CA . THR 27 1147 ? B -8.783 24.590 -47.931 1.000 2 B 42.678 1 ATOM 1572 C C . THR 27 1147 ? B -10.164 24.538 -47.284 1.000 2 B 42.678 1 ATOM 1573 O O . THR 27 1147 ? B -10.393 23.755 -46.359 1.000 2 B 42.678 1 ATOM 1574 C CB . THR 27 1147 ? B -8.500 23.260 -48.653 1.000 2 B 42.678 1 ATOM 1575 O OG1 . THR 27 1147 ? B -7.578 22.487 -47.874 1.000 2 B 42.678 1 ATOM 1576 C CG2 . THR 27 1147 ? B -7.903 23.501 -50.035 1.000 2 B 42.678 1 ATOM 1577 N N . THR 28 1148 ? B -10.891 25.663 -47.024 1.000 2 B 30.364 1 ATOM 1578 C CA . THR 28 1148 ? B -12.120 26.342 -47.419 1.000 2 B 30.364 1 ATOM 1579 C C . THR 28 1148 ? B -12.837 25.566 -48.520 1.000 2 B 30.364 1 ATOM 1580 O O . THR 28 1148 ? B -12.217 25.158 -49.504 1.000 2 B 30.364 1 ATOM 1581 C CB . THR 28 1148 ? B -11.835 27.777 -47.902 1.000 2 B 30.364 1 ATOM 1582 O OG1 . THR 28 1148 ? B -11.340 28.554 -46.804 1.000 2 B 30.364 1 ATOM 1583 C CG2 . THR 28 1148 ? B -13.098 28.435 -48.447 1.000 2 B 30.364 1 ATOM 1584 N N . ALA 29 1149 ? B -14.029 24.851 -48.323 1.000 2 B 37.011 1 ATOM 1585 C CA . ALA 29 1149 ? B -15.266 25.071 -49.068 1.000 2 B 37.011 1 ATOM 1586 C C . ALA 29 1149 ? B -15.851 23.751 -49.562 1.000 2 B 37.011 1 ATOM 1587 O O . ALA 29 1149 ? B -15.139 22.926 -50.138 1.000 2 B 37.011 1 ATOM 1588 C CB . ALA 29 1149 ? B -15.019 26.013 -50.244 1.000 2 B 37.011 1 ATOM 1589 N N . GLU 30 1150 ? B -16.973 23.212 -49.035 1.000 2 B 37.558 1 ATOM 1590 C CA . GLU 30 1150 ? B -18.199 22.968 -49.790 1.000 2 B 37.558 1 ATOM 1591 C C . GLU 30 1150 ? B -18.746 21.570 -49.518 1.000 2 B 37.558 1 ATOM 1592 O O . GLU 30 1150 ? B -18.022 20.580 -49.639 1.000 2 B 37.558 1 ATOM 1593 C CB . GLU 30 1150 ? B -17.952 23.153 -51.290 1.000 2 B 37.558 1 ATOM 1594 C CG . GLU 30 1150 ? B -19.044 23.941 -52.000 1.000 2 B 37.558 1 ATOM 1595 C CD . GLU 30 1150 ? B -19.593 23.232 -53.228 1.000 2 B 37.558 1 ATOM 1596 O OE1 . GLU 30 1150 ? B -20.812 23.337 -53.495 1.000 2 B 37.558 1 ATOM 1597 O OE2 . GLU 30 1150 ? B -18.799 22.564 -53.927 1.000 2 B 37.558 1 ATOM 1598 N N . GLU 31 1151 ? B -19.925 21.436 -48.798 1.000 2 B 29.968 1 ATOM 1599 C CA . GLU 31 1151 ? B -21.284 21.163 -49.254 1.000 2 B 29.968 1 ATOM 1600 C C . GLU 31 1151 ? B -21.423 19.726 -49.748 1.000 2 B 29.968 1 ATOM 1601 O O . GLU 31 1151 ? B -20.709 19.306 -50.661 1.000 2 B 29.968 1 ATOM 1602 C CB . GLU 31 1151 ? B -21.687 22.141 -50.361 1.000 2 B 29.968 1 ATOM 1603 C CG . GLU 31 1151 ? B -23.189 22.228 -50.588 1.000 2 B 29.968 1 ATOM 1604 C CD . GLU 31 1151 ? B -23.563 23.023 -51.829 1.000 2 B 29.968 1 ATOM 1605 O OE1 . GLU 31 1151 ? B -24.710 22.889 -52.313 1.000 2 B 29.968 1 ATOM 1606 O OE2 . GLU 31 1151 ? B -22.702 23.784 -52.323 1.000 2 B 29.968 1 ATOM 1607 N N . VAL 32 1152 ? B -22.002 18.783 -49.024 1.000 2 B 42.448 1 ATOM 1608 C CA . VAL 32 1152 ? B -23.246 18.027 -49.123 1.000 2 B 42.448 1 ATOM 1609 C C . VAL 32 1152 ? B -23.053 16.837 -50.061 1.000 2 B 42.448 1 ATOM 1610 O O . VAL 32 1152 ? B -22.357 16.942 -51.073 1.000 2 B 42.448 1 ATOM 1611 C CB . VAL 32 1152 ? B -24.411 18.912 -49.618 1.000 2 B 42.448 1 ATOM 1612 C CG1 . VAL 32 1152 ? B -25.639 18.061 -49.935 1.000 2 B 42.448 1 ATOM 1613 C CG2 . VAL 32 1152 ? B -24.749 19.978 -48.578 1.000 2 B 42.448 1 ATOM 1614 N N . PRO 33 1153 ? B -23.851 15.686 -50.051 1.000 2 B 51.005 1 ATOM 1615 C CA . PRO 33 1153 ? B -24.064 14.345 -49.501 1.000 2 B 51.005 1 ATOM 1616 C C . PRO 33 1153 ? B -24.097 13.264 -50.578 1.000 2 B 51.005 1 ATOM 1617 O O . PRO 33 1153 ? B -24.442 13.544 -51.729 1.000 2 B 51.005 1 ATOM 1618 C CB . PRO 33 1153 ? B -25.422 14.462 -48.803 1.000 2 B 51.005 1 ATOM 1619 C CG . PRO 33 1153 ? B -26.212 15.397 -49.660 1.000 2 B 51.005 1 ATOM 1620 C CD . PRO 33 1153 ? B -25.316 15.925 -50.743 1.000 2 B 51.005 1 ATOM 1621 N N . GLU 34 1154 ? B -23.449 12.136 -50.512 1.000 2 B 44.393 1 ATOM 1622 C CA . GLU 34 1154 ? B -23.722 10.952 -51.321 1.000 2 B 44.393 1 ATOM 1623 C C . GLU 34 1154 ? B -23.668 9.682 -50.476 1.000 2 B 44.393 1 ATOM 1624 O O . GLU 34 1154 ? B -22.662 9.411 -49.817 1.000 2 B 44.393 1 ATOM 1625 C CB . GLU 34 1154 ? B -22.729 10.853 -52.482 1.000 2 B 44.393 1 ATOM 1626 C CG . GLU 34 1154 ? B -23.147 11.638 -53.717 1.000 2 B 44.393 1 ATOM 1627 C CD . GLU 34 1154 ? B -22.665 11.013 -55.016 1.000 2 B 44.393 1 ATOM 1628 O OE1 . GLU 34 1154 ? B -23.495 10.786 -55.926 1.000 2 B 44.393 1 ATOM 1629 O OE2 . GLU 34 1154 ? B -21.447 10.748 -55.126 1.000 2 B 44.393 1 ATOM 1630 N N . ASP 35 1155 ? B -24.771 9.254 -49.770 1.000 2 B 44.156 1 ATOM 1631 C CA . ASP 35 1155 ? B -25.590 8.062 -49.971 1.000 2 B 44.156 1 ATOM 1632 C C . ASP 35 1155 ? B -24.719 6.821 -50.152 1.000 2 B 44.156 1 ATOM 1633 O O . ASP 35 1155 ? B -23.801 6.815 -50.976 1.000 2 B 44.156 1 ATOM 1634 C CB . ASP 35 1155 ? B -26.509 8.241 -51.182 1.000 2 B 44.156 1 ATOM 1635 C CG . ASP 35 1155 ? B -27.890 7.647 -50.970 1.000 2 B 44.156 1 ATOM 1636 O OD1 . ASP 35 1155 ? B -28.174 7.143 -49.862 1.000 2 B 44.156 1 ATOM 1637 O OD2 . ASP 35 1155 ? B -28.701 7.681 -51.921 1.000 2 B 44.156 1 ATOM 1638 N N . PRO 36 1156 ? B -25.121 5.568 -49.618 1.000 2 B 45.874 1 ATOM 1639 C CA . PRO 36 1156 ? B -25.028 4.286 -48.915 1.000 2 B 45.874 1 ATOM 1640 C C . PRO 36 1156 ? B -24.839 3.105 -49.864 1.000 2 B 45.874 1 ATOM 1641 O O . PRO 36 1156 ? B -25.564 2.982 -50.855 1.000 2 B 45.874 1 ATOM 1642 C CB . PRO 36 1156 ? B -26.369 4.187 -48.182 1.000 2 B 45.874 1 ATOM 1643 C CG . PRO 36 1156 ? B -27.148 5.374 -48.651 1.000 2 B 45.874 1 ATOM 1644 C CD . PRO 36 1156 ? B -26.461 5.950 -49.855 1.000 2 B 45.874 1 ATOM 1645 N N . LEU 37 1157 ? B -23.837 2.257 -49.881 1.000 2 B 41.193 1 ATOM 1646 C CA . LEU 37 1157 ? B -23.991 0.841 -50.197 1.000 2 B 41.193 1 ATOM 1647 C C . LEU 37 1157 ? B -22.653 0.221 -50.585 1.000 2 B 41.193 1 ATOM 1648 O O . LEU 37 1157 ? B -22.573 -0.542 -51.550 1.000 2 B 41.193 1 ATOM 1649 C CB . LEU 37 1157 ? B -25.002 0.652 -51.332 1.000 2 B 41.193 1 ATOM 1650 C CG . LEU 37 1157 ? B -26.357 0.061 -50.941 1.000 2 B 41.193 1 ATOM 1651 C CD1 . LEU 37 1157 ? B -27.476 1.050 -51.252 1.000 2 B 41.193 1 ATOM 1652 C CD2 . LEU 37 1157 ? B -26.591 -1.263 -51.661 1.000 2 B 41.193 1 ATOM 1653 N N . LEU 38 1158 ? B -21.623 0.215 -49.833 1.000 2 B 48.281 1 ATOM 1654 C CA . LEU 38 1158 ? B -20.688 -0.889 -50.022 1.000 2 B 48.281 1 ATOM 1655 C C . LEU 38 1158 ? B -20.547 -1.706 -48.742 1.000 2 B 48.281 1 ATOM 1656 O O . LEU 38 1158 ? B -20.026 -1.212 -47.739 1.000 2 B 48.281 1 ATOM 1657 C CB . LEU 38 1158 ? B -19.318 -0.364 -50.459 1.000 2 B 48.281 1 ATOM 1658 C CG . LEU 38 1158 ? B -19.304 0.561 -51.677 1.000 2 B 48.281 1 ATOM 1659 C CD1 . LEU 38 1158 ? B -17.916 1.163 -51.869 1.000 2 B 48.281 1 ATOM 1660 C CD2 . LEU 38 1158 ? B -19.744 -0.193 -52.927 1.000 2 B 48.281 1 ATOM 1661 N N . LYS 39 1159 ? B -21.511 -2.357 -48.248 1.000 2 B 44.309 1 ATOM 1662 C CA . LYS 39 1159 ? B -21.685 -3.803 -48.146 1.000 2 B 44.309 1 ATOM 1663 C C . LYS 39 1159 ? B -20.581 -4.544 -48.895 1.000 2 B 44.309 1 ATOM 1664 O O . LYS 39 1159 ? B -20.483 -4.447 -50.120 1.000 2 B 44.309 1 ATOM 1665 C CB . LYS 39 1159 ? B -23.054 -4.218 -48.685 1.000 2 B 44.309 1 ATOM 1666 C CG . LYS 39 1159 ? B -24.220 -3.804 -47.799 1.000 2 B 44.309 1 ATOM 1667 C CD . LYS 39 1159 ? B -24.864 -5.008 -47.123 1.000 2 B 44.309 1 ATOM 1668 C CE . LYS 39 1159 ? B -26.174 -4.634 -46.443 1.000 2 B 44.309 1 ATOM 1669 N NZ . LYS 39 1159 ? B -26.871 -5.832 -45.887 1.000 2 B 44.309 1 ATOM 1670 N N . ALA 40 1160 ? B -19.347 -4.778 -48.303 1.000 2 B 51.868 1 ATOM 1671 C CA . ALA 40 1160 ? B -18.690 -6.027 -48.680 1.000 2 B 51.868 1 ATOM 1672 C C . ALA 40 1160 ? B -17.464 -6.287 -47.809 1.000 2 B 51.868 1 ATOM 1673 O O . ALA 40 1160 ? B -16.601 -5.418 -47.666 1.000 2 B 51.868 1 ATOM 1674 C CB . ALA 40 1160 ? B -18.295 -5.996 -50.154 1.000 2 B 51.868 1 ATOM 1675 N N . LYS 41 1161 ? B -17.544 -6.854 -46.607 1.000 2 B 46.030 1 ATOM 1676 C CA . LYS 41 1161 ? B -16.638 -7.984 -46.421 1.000 2 B 46.030 1 ATOM 1677 C C . LYS 41 1161 ? B -15.739 -7.773 -45.206 1.000 2 B 46.030 1 ATOM 1678 O O . LYS 41 1161 ? B -15.119 -6.717 -45.062 1.000 2 B 46.030 1 ATOM 1679 C CB . LYS 41 1161 ? B -15.785 -8.199 -47.672 1.000 2 B 46.030 1 ATOM 1680 C CG . LYS 41 1161 ? B -15.235 -9.612 -47.811 1.000 2 B 46.030 1 ATOM 1681 C CD . LYS 41 1161 ? B -14.783 -9.898 -49.237 1.000 2 B 46.030 1 ATOM 1682 C CE . LYS 41 1161 ? B -13.897 -11.134 -49.306 1.000 2 B 46.030 1 ATOM 1683 N NZ . LYS 41 1161 ? B -13.471 -11.434 -50.706 1.000 2 B 46.030 1 ATOM 1684 N N . ARG 42 1162 ? B -16.246 -8.022 -44.000 1.000 2 B 42.922 1 ATOM 1685 C CA . ARG 42 1162 ? B -15.703 -8.776 -42.874 1.000 2 B 42.922 1 ATOM 1686 C C . ARG 42 1162 ? B -14.226 -8.460 -42.665 1.000 2 B 42.922 1 ATOM 1687 O O . ARG 42 1162 ? B -13.405 -8.682 -43.558 1.000 2 B 42.922 1 ATOM 1688 C CB . ARG 42 1162 ? B -15.892 -10.278 -43.092 1.000 2 B 42.922 1 ATOM 1689 C CG . ARG 42 1162 ? B -17.188 -10.826 -42.516 1.000 2 B 42.922 1 ATOM 1690 C CD . ARG 42 1162 ? B -17.348 -12.313 -42.800 1.000 2 B 42.922 1 ATOM 1691 N NE . ARG 42 1162 ? B -16.765 -13.130 -41.739 1.000 2 B 42.922 1 ATOM 1692 C CZ . ARG 42 1162 ? B -16.561 -14.442 -41.819 1.000 2 B 42.922 1 ATOM 1693 N NH1 . ARG 42 1162 ? B -16.889 -15.114 -42.916 1.000 2 B 42.922 1 ATOM 1694 N NH2 . ARG 42 1162 ? B -16.024 -15.087 -40.794 1.000 2 B 42.922 1 ATOM 1695 N N . ARG 43 1163 ? B -13.818 -7.374 -42.194 1.000 2 B 56.908 1 ATOM 1696 C CA . ARG 43 1163 ? B -12.448 -7.188 -41.726 1.000 2 B 56.908 1 ATOM 1697 C C . ARG 43 1163 ? B -12.425 -6.559 -40.337 1.000 2 B 56.908 1 ATOM 1698 O O . ARG 43 1163 ? B -13.178 -5.623 -40.061 1.000 2 B 56.908 1 ATOM 1699 C CB . ARG 43 1163 ? B -11.658 -6.321 -42.707 1.000 2 B 56.908 1 ATOM 1700 C CG . ARG 43 1163 ? B -10.778 -7.114 -43.661 1.000 2 B 56.908 1 ATOM 1701 C CD . ARG 43 1163 ? B -9.846 -6.208 -44.454 1.000 2 B 56.908 1 ATOM 1702 N NE . ARG 43 1163 ? B -8.444 -6.552 -44.233 1.000 2 B 56.908 1 ATOM 1703 C CZ . ARG 43 1163 ? B -7.458 -5.668 -44.108 1.000 2 B 56.908 1 ATOM 1704 N NH1 . ARG 43 1163 ? B -7.702 -4.365 -44.178 1.000 2 B 56.908 1 ATOM 1705 N NH2 . ARG 43 1163 ? B -6.218 -6.091 -43.910 1.000 2 B 56.908 1 ATOM 1706 N N . ARG 44 1164 ? B -12.542 -7.389 -39.280 1.000 2 B 48.048 1 ATOM 1707 C CA . ARG 44 1164 ? B -11.758 -7.469 -38.052 1.000 2 B 48.048 1 ATOM 1708 C C . ARG 44 1164 ? B -11.741 -6.129 -37.324 1.000 2 B 48.048 1 ATOM 1709 O O . ARG 44 1164 ? B -11.260 -5.131 -37.863 1.000 2 B 48.048 1 ATOM 1710 C CB . ARG 44 1164 ? B -10.327 -7.919 -38.355 1.000 2 B 48.048 1 ATOM 1711 C CG . ARG 44 1164 ? B -10.177 -9.423 -38.525 1.000 2 B 48.048 1 ATOM 1712 C CD . ARG 44 1164 ? B -8.719 -9.854 -38.466 1.000 2 B 48.048 1 ATOM 1713 N NE . ARG 44 1164 ? B -8.559 -11.264 -38.812 1.000 2 B 48.048 1 ATOM 1714 C CZ . ARG 44 1164 ? B -7.524 -12.019 -38.456 1.000 2 B 48.048 1 ATOM 1715 N NH1 . ARG 44 1164 ? B -6.532 -11.513 -37.733 1.000 2 B 48.048 1 ATOM 1716 N NH2 . ARG 44 1164 ? B -7.480 -13.291 -38.825 1.000 2 B 48.048 1 ATOM 1717 N N . VAL 45 1165 ? B -12.889 -5.567 -36.909 1.000 2 B 47.985 1 ATOM 1718 C CA . VAL 45 1165 ? B -12.936 -4.492 -35.924 1.000 2 B 47.985 1 ATOM 1719 C C . VAL 45 1165 ? B -11.912 -4.753 -34.823 1.000 2 B 47.985 1 ATOM 1720 O O . VAL 45 1165 ? B -11.815 -5.870 -34.308 1.000 2 B 47.985 1 ATOM 1721 C CB . VAL 45 1165 ? B -14.348 -4.343 -35.314 1.000 2 B 47.985 1 ATOM 1722 C CG1 . VAL 45 1165 ? B -14.984 -3.020 -35.740 1.000 2 B 47.985 1 ATOM 1723 C CG2 . VAL 45 1165 ? B -15.232 -5.520 -35.723 1.000 2 B 47.985 1 ATOM 1724 N N . SER 46 1166 ? B -10.667 -4.586 -35.075 1.000 2 B 46.792 1 ATOM 1725 C CA . SER 46 1166 ? B -9.688 -3.929 -34.215 1.000 2 B 46.792 1 ATOM 1726 C C . SER 46 1166 ? B -10.257 -3.676 -32.822 1.000 2 B 46.792 1 ATOM 1727 O O . SER 46 1166 ? B -11.272 -2.993 -32.675 1.000 2 B 46.792 1 ATOM 1728 C CB . SER 46 1166 ? B -9.231 -2.608 -34.835 1.000 2 B 46.792 1 ATOM 1729 O OG . SER 46 1166 ? B -10.308 -1.690 -34.915 1.000 2 B 46.792 1 ATOM 1730 N N . LYS 47 1167 ? B -10.538 -4.646 -32.056 1.000 2 B 49.627 1 ATOM 1731 C CA . LYS 47 1167 ? B -10.425 -4.967 -30.636 1.000 2 B 49.627 1 ATOM 1732 C C . LYS 47 1167 ? B -9.251 -4.230 -29.998 1.000 2 B 49.627 1 ATOM 1733 O O . LYS 47 1167 ? B -8.241 -4.845 -29.649 1.000 2 B 49.627 1 ATOM 1734 C CB . LYS 47 1167 ? B -10.268 -6.475 -30.437 1.000 2 B 49.627 1 ATOM 1735 C CG . LYS 47 1167 ? B -10.493 -6.937 -29.005 1.000 2 B 49.627 1 ATOM 1736 C CD . LYS 47 1167 ? B -11.406 -8.156 -28.948 1.000 2 B 49.627 1 ATOM 1737 C CE . LYS 47 1167 ? B -11.632 -8.619 -27.515 1.000 2 B 49.627 1 ATOM 1738 N NZ . LYS 47 1167 ? B -12.405 -9.896 -27.461 1.000 2 B 49.627 1 ATOM 1739 N N . ASP 48 1168 ? B -8.969 -3.012 -30.437 1.000 2 B 44.262 1 ATOM 1740 C CA . ASP 48 1168 ? B -8.066 -2.215 -29.613 1.000 2 B 44.262 1 ATOM 1741 C C . ASP 48 1168 ? B -8.341 -0.722 -29.782 1.000 2 B 44.262 1 ATOM 1742 O O . ASP 48 1168 ? B -7.457 0.036 -30.187 1.000 2 B 44.262 1 ATOM 1743 C CB . ASP 48 1168 ? B -6.608 -2.523 -29.962 1.000 2 B 44.262 1 ATOM 1744 C CG . ASP 48 1168 ? B -5.754 -2.811 -28.740 1.000 2 B 44.262 1 ATOM 1745 O OD1 . ASP 48 1168 ? B -6.211 -2.561 -27.604 1.000 2 B 44.262 1 ATOM 1746 O OD2 . ASP 48 1168 ? B -4.612 -3.288 -28.915 1.000 2 B 44.262 1 ATOM 1747 N N . ASP 49 1169 ? B -9.586 -0.379 -29.878 1.000 2 B 45.960 1 ATOM 1748 C CA . ASP 49 1169 ? B -9.894 1.046 -29.806 1.000 2 B 45.960 1 ATOM 1749 C C . ASP 49 1169 ? B -10.667 1.377 -28.532 1.000 2 B 45.960 1 ATOM 1750 O O . ASP 49 1169 ? B -11.821 0.971 -28.376 1.000 2 B 45.960 1 ATOM 1751 C CB . ASP 49 1169 ? B -10.693 1.484 -31.035 1.000 2 B 45.960 1 ATOM 1752 C CG . ASP 49 1169 ? B -10.068 2.663 -31.760 1.000 2 B 45.960 1 ATOM 1753 O OD1 . ASP 49 1169 ? B -9.057 3.213 -31.271 1.000 2 B 45.960 1 ATOM 1754 O OD2 . ASP 49 1169 ? B -10.592 3.048 -32.828 1.000 2 B 45.960 1 ATOM 1755 N N . TRP 50 1170 ? B -10.123 0.987 -27.358 1.000 2 B 38.116 1 ATOM 1756 C CA . TRP 50 1170 ? B -10.633 1.530 -26.103 1.000 2 B 38.116 1 ATOM 1757 C C . TRP 50 1170 ? B -11.126 2.961 -26.290 1.000 2 B 38.116 1 ATOM 1758 O O . TRP 50 1170 ? B -10.368 3.835 -26.717 1.000 2 B 38.116 1 ATOM 1759 C CB . TRP 50 1170 ? B -9.553 1.486 -25.019 1.000 2 B 38.116 1 ATOM 1760 C CG . TRP 50 1170 ? B -8.275 0.837 -25.459 1.000 2 B 38.116 1 ATOM 1761 C CD1 . TRP 50 1170 ? B -7.812 -0.398 -25.099 1.000 2 B 38.116 1 ATOM 1762 C CD2 . TRP 50 1170 ? B -7.292 1.394 -26.337 1.000 2 B 38.116 1 ATOM 1763 N NE1 . TRP 50 1170 ? B -6.600 -0.644 -25.703 1.000 2 B 38.116 1 ATOM 1764 C CE2 . TRP 50 1170 ? B -6.259 0.439 -26.467 1.000 2 B 38.116 1 ATOM 1765 C CE3 . TRP 50 1170 ? B -7.186 2.608 -27.029 1.000 2 B 38.116 1 ATOM 1766 C CZ2 . TRP 50 1170 ? B -5.132 0.662 -27.262 1.000 2 B 38.116 1 ATOM 1767 C CZ3 . TRP 50 1170 ? B -6.064 2.828 -27.820 1.000 2 B 38.116 1 ATOM 1768 C CH2 . TRP 50 1170 ? B -5.053 1.858 -27.928 1.000 2 B 38.116 1 ATOM 1769 N N . PRO 51 1171 ? B -12.397 3.218 -26.721 1.000 2 B 46.414 1 ATOM 1770 C CA . PRO 51 1171 ? B -12.915 4.582 -26.842 1.000 2 B 46.414 1 ATOM 1771 C C . PRO 51 1171 ? B -12.431 5.499 -25.721 1.000 2 B 46.414 1 ATOM 1772 O O . PRO 51 1171 ? B -12.493 5.129 -24.546 1.000 2 B 46.414 1 ATOM 1773 C CB . PRO 51 1171 ? B -14.432 4.390 -26.774 1.000 2 B 46.414 1 ATOM 1774 C CG . PRO 51 1171 ? B -14.620 3.062 -26.113 1.000 2 B 46.414 1 ATOM 1775 C CD . PRO 51 1171 ? B -13.268 2.504 -25.772 1.000 2 B 46.414 1 ATOM 1776 N N . GLU 52 1172 ? B -11.224 6.035 -25.746 1.000 2 B 52.298 1 ATOM 1777 C CA . GLU 52 1172 ? B -11.081 7.463 -25.475 1.000 2 B 52.298 1 ATOM 1778 C C . GLU 52 1172 ? B -12.408 8.194 -25.652 1.000 2 B 52.298 1 ATOM 1779 O O . GLU 52 1172 ? B -12.523 9.375 -25.316 1.000 2 B 52.298 1 ATOM 1780 C CB . GLU 52 1172 ? B -10.015 8.079 -26.384 1.000 2 B 52.298 1 ATOM 1781 C CG . GLU 52 1172 ? B -9.096 9.062 -25.676 1.000 2 B 52.298 1 ATOM 1782 C CD . GLU 52 1172 ? B -8.218 9.857 -26.629 1.000 2 B 52.298 1 ATOM 1783 O OE1 . GLU 52 1172 ? B -7.725 10.941 -26.240 1.000 2 B 52.298 1 ATOM 1784 O OE2 . GLU 52 1172 ? B -8.022 9.394 -27.775 1.000 2 B 52.298 1 ATOM 1785 N N . ARG 53 1173 ? B -13.645 7.524 -25.511 1.000 2 B 49.318 1 ATOM 1786 C CA . ARG 53 1173 ? B -14.841 8.357 -25.587 1.000 2 B 49.318 1 ATOM 1787 C C . ARG 53 1173 ? B -15.616 8.322 -24.275 1.000 2 B 49.318 1 ATOM 1788 O O . ARG 53 1173 ? B -15.824 7.252 -23.699 1.000 2 B 49.318 1 ATOM 1789 C CB . ARG 53 1173 ? B -15.740 7.905 -26.740 1.000 2 B 49.318 1 ATOM 1790 C CG . ARG 53 1173 ? B -16.629 9.005 -27.296 1.000 2 B 49.318 1 ATOM 1791 C CD . ARG 53 1173 ? B -17.603 8.471 -28.337 1.000 2 B 49.318 1 ATOM 1792 N NE . ARG 53 1173 ? B -16.975 8.348 -29.650 1.000 2 B 49.318 1 ATOM 1793 C CZ . ARG 53 1173 ? B -17.419 8.931 -30.760 1.000 2 B 49.318 1 ATOM 1794 N NH1 . ARG 53 1173 ? B -18.508 9.691 -30.738 1.000 2 B 49.318 1 ATOM 1795 N NH2 . ARG 53 1173 ? B -16.771 8.752 -31.902 1.000 2 B 49.318 1 ATOM 1796 N N . GLU 54 1174 ? B -15.185 8.865 -23.092 1.000 2 B 47.000 1 ATOM 1797 C CA . GLU 54 1174 ? B -16.026 9.773 -22.317 1.000 2 B 47.000 1 ATOM 1798 C C . GLU 54 1174 ? B -16.529 9.105 -21.041 1.000 2 B 47.000 1 ATOM 1799 O O . GLU 54 1174 ? B -17.334 8.173 -21.097 1.000 2 B 47.000 1 ATOM 1800 C CB . GLU 54 1174 ? B -17.210 10.259 -23.158 1.000 2 B 47.000 1 ATOM 1801 C CG . GLU 54 1174 ? B -17.087 11.705 -23.616 1.000 2 B 47.000 1 ATOM 1802 C CD . GLU 54 1174 ? B -17.099 11.859 -25.128 1.000 2 B 47.000 1 ATOM 1803 O OE1 . GLU 54 1174 ? B -16.678 12.924 -25.633 1.000 2 B 47.000 1 ATOM 1804 O OE2 . GLU 54 1174 ? B -17.535 10.907 -25.813 1.000 2 B 47.000 1 ATOM 1805 N N . MET 55 1175 ? B -15.730 8.565 -20.095 1.000 2 B 44.452 1 ATOM 1806 C CA . MET 55 1175 ? B -16.236 8.621 -18.726 1.000 2 B 44.452 1 ATOM 1807 C C . MET 55 1175 ? B -16.384 10.065 -18.260 1.000 2 B 44.452 1 ATOM 1808 O O . MET 55 1175 ? B -15.390 10.736 -17.976 1.000 2 B 44.452 1 ATOM 1809 C CB . MET 55 1175 ? B -15.309 7.858 -17.778 1.000 2 B 44.452 1 ATOM 1810 C CG . MET 55 1175 ? B -15.809 6.467 -17.421 1.000 2 B 44.452 1 ATOM 1811 S SD . MET 55 1175 ? B -15.423 5.227 -18.718 1.000 2 B 44.452 1 ATOM 1812 C CE . MET 55 1175 ? B -14.109 4.293 -17.887 1.000 2 B 44.452 1 ATOM 1813 N N . THR 56 1176 ? B -16.884 10.967 -19.187 1.000 2 B 45.557 1 ATOM 1814 C CA . THR 56 1176 ? B -17.612 12.125 -18.681 1.000 2 B 45.557 1 ATOM 1815 C C . THR 56 1176 ? B -18.675 11.698 -17.674 1.000 2 B 45.557 1 ATOM 1816 O O . THR 56 1176 ? B -19.432 10.758 -17.924 1.000 2 B 45.557 1 ATOM 1817 C CB . THR 56 1176 ? B -18.273 12.913 -19.827 1.000 2 B 45.557 1 ATOM 1818 O OG1 . THR 56 1176 ? B -18.446 12.048 -20.957 1.000 2 B 45.557 1 ATOM 1819 C CG2 . THR 56 1176 ? B -17.417 14.106 -20.241 1.000 2 B 45.557 1 ATOM 1820 N N . ASN 57 1177 ? B -18.379 11.166 -16.444 1.000 2 B 46.416 1 ATOM 1821 C CA . ASN 57 1177 ? B -19.252 11.359 -15.291 1.000 2 B 46.416 1 ATOM 1822 C C . ASN 57 1177 ? B -20.394 12.320 -15.608 1.000 2 B 46.416 1 ATOM 1823 O O . ASN 57 1177 ? B -20.182 13.528 -15.723 1.000 2 B 46.416 1 ATOM 1824 C CB . ASN 57 1177 ? B -18.451 11.865 -14.090 1.000 2 B 46.416 1 ATOM 1825 C CG . ASN 57 1177 ? B -17.239 11.005 -13.791 1.000 2 B 46.416 1 ATOM 1826 O OD1 . ASN 57 1177 ? B -17.256 9.790 -14.007 1.000 2 B 46.416 1 ATOM 1827 N ND2 . ASN 57 1177 ? B -16.177 11.628 -13.294 1.000 2 B 46.416 1 ATOM 1828 N N . SER 58 1178 ? B -21.109 12.037 -16.624 1.000 2 B 32.773 1 ATOM 1829 C CA . SER 58 1178 ? B -22.516 12.421 -16.603 1.000 2 B 32.773 1 ATOM 1830 C C . SER 58 1178 ? B -23.294 11.615 -15.569 1.000 2 B 32.773 1 ATOM 1831 O O . SER 58 1178 ? B -23.543 10.423 -15.762 1.000 2 B 32.773 1 ATOM 1832 C CB . SER 58 1178 ? B -23.144 12.232 -17.985 1.000 2 B 32.773 1 ATOM 1833 O OG . SER 58 1178 ? B -22.406 12.931 -18.973 1.000 2 B 32.773 1 ATOM 1834 N N . SER 59 1179 ? B -22.978 11.532 -14.211 1.000 2 B 47.016 1 ATOM 1835 C CA . SER 59 1179 ? B -24.114 11.427 -13.301 1.000 2 B 47.016 1 ATOM 1836 C C . SER 59 1179 ? B -24.824 12.767 -13.146 1.000 2 B 47.016 1 ATOM 1837 O O . SER 59 1179 ? B -24.183 13.792 -12.906 1.000 2 B 47.016 1 ATOM 1838 C CB . SER 59 1179 ? B -23.658 10.921 -11.931 1.000 2 B 47.016 1 ATOM 1839 O OG . SER 59 1179 ? B -23.247 12.000 -11.108 1.000 2 B 47.016 1 ATOM 1840 N N . SER 60 1180 ? B -25.530 13.188 -14.105 1.000 2 B 42.586 1 ATOM 1841 C CA . SER 60 1180 ? B -26.913 13.616 -14.290 1.000 2 B 42.586 1 ATOM 1842 C C . SER 60 1180 ? B -27.560 13.983 -12.959 1.000 2 B 42.586 1 ATOM 1843 O O . SER 60 1180 ? B -27.516 13.203 -12.005 1.000 2 B 42.586 1 ATOM 1844 C CB . SER 60 1180 ? B -27.727 12.518 -14.977 1.000 2 B 42.586 1 ATOM 1845 O OG . SER 60 1180 ? B -29.115 12.781 -14.871 1.000 2 B 42.586 1 ATOM 1846 N N . ASN 61 1181 ? B -27.294 15.083 -12.314 1.000 2 B 38.811 1 ATOM 1847 C CA . ASN 61 1181 ? B -28.295 15.964 -11.721 1.000 2 B 38.811 1 ATOM 1848 C C . ASN 61 1181 ? B -27.771 16.637 -10.456 1.000 2 B 38.811 1 ATOM 1849 O O . ASN 61 1181 ? B -27.684 16.004 -9.402 1.000 2 B 38.811 1 ATOM 1850 C CB . ASN 61 1181 ? B -29.579 15.190 -11.418 1.000 2 B 38.811 1 ATOM 1851 C CG . ASN 61 1181 ? B -30.657 15.416 -12.460 1.000 2 B 38.811 1 ATOM 1852 O OD1 . ASN 61 1181 ? B -31.137 16.538 -12.641 1.000 2 B 38.811 1 ATOM 1853 N ND2 . ASN 61 1181 ? B -31.043 14.352 -13.154 1.000 2 B 38.811 1 ATOM 1854 N N . HIS 62 1182 ? B -26.842 17.603 -10.449 1.000 2 B 40.327 1 ATOM 1855 C CA . HIS 62 1182 ? B -27.199 18.596 -9.442 1.000 2 B 40.327 1 ATOM 1856 C C . HIS 62 1182 ? B -26.720 19.986 -9.847 1.000 2 B 40.327 1 ATOM 1857 O O . HIS 62 1182 ? B -25.515 20.227 -9.948 1.000 2 B 40.327 1 ATOM 1858 C CB . HIS 62 1182 ? B -26.613 18.214 -8.082 1.000 2 B 40.327 1 ATOM 1859 C CG . HIS 62 1182 ? B -27.005 19.144 -6.978 1.000 2 B 40.327 1 ATOM 1860 N ND1 . HIS 62 1182 ? B -26.307 20.298 -6.694 1.000 2 B 40.327 1 ATOM 1861 C CD2 . HIS 62 1182 ? B -28.025 19.089 -6.089 1.000 2 B 40.327 1 ATOM 1862 C CE1 . HIS 62 1182 ? B -26.883 20.914 -5.675 1.000 2 B 40.327 1 ATOM 1863 N NE2 . HIS 62 1182 ? B -27.927 20.201 -5.290 1.000 2 B 40.327 1 ATOM 1864 N N . LEU 63 1183 ? B -26.885 20.451 -11.088 1.000 2 B 40.841 1 ATOM 1865 C CA . LEU 63 1183 ? B -27.205 21.816 -11.492 1.000 2 B 40.841 1 ATOM 1866 C C . LEU 63 1183 ? B -27.457 22.698 -10.273 1.000 2 B 40.841 1 ATOM 1867 O O . LEU 63 1183 ? B -28.252 22.345 -9.400 1.000 2 B 40.841 1 ATOM 1868 C CB . LEU 63 1183 ? B -28.430 21.831 -12.409 1.000 2 B 40.841 1 ATOM 1869 C CG . LEU 63 1183 ? B -28.620 23.084 -13.266 1.000 2 B 40.841 1 ATOM 1870 C CD1 . LEU 63 1183 ? B -27.611 23.102 -14.410 1.000 2 B 40.841 1 ATOM 1871 C CD2 . LEU 63 1183 ? B -30.045 23.154 -13.803 1.000 2 B 40.841 1 ATOM 1872 N N . GLU 64 1184 ? B -26.517 23.075 -9.366 1.000 2 B 40.351 1 ATOM 1873 C CA . GLU 64 1184 ? B -26.540 24.386 -8.725 1.000 2 B 40.351 1 ATOM 1874 C C . GLU 64 1184 ? B -25.539 24.456 -7.576 1.000 2 B 40.351 1 ATOM 1875 O O . GLU 64 1184 ? B -25.563 23.618 -6.672 1.000 2 B 40.351 1 ATOM 1876 C CB . GLU 64 1184 ? B -27.947 24.712 -8.218 1.000 2 B 40.351 1 ATOM 1877 C CG . GLU 64 1184 ? B -28.957 24.967 -9.327 1.000 2 B 40.351 1 ATOM 1878 C CD . GLU 64 1184 ? B -29.521 26.379 -9.312 1.000 2 B 40.351 1 ATOM 1879 O OE1 . GLU 64 1184 ? B -29.781 26.940 -10.400 1.000 2 B 40.351 1 ATOM 1880 O OE2 . GLU 64 1184 ? B -29.704 26.928 -8.202 1.000 2 B 40.351 1 ATOM 1881 N N . ASP 65 1185 ? B -24.227 24.467 -7.787 1.000 2 B 43.771 1 ATOM 1882 C CA . ASP 65 1185 ? B -23.459 25.376 -6.942 1.000 2 B 43.771 1 ATOM 1883 C C . ASP 65 1185 ? B -21.969 25.047 -6.993 1.000 2 B 43.771 1 ATOM 1884 O O . ASP 65 1185 ? B -21.555 23.953 -6.602 1.000 2 B 43.771 1 ATOM 1885 C CB . ASP 65 1185 ? B -23.961 25.319 -5.498 1.000 2 B 43.771 1 ATOM 1886 C CG . ASP 65 1185 ? B -24.751 26.552 -5.095 1.000 2 B 43.771 1 ATOM 1887 O OD1 . ASP 65 1185 ? B -24.783 27.535 -5.867 1.000 2 B 43.771 1 ATOM 1888 O OD2 . ASP 65 1185 ? B -25.345 26.542 -3.996 1.000 2 B 43.771 1 ATOM 1889 N N . PRO 66 1186 ? B -21.243 25.518 -7.985 1.000 2 B 49.717 1 ATOM 1890 C CA . PRO 66 1186 ? B -19.814 25.504 -8.307 1.000 2 B 49.717 1 ATOM 1891 C C . PRO 66 1186 ? B -18.930 25.702 -7.078 1.000 2 B 49.717 1 ATOM 1892 O O . PRO 66 1186 ? B -17.712 25.520 -7.153 1.000 2 B 49.717 1 ATOM 1893 C CB . PRO 66 1186 ? B -19.662 26.674 -9.283 1.000 2 B 49.717 1 ATOM 1894 C CG . PRO 66 1186 ? B -21.015 26.838 -9.896 1.000 2 B 49.717 1 ATOM 1895 C CD . PRO 66 1186 ? B -22.051 26.521 -8.856 1.000 2 B 49.717 1 ATOM 1896 N N . HIS 67 1187 ? B -19.478 25.451 -5.847 1.000 2 B 44.801 1 ATOM 1897 C CA . HIS 67 1187 ? B -18.574 25.657 -4.721 1.000 2 B 44.801 1 ATOM 1898 C C . HIS 67 1187 ? B -18.441 24.391 -3.881 1.000 2 B 44.801 1 ATOM 1899 O O . HIS 67 1187 ? B -18.028 24.452 -2.721 1.000 2 B 44.801 1 ATOM 1900 C CB . HIS 67 1187 ? B -19.060 26.817 -3.849 1.000 2 B 44.801 1 ATOM 1901 C CG . HIS 67 1187 ? B -18.473 28.139 -4.229 1.000 2 B 44.801 1 ATOM 1902 N ND1 . HIS 67 1187 ? B -17.268 28.588 -3.734 1.000 2 B 44.801 1 ATOM 1903 C CD2 . HIS 67 1187 ? B -18.927 29.108 -5.058 1.000 2 B 44.801 1 ATOM 1904 C CE1 . HIS 67 1187 ? B -17.006 29.780 -4.244 1.000 2 B 44.801 1 ATOM 1905 N NE2 . HIS 67 1187 ? B -17.997 30.118 -5.050 1.000 2 B 44.801 1 ATOM 1906 N N . TYR 68 1188 ? B -18.698 23.104 -4.418 1.000 2 B 43.906 1 ATOM 1907 C CA . TYR 68 1188 ? B -18.450 21.962 -3.546 1.000 2 B 43.906 1 ATOM 1908 C C . TYR 68 1188 ? B -17.159 21.251 -3.934 1.000 2 B 43.906 1 ATOM 1909 O O . TYR 68 1188 ? B -16.703 20.349 -3.227 1.000 2 B 43.906 1 ATOM 1910 C CB . TYR 68 1188 ? B -19.623 20.979 -3.600 1.000 2 B 43.906 1 ATOM 1911 C CG . TYR 68 1188 ? B -20.776 21.360 -2.702 1.000 2 B 43.906 1 ATOM 1912 C CD1 . TYR 68 1188 ? B -20.839 20.906 -1.387 1.000 2 B 43.906 1 ATOM 1913 C CD2 . TYR 68 1188 ? B -21.803 22.173 -3.168 1.000 2 B 43.906 1 ATOM 1914 C CE1 . TYR 68 1188 ? B -21.900 21.252 -0.557 1.000 2 B 43.906 1 ATOM 1915 C CE2 . TYR 68 1188 ? B -22.869 22.526 -2.346 1.000 2 B 43.906 1 ATOM 1916 C CZ . TYR 68 1188 ? B -22.908 22.062 -1.045 1.000 2 B 43.906 1 ATOM 1917 O OH . TYR 68 1188 ? B -23.961 22.408 -0.227 1.000 2 B 43.906 1 ATOM 1918 N N . SER 69 1189 ? B -16.313 21.773 -4.858 1.000 2 B 51.498 1 ATOM 1919 C CA . SER 69 1189 ? B -15.081 21.119 -5.287 1.000 2 B 51.498 1 ATOM 1920 C C . SER 69 1189 ? B -13.877 21.646 -4.514 1.000 2 B 51.498 1 ATOM 1921 O O . SER 69 1189 ? B -12.787 21.075 -4.587 1.000 2 B 51.498 1 ATOM 1922 C CB . SER 69 1189 ? B -14.861 21.319 -6.787 1.000 2 B 51.498 1 ATOM 1923 O OG . SER 69 1189 ? B -14.474 22.654 -7.065 1.000 2 B 51.498 1 ATOM 1924 N N . GLU 70 1190 ? B -14.151 22.680 -3.599 1.000 2 B 47.857 1 ATOM 1925 C CA . GLU 70 1190 ? B -12.926 23.349 -3.170 1.000 2 B 47.857 1 ATOM 1926 C C . GLU 70 1190 ? B -12.389 22.740 -1.877 1.000 2 B 47.857 1 ATOM 1927 O O . GLU 70 1190 ? B -11.178 22.728 -1.647 1.000 2 B 47.857 1 ATOM 1928 C CB . GLU 70 1190 ? B -13.170 24.848 -2.983 1.000 2 B 47.857 1 ATOM 1929 C CG . GLU 70 1190 ? B -13.302 25.617 -4.290 1.000 2 B 47.857 1 ATOM 1930 C CD . GLU 70 1190 ? B -13.844 27.025 -4.106 1.000 2 B 47.857 1 ATOM 1931 O OE1 . GLU 70 1190 ? B -14.169 27.688 -5.117 1.000 2 B 47.857 1 ATOM 1932 O OE2 . GLU 70 1190 ? B -13.944 27.470 -2.941 1.000 2 B 47.857 1 ATOM 1933 N N . LEU 71 1191 ? B -12.530 21.462 -1.550 1.000 2 B 50.634 1 ATOM 1934 C CA . LEU 71 1191 ? B -11.539 20.749 -0.752 1.000 2 B 50.634 1 ATOM 1935 C C . LEU 71 1191 ? B -12.093 19.416 -0.260 1.000 2 B 50.634 1 ATOM 1936 O O . LEU 71 1191 ? B -11.595 18.854 0.718 1.000 2 B 50.634 1 ATOM 1937 C CB . LEU 71 1191 ? B -11.096 21.602 0.440 1.000 2 B 50.634 1 ATOM 1938 C CG . LEU 71 1191 ? B -10.278 22.852 0.112 1.000 2 B 50.634 1 ATOM 1939 C CD1 . LEU 71 1191 ? B -10.744 24.028 0.963 1.000 2 B 50.634 1 ATOM 1940 C CD2 . LEU 71 1191 ? B -8.791 22.589 0.323 1.000 2 B 50.634 1 ATOM 1941 N N . THR 72 1192 ? B -12.981 18.717 -1.057 1.000 2 B 60.598 1 ATOM 1942 C CA . THR 72 1192 ? B -13.570 17.493 -0.525 1.000 2 B 60.598 1 ATOM 1943 C C . THR 72 1192 ? B -12.632 16.307 -0.729 1.000 2 B 60.598 1 ATOM 1944 O O . THR 72 1192 ? B -12.671 15.340 0.034 1.000 2 B 60.598 1 ATOM 1945 C CB . THR 72 1192 ? B -14.929 17.195 -1.185 1.000 2 B 60.598 1 ATOM 1946 O OG1 . THR 72 1192 ? B -14.759 17.124 -2.606 1.000 2 B 60.598 1 ATOM 1947 C CG2 . THR 72 1192 ? B -15.948 18.283 -0.861 1.000 2 B 60.598 1 ATOM 1948 N N . ASN 73 1193 ? B -11.581 16.520 -1.580 1.000 2 B 64.831 1 ATOM 1949 C CA . ASN 73 1193 ? B -10.749 15.347 -1.825 1.000 2 B 64.831 1 ATOM 1950 C C . ASN 73 1193 ? B -9.312 15.572 -1.365 1.000 2 B 64.831 1 ATOM 1951 O O . ASN 73 1193 ? B -8.686 16.567 -1.735 1.000 2 B 64.831 1 ATOM 1952 C CB . ASN 73 1193 ? B -10.779 14.968 -3.307 1.000 2 B 64.831 1 ATOM 1953 C CG . ASN 73 1193 ? B -12.162 14.564 -3.779 1.000 2 B 64.831 1 ATOM 1954 O OD1 . ASN 73 1193 ? B -12.863 13.803 -3.107 1.000 2 B 64.831 1 ATOM 1955 N ND2 . ASN 73 1193 ? B -12.565 15.071 -4.938 1.000 2 B 64.831 1 ATOM 1956 N N . LEU 74 1194 ? B -9.059 15.223 -0.144 1.000 2 B 74.552 1 ATOM 1957 C CA . LEU 74 1194 ? B -7.687 15.208 0.352 1.000 2 B 74.552 1 ATOM 1958 C C . LEU 74 1194 ? B -6.875 14.111 -0.328 1.000 2 B 74.552 1 ATOM 1959 O O . LEU 74 1194 ? B -7.269 12.943 -0.316 1.000 2 B 74.552 1 ATOM 1960 C CB . LEU 74 1194 ? B -7.669 15.007 1.870 1.000 2 B 74.552 1 ATOM 1961 C CG . LEU 74 1194 ? B -6.649 15.837 2.651 1.000 2 B 74.552 1 ATOM 1962 C CD1 . LEU 74 1194 ? B -7.362 16.800 3.595 1.000 2 B 74.552 1 ATOM 1963 C CD2 . LEU 74 1194 ? B -5.699 14.929 3.423 1.000 2 B 74.552 1 ATOM 1964 N N . LYS 75 1195 ? B -5.906 14.523 -1.142 1.000 2 B 80.522 1 ATOM 1965 C CA . LYS 75 1195 ? B -4.975 13.605 -1.792 1.000 2 B 80.522 1 ATOM 1966 C C . LYS 75 1195 ? B -3.713 13.416 -0.955 1.000 2 B 80.522 1 ATOM 1967 O O . LYS 75 1195 ? B -3.046 14.390 -0.600 1.000 2 B 80.522 1 ATOM 1968 C CB . LYS 75 1195 ? B -4.608 14.112 -3.187 1.000 2 B 80.522 1 ATOM 1969 C CG . LYS 75 1195 ? B -5.746 14.035 -4.194 1.000 2 B 80.522 1 ATOM 1970 C CD . LYS 75 1195 ? B -5.323 14.563 -5.558 1.000 2 B 80.522 1 ATOM 1971 C CE . LYS 75 1195 ? B -4.729 13.460 -6.425 1.000 2 B 80.522 1 ATOM 1972 N NZ . LYS 75 1195 ? B -4.491 13.923 -7.825 1.000 2 B 80.522 1 ATOM 1973 N N . VAL 76 1196 ? B -3.578 12.284 -0.420 1.000 2 B 81.339 1 ATOM 1974 C CA . VAL 76 1196 ? B -2.387 11.935 0.348 1.000 2 B 81.339 1 ATOM 1975 C C . VAL 76 1196 ? B -1.473 11.046 -0.492 1.000 2 B 81.339 1 ATOM 1976 O O . VAL 76 1196 ? B -1.929 10.077 -1.103 1.000 2 B 81.339 1 ATOM 1977 C CB . VAL 76 1196 ? B -2.752 11.226 1.671 1.000 2 B 81.339 1 ATOM 1978 C CG1 . VAL 76 1196 ? B -1.493 10.872 2.460 1.000 2 B 81.339 1 ATOM 1979 C CG2 . VAL 76 1196 ? B -3.682 12.104 2.507 1.000 2 B 81.339 1 ATOM 1980 N N . CYS 77 1197 ? B -0.192 11.470 -0.639 1.000 2 B 81.277 1 ATOM 1981 C CA . CYS 77 1197 ? B 0.829 10.703 -1.344 1.000 2 B 81.277 1 ATOM 1982 C C . CYS 77 1197 ? B 1.788 10.040 -0.362 1.000 2 B 81.277 1 ATOM 1983 O O . CYS 77 1197 ? B 2.371 10.711 0.491 1.000 2 B 81.277 1 ATOM 1984 C CB . CYS 77 1197 ? B 1.608 11.603 -2.303 1.000 2 B 81.277 1 ATOM 1985 S SG . CYS 77 1197 ? B 0.583 12.366 -3.580 1.000 2 B 81.277 1 ATOM 1986 N N . ILE 78 1198 ? B 1.772 8.720 -0.306 1.000 2 B 79.133 1 ATOM 1987 C CA . ILE 78 1198 ? B 2.695 7.960 0.531 1.000 2 B 79.133 1 ATOM 1988 C C . ILE 78 1198 ? B 3.870 7.469 -0.311 1.000 2 B 79.133 1 ATOM 1989 O O . ILE 78 1198 ? B 3.685 6.707 -1.262 1.000 2 B 79.133 1 ATOM 1990 C CB . ILE 78 1198 ? B 1.988 6.767 1.213 1.000 2 B 79.133 1 ATOM 1991 C CG1 . ILE 78 1198 ? B 0.788 7.255 2.032 1.000 2 B 79.133 1 ATOM 1992 C CG2 . ILE 78 1198 ? B 2.971 5.988 2.091 1.000 2 B 79.133 1 ATOM 1993 C CD1 . ILE 78 1198 ? B -0.126 6.137 2.516 1.000 2 B 79.133 1 ATOM 1994 N N . GLU 79 1199 ? B 5.066 8.161 -0.152 1.000 2 B 81.482 1 ATOM 1995 C CA . GLU 79 1199 ? B 6.293 7.785 -0.848 1.000 2 B 81.482 1 ATOM 1996 C C . GLU 79 1199 ? B 6.844 6.464 -0.320 1.000 2 B 81.482 1 ATOM 1997 O O . GLU 79 1199 ? B 6.928 6.261 0.893 1.000 2 B 81.482 1 ATOM 1998 C CB . GLU 79 1199 ? B 7.347 8.887 -0.713 1.000 2 B 81.482 1 ATOM 1999 C CG . GLU 79 1199 ? B 6.954 10.199 -1.376 1.000 2 B 81.482 1 ATOM 2000 C CD . GLU 79 1199 ? B 7.978 11.304 -1.173 1.000 2 B 81.482 1 ATOM 2001 O OE1 . GLU 79 1199 ? B 7.758 12.434 -1.666 1.000 2 B 81.482 1 ATOM 2002 O OE2 . GLU 79 1199 ? B 9.010 11.038 -0.517 1.000 2 B 81.482 1 ATOM 2003 N N . LEU 80 1200 ? B 6.848 5.494 -1.163 1.000 2 B 72.698 1 ATOM 2004 C CA . LEU 80 1200 ? B 7.392 4.185 -0.818 1.000 2 B 72.698 1 ATOM 2005 C C . LEU 80 1200 ? B 8.915 4.193 -0.890 1.000 2 B 72.698 1 ATOM 2006 O O . LEU 80 1200 ? B 9.497 3.720 -1.869 1.000 2 B 72.698 1 ATOM 2007 C CB . LEU 80 1200 ? B 6.831 3.109 -1.752 1.000 2 B 72.698 1 ATOM 2008 C CG . LEU 80 1200 ? B 5.309 2.953 -1.771 1.000 2 B 72.698 1 ATOM 2009 C CD1 . LEU 80 1200 ? B 4.890 1.977 -2.865 1.000 2 B 72.698 1 ATOM 2010 C CD2 . LEU 80 1200 ? B 4.802 2.490 -0.410 1.000 2 B 72.698 1 ATOM 2011 N N . THR 81 1201 ? B 9.513 5.232 -0.190 1.000 2 B 65.083 1 ATOM 2012 C CA . THR 81 1201 ? B 10.966 5.339 -0.125 1.000 2 B 65.083 1 ATOM 2013 C C . THR 81 1201 ? B 11.550 4.250 0.770 1.000 2 B 65.083 1 ATOM 2014 O O . THR 81 1201 ? B 10.942 3.873 1.775 1.000 2 B 65.083 1 ATOM 2015 C CB . THR 81 1201 ? B 11.401 6.722 0.395 1.000 2 B 65.083 1 ATOM 2016 O OG1 . THR 81 1201 ? B 10.840 6.936 1.696 1.000 2 B 65.083 1 ATOM 2017 C CG2 . THR 81 1201 ? B 10.931 7.833 -0.538 1.000 2 B 65.083 1 ATOM 2018 N N . GLY 82 1202 ? B 12.211 3.192 0.251 1.000 2 B 59.418 1 ATOM 2019 C CA . GLY 82 1202 ? B 12.929 2.099 0.887 1.000 2 B 59.418 1 ATOM 2020 C C . GLY 82 1202 ? B 12.424 0.731 0.470 1.000 2 B 59.418 1 ATOM 2021 O O . GLY 82 1202 ? B 12.829 -0.286 1.038 1.000 2 B 59.418 1 ATOM 2022 N N . LEU 83 1203 ? B 11.300 0.804 -0.354 1.000 2 B 53.913 1 ATOM 2023 C CA . LEU 83 1203 ? B 10.830 -0.460 -0.909 1.000 2 B 53.913 1 ATOM 2024 C C . LEU 83 1203 ? B 11.414 -0.694 -2.299 1.000 2 B 53.913 1 ATOM 2025 O O . LEU 83 1203 ? B 10.682 -1.008 -3.240 1.000 2 B 53.913 1 ATOM 2026 C CB . LEU 83 1203 ? B 9.301 -0.482 -0.976 1.000 2 B 53.913 1 ATOM 2027 C CG . LEU 83 1203 ? B 8.566 -0.574 0.362 1.000 2 B 53.913 1 ATOM 2028 C CD1 . LEU 83 1203 ? B 7.069 -0.363 0.160 1.000 2 B 53.913 1 ATOM 2029 C CD2 . LEU 83 1203 ? B 8.836 -1.918 1.031 1.000 2 B 53.913 1 ATOM 2030 N N . HIS 84 1204 ? B 12.537 0.056 -2.662 1.000 2 B 54.399 1 ATOM 2031 C CA . HIS 84 1204 ? B 13.238 -0.243 -3.906 1.000 2 B 54.399 1 ATOM 2032 C C . HIS 84 1204 ? B 13.669 -1.705 -3.959 1.000 2 B 54.399 1 ATOM 2033 O O . HIS 84 1204 ? B 14.290 -2.207 -3.019 1.000 2 B 54.399 1 ATOM 2034 C CB . HIS 84 1204 ? B 14.455 0.670 -4.068 1.000 2 B 54.399 1 ATOM 2035 C CG . HIS 84 1204 ? B 14.914 0.811 -5.484 1.000 2 B 54.399 1 ATOM 2036 N ND1 . HIS 84 1204 ? B 15.408 -0.247 -6.216 1.000 2 B 54.399 1 ATOM 2037 C CD2 . HIS 84 1204 ? B 14.952 1.889 -6.303 1.000 2 B 54.399 1 ATOM 2038 C CE1 . HIS 84 1204 ? B 15.731 0.175 -7.427 1.000 2 B 54.399 1 ATOM 2039 N NE2 . HIS 84 1204 ? B 15.464 1.467 -7.506 1.000 2 B 54.399 1 ATOM 2040 N N . PRO 85 1205 ? B 12.943 -2.497 -4.665 1.000 2 B 54.023 1 ATOM 2041 C CA . PRO 85 1205 ? B 13.337 -3.901 -4.803 1.000 2 B 54.023 1 ATOM 2042 C C . PRO 85 1205 ? B 14.851 -4.094 -4.772 1.000 2 B 54.023 1 ATOM 2043 O O . PRO 85 1205 ? B 15.331 -5.226 -4.664 1.000 2 B 54.023 1 ATOM 2044 C CB . PRO 85 1205 ? B 12.763 -4.296 -6.166 1.000 2 B 54.023 1 ATOM 2045 C CG . PRO 85 1205 ? B 12.303 -3.011 -6.774 1.000 2 B 54.023 1 ATOM 2046 C CD . PRO 85 1205 ? B 12.401 -1.930 -5.735 1.000 2 B 54.023 1 ATOM 2047 N N . LYS 86 1206 ? B 15.673 -2.930 -4.829 1.000 2 B 60.868 1 ATOM 2048 C CA . LYS 86 1206 ? B 17.094 -3.192 -5.037 1.000 2 B 60.868 1 ATOM 2049 C C . LYS 86 1206 ? B 17.770 -3.623 -3.739 1.000 2 B 60.868 1 ATOM 2050 O O . LYS 86 1206 ? B 18.687 -4.447 -3.754 1.000 2 B 60.868 1 ATOM 2051 C CB . LYS 86 1206 ? B 17.791 -1.954 -5.604 1.000 2 B 60.868 1 ATOM 2052 C CG . LYS 86 1206 ? B 19.075 -2.258 -6.361 1.000 2 B 60.868 1 ATOM 2053 C CD . LYS 86 1206 ? B 19.677 -0.998 -6.969 1.000 2 B 60.868 1 ATOM 2054 C CE . LYS 86 1206 ? B 21.080 -1.250 -7.505 1.000 2 B 60.868 1 ATOM 2055 N NZ . LYS 86 1206 ? B 21.491 -0.209 -8.494 1.000 2 B 60.868 1 ATOM 2056 N N . LYS 87 1207 ? B 17.131 -3.361 -2.563 1.000 2 B 52.315 1 ATOM 2057 C CA . LYS 87 1207 ? B 17.804 -3.754 -1.329 1.000 2 B 52.315 1 ATOM 2058 C C . LYS 87 1207 ? B 16.994 -4.801 -0.570 1.000 2 B 52.315 1 ATOM 2059 O O . LYS 87 1207 ? B 17.324 -5.145 0.567 1.000 2 B 52.315 1 ATOM 2060 C CB . LYS 87 1207 ? B 18.049 -2.534 -0.439 1.000 2 B 52.315 1 ATOM 2061 C CG . LYS 87 1207 ? B 19.000 -1.510 -1.039 1.000 2 B 52.315 1 ATOM 2062 C CD . LYS 87 1207 ? B 19.257 -0.355 -0.080 1.000 2 B 52.315 1 ATOM 2063 C CE . LYS 87 1207 ? B 20.167 0.696 -0.699 1.000 2 B 52.315 1 ATOM 2064 N NZ . LYS 87 1207 ? B 20.410 1.838 0.233 1.000 2 B 52.315 1 ATOM 2065 N N . GLN 88 1208 ? B 16.136 -5.495 -1.248 1.000 2 B 56.674 1 ATOM 2066 C CA . GLN 88 1208 ? B 15.350 -6.390 -0.405 1.000 2 B 56.674 1 ATOM 2067 C C . GLN 88 1208 ? B 15.748 -7.846 -0.627 1.000 2 B 56.674 1 ATOM 2068 O O . GLN 88 1208 ? B 15.257 -8.495 -1.553 1.000 2 B 56.674 1 ATOM 2069 C CB . GLN 88 1208 ? B 13.855 -6.207 -0.674 1.000 2 B 56.674 1 ATOM 2070 C CG . GLN 88 1208 ? B 13.176 -5.225 0.270 1.000 2 B 56.674 1 ATOM 2071 C CD . GLN 88 1208 ? B 11.675 -5.432 0.353 1.000 2 B 56.674 1 ATOM 2072 O OE1 . GLN 88 1208 ? B 11.060 -5.983 -0.565 1.000 2 B 56.674 1 ATOM 2073 N NE2 . GLN 88 1208 ? B 11.075 -4.992 1.454 1.000 2 B 56.674 1 ATOM 2074 N N . ARG 89 1209 ? B 17.050 -8.086 -0.527 1.000 2 B 61.788 1 ATOM 2075 C CA . ARG 89 1209 ? B 17.540 -9.461 -0.529 1.000 2 B 61.788 1 ATOM 2076 C C . ARG 89 1209 ? B 16.567 -10.391 0.187 1.000 2 B 61.788 1 ATOM 2077 O O . ARG 89 1209 ? B 16.442 -11.564 -0.172 1.000 2 B 61.788 1 ATOM 2078 C CB . ARG 89 1209 ? B 18.921 -9.541 0.126 1.000 2 B 61.788 1 ATOM 2079 C CG . ARG 89 1209 ? B 20.027 -8.884 -0.684 1.000 2 B 61.788 1 ATOM 2080 C CD . ARG 89 1209 ? B 21.406 -9.228 -0.139 1.000 2 B 61.788 1 ATOM 2081 N NE . ARG 89 1209 ? B 22.444 -8.389 -0.731 1.000 2 B 61.788 1 ATOM 2082 C CZ . ARG 89 1209 ? B 23.546 -7.991 -0.102 1.000 2 B 61.788 1 ATOM 2083 N NH1 . ARG 89 1209 ? B 23.777 -8.350 1.156 1.000 2 B 61.788 1 ATOM 2084 N NH2 . ARG 89 1209 ? B 24.426 -7.228 -0.735 1.000 2 B 61.788 1 ATOM 2085 N N . HIS 90 1210 ? B 15.696 -9.791 1.251 1.000 2 B 65.541 1 ATOM 2086 C CA . HIS 90 1210 ? B 14.883 -10.724 2.024 1.000 2 B 65.541 1 ATOM 2087 C C . HIS 90 1210 ? B 13.571 -11.033 1.312 1.000 2 B 65.541 1 ATOM 2088 O O . HIS 90 1210 ? B 12.864 -11.973 1.684 1.000 2 B 65.541 1 ATOM 2089 C CB . HIS 90 1210 ? B 14.603 -10.161 3.419 1.000 2 B 65.541 1 ATOM 2090 C CG . HIS 90 1210 ? B 13.854 -8.867 3.405 1.000 2 B 65.541 1 ATOM 2091 N ND1 . HIS 90 1210 ? B 14.463 -7.658 3.147 1.000 2 B 65.541 1 ATOM 2092 C CD2 . HIS 90 1210 ? B 12.544 -8.595 3.615 1.000 2 B 65.541 1 ATOM 2093 C CE1 . HIS 90 1210 ? B 13.557 -6.696 3.199 1.000 2 B 65.541 1 ATOM 2094 N NE2 . HIS 90 1210 ? B 12.385 -7.238 3.481 1.000 2 B 65.541 1 ATOM 2095 N N . LEU 91 1211 ? B 13.263 -10.172 0.260 1.000 2 B 66.436 1 ATOM 2096 C CA . LEU 91 1211 ? B 12.011 -10.431 -0.442 1.000 2 B 66.436 1 ATOM 2097 C C . LEU 91 1211 ? B 12.243 -11.325 -1.655 1.000 2 B 66.436 1 ATOM 2098 O O . LEU 91 1211 ? B 11.306 -11.623 -2.400 1.000 2 B 66.436 1 ATOM 2099 C CB . LEU 91 1211 ? B 11.360 -9.116 -0.880 1.000 2 B 66.436 1 ATOM 2100 C CG . LEU 91 1211 ? B 10.514 -8.395 0.171 1.000 2 B 66.436 1 ATOM 2101 C CD1 . LEU 91 1211 ? B 10.798 -6.897 0.143 1.000 2 B 66.436 1 ATOM 2102 C CD2 . LEU 91 1211 ? B 9.031 -8.668 -0.056 1.000 2 B 66.436 1 ATOM 2103 N N . LEU 92 1212 ? B 13.531 -11.749 -1.890 1.000 2 B 69.414 1 ATOM 2104 C CA . LEU 92 1212 ? B 13.844 -12.663 -2.982 1.000 2 B 69.414 1 ATOM 2105 C C . LEU 92 1212 ? B 12.976 -13.915 -2.910 1.000 2 B 69.414 1 ATOM 2106 O O . LEU 92 1212 ? B 12.487 -14.397 -3.935 1.000 2 B 69.414 1 ATOM 2107 C CB . LEU 92 1212 ? B 15.324 -13.052 -2.948 1.000 2 B 69.414 1 ATOM 2108 C CG . LEU 92 1212 ? B 16.314 -11.997 -3.444 1.000 2 B 69.414 1 ATOM 2109 C CD1 . LEU 92 1212 ? B 17.747 -12.450 -3.182 1.000 2 B 69.414 1 ATOM 2110 C CD2 . LEU 92 1212 ? B 16.099 -11.717 -4.927 1.000 2 B 69.414 1 ATOM 2111 N N . HIS 93 1213 ? B 12.786 -14.449 -1.633 1.000 2 B 75.683 1 ATOM 2112 C CA . HIS 93 1213 ? B 12.007 -15.670 -1.463 1.000 2 B 75.683 1 ATOM 2113 C C . HIS 93 1213 ? B 10.562 -15.469 -1.910 1.000 2 B 75.683 1 ATOM 2114 O O . HIS 93 1213 ? B 9.952 -16.377 -2.480 1.000 2 B 75.683 1 ATOM 2115 C CB . HIS 93 1213 ? B 12.046 -16.132 -0.005 1.000 2 B 75.683 1 ATOM 2116 C CG . HIS 93 1213 ? B 11.494 -17.506 0.205 1.000 2 B 75.683 1 ATOM 2117 N ND1 . HIS 93 1213 ? B 12.179 -18.646 -0.158 1.000 2 B 75.683 1 ATOM 2118 C CD2 . HIS 93 1213 ? B 10.324 -17.922 0.743 1.000 2 B 75.683 1 ATOM 2119 C CE1 . HIS 93 1213 ? B 11.450 -19.706 0.148 1.000 2 B 75.683 1 ATOM 2120 N NE2 . HIS 93 1213 ? B 10.320 -19.294 0.696 1.000 2 B 75.683 1 ATOM 2121 N N . LEU 94 1214 ? B 10.046 -14.170 -1.618 1.000 2 B 78.086 1 ATOM 2122 C CA . LEU 94 1214 ? B 8.678 -13.869 -2.024 1.000 2 B 78.086 1 ATOM 2123 C C . LEU 94 1214 ? B 8.572 -13.763 -3.542 1.000 2 B 78.086 1 ATOM 2124 O O . LEU 94 1214 ? B 7.601 -14.237 -4.135 1.000 2 B 78.086 1 ATOM 2125 C CB . LEU 94 1214 ? B 8.201 -12.567 -1.375 1.000 2 B 78.086 1 ATOM 2126 C CG . LEU 94 1214 ? B 7.550 -12.694 0.003 1.000 2 B 78.086 1 ATOM 2127 C CD1 . LEU 94 1214 ? B 8.208 -11.738 0.991 1.000 2 B 78.086 1 ATOM 2128 C CD2 . LEU 94 1214 ? B 6.051 -12.429 -0.088 1.000 2 B 78.086 1 ATOM 2129 N N . ARG 95 1215 ? B 9.587 -13.083 -4.132 1.000 2 B 78.298 1 ATOM 2130 C CA . ARG 95 1215 ? B 9.643 -13.047 -5.590 1.000 2 B 78.298 1 ATOM 2131 C C . ARG 95 1215 ? B 9.704 -14.456 -6.170 1.000 2 B 78.298 1 ATOM 2132 O O . ARG 95 1215 ? B 9.011 -14.763 -7.142 1.000 2 B 78.298 1 ATOM 2133 C CB . ARG 95 1215 ? B 10.849 -12.233 -6.062 1.000 2 B 78.298 1 ATOM 2134 C CG . ARG 95 1215 ? B 10.935 -12.078 -7.573 1.000 2 B 78.298 1 ATOM 2135 C CD . ARG 95 1215 ? B 12.146 -11.254 -7.988 1.000 2 B 78.298 1 ATOM 2136 N NE . ARG 95 1215 ? B 12.135 -10.963 -9.418 1.000 2 B 78.298 1 ATOM 2137 C CZ . ARG 95 1215 ? B 13.112 -10.342 -10.073 1.000 2 B 78.298 1 ATOM 2138 N NH1 . ARG 95 1215 ? B 14.202 -9.931 -9.434 1.000 2 B 78.298 1 ATOM 2139 N NH2 . ARG 95 1215 ? B 12.999 -10.128 -11.376 1.000 2 B 78.298 1 ATOM 2140 N N . GLU 96 1216 ? B 10.757 -15.312 -5.612 1.000 2 B 80.524 1 ATOM 2141 C CA . GLU 96 1216 ? B 10.900 -16.696 -6.054 1.000 2 B 80.524 1 ATOM 2142 C C . GLU 96 1216 ? B 9.589 -17.462 -5.899 1.000 2 B 80.524 1 ATOM 2143 O O . GLU 96 1216 ? B 9.205 -18.230 -6.783 1.000 2 B 80.524 1 ATOM 2144 C CB . GLU 96 1216 ? B 12.015 -17.398 -5.275 1.000 2 B 80.524 1 ATOM 2145 C CG . GLU 96 1216 ? B 12.298 -18.816 -5.748 1.000 2 B 80.524 1 ATOM 2146 C CD . GLU 96 1216 ? B 13.429 -19.488 -4.987 1.000 2 B 80.524 1 ATOM 2147 O OE1 . GLU 96 1216 ? B 13.950 -20.523 -5.462 1.000 2 B 80.524 1 ATOM 2148 O OE2 . GLU 96 1216 ? B 13.796 -18.977 -3.905 1.000 2 B 80.524 1 ATOM 2149 N N . ARG 97 1217 ? B 8.941 -17.285 -4.775 1.000 2 B 79.956 1 ATOM 2150 C CA . ARG 97 1217 ? B 7.661 -17.945 -4.537 1.000 2 B 79.956 1 ATOM 2151 C C . ARG 97 1217 ? B 6.610 -17.481 -5.539 1.000 2 B 79.956 1 ATOM 2152 O O . ARG 97 1217 ? B 5.792 -18.278 -6.002 1.000 2 B 79.956 1 ATOM 2153 C CB . ARG 97 1217 ? B 7.177 -17.680 -3.109 1.000 2 B 79.956 1 ATOM 2154 C CG . ARG 97 1217 ? B 7.924 -18.473 -2.048 1.000 2 B 79.956 1 ATOM 2155 C CD . ARG 97 1217 ? B 7.037 -19.529 -1.405 1.000 2 B 79.956 1 ATOM 2156 N NE . ARG 97 1217 ? B 7.709 -20.191 -0.290 1.000 2 B 79.956 1 ATOM 2157 C CZ . ARG 97 1217 ? B 7.315 -20.126 0.979 1.000 2 B 79.956 1 ATOM 2158 N NH1 . ARG 97 1217 ? B 6.240 -19.424 1.320 1.000 2 B 79.956 1 ATOM 2159 N NH2 . ARG 97 1217 ? B 8.000 -20.767 1.914 1.000 2 B 79.956 1 ATOM 2160 N N . TRP 98 1218 ? B 6.635 -16.152 -5.763 1.000 2 B 77.455 1 ATOM 2161 C CA . TRP 98 1218 ? B 5.688 -15.621 -6.739 1.000 2 B 77.455 1 ATOM 2162 C C . TRP 98 1218 ? B 5.967 -16.182 -8.129 1.000 2 B 77.455 1 ATOM 2163 O O . TRP 98 1218 ? B 5.042 -16.578 -8.842 1.000 2 B 77.455 1 ATOM 2164 C CB . TRP 98 1218 ? B 5.750 -14.091 -6.771 1.000 2 B 77.455 1 ATOM 2165 C CG . TRP 98 1218 ? B 4.803 -13.464 -7.749 1.000 2 B 77.455 1 ATOM 2166 C CD1 . TRP 98 1218 ? B 5.124 -12.660 -8.807 1.000 2 B 77.455 1 ATOM 2167 C CD2 . TRP 98 1218 ? B 3.377 -13.586 -7.756 1.000 2 B 77.455 1 ATOM 2168 N NE1 . TRP 98 1218 ? B 3.983 -12.275 -9.472 1.000 2 B 77.455 1 ATOM 2169 C CE2 . TRP 98 1218 ? B 2.898 -12.829 -8.848 1.000 2 B 77.455 1 ATOM 2170 C CE3 . TRP 98 1218 ? B 2.457 -14.263 -6.944 1.000 2 B 77.455 1 ATOM 2171 C CZ2 . TRP 98 1218 ? B 1.537 -12.731 -9.149 1.000 2 B 77.455 1 ATOM 2172 C CZ3 . TRP 98 1218 ? B 1.104 -14.165 -7.245 1.000 2 B 77.455 1 ATOM 2173 C CH2 . TRP 98 1218 ? B 0.659 -13.404 -8.339 1.000 2 B 77.455 1 ATOM 2174 N N . GLU 99 1219 ? B 7.157 -16.205 -8.568 1.000 2 B 81.283 1 ATOM 2175 C CA . GLU 99 1219 ? B 7.556 -16.759 -9.859 1.000 2 B 81.283 1 ATOM 2176 C C . GLU 99 1219 ? B 7.206 -18.241 -9.956 1.000 2 B 81.283 1 ATOM 2177 O O . GLU 99 1219 ? B 6.778 -18.716 -11.010 1.000 2 B 81.283 1 ATOM 2178 C CB . GLU 99 1219 ? B 9.055 -16.556 -10.091 1.000 2 B 81.283 1 ATOM 2179 C CG . GLU 99 1219 ? B 9.504 -16.861 -11.513 1.000 2 B 81.283 1 ATOM 2180 C CD . GLU 99 1219 ? B 10.932 -16.422 -11.798 1.000 2 B 81.283 1 ATOM 2181 O OE1 . GLU 99 1219 ? B 11.342 -16.423 -12.981 1.000 2 B 81.283 1 ATOM 2182 O OE2 . GLU 99 1219 ? B 11.646 -16.076 -10.831 1.000 2 B 81.283 1 ATOM 2183 N N . GLN 100 1220 ? B 7.371 -18.972 -8.894 1.000 2 B 77.054 1 ATOM 2184 C CA . GLN 100 1220 ? B 6.994 -20.381 -8.865 1.000 2 B 77.054 1 ATOM 2185 C C . GLN 100 1220 ? B 5.487 -20.551 -9.041 1.000 2 B 77.054 1 ATOM 2186 O O . GLN 100 1220 ? B 5.036 -21.497 -9.689 1.000 2 B 77.054 1 ATOM 2187 C CB . GLN 100 1220 ? B 7.446 -21.031 -7.557 1.000 2 B 77.054 1 ATOM 2188 C CG . GLN 100 1220 ? B 8.749 -21.810 -7.676 1.000 2 B 77.054 1 ATOM 2189 C CD . GLN 100 1220 ? B 9.460 -21.971 -6.345 1.000 2 B 77.054 1 ATOM 2190 O OE1 . GLN 100 1220 ? B 8.821 -22.091 -5.295 1.000 2 B 77.054 1 ATOM 2191 N NE2 . GLN 100 1220 ? B 10.788 -21.975 -6.379 1.000 2 B 77.054 1 ATOM 2192 N N . GLN 101 1221 ? B 4.771 -19.654 -8.405 1.000 2 B 74.992 1 ATOM 2193 C CA . GLN 101 1221 ? B 3.317 -19.735 -8.504 1.000 2 B 74.992 1 ATOM 2194 C C . GLN 101 1221 ? B 2.841 -19.389 -9.912 1.000 2 B 74.992 1 ATOM 2195 O O . GLN 101 1221 ? B 1.894 -19.993 -10.419 1.000 2 B 74.992 1 ATOM 2196 C CB . GLN 101 1221 ? B 2.656 -18.808 -7.483 1.000 2 B 74.992 1 ATOM 2197 C CG . GLN 101 1221 ? B 1.173 -19.082 -7.273 1.000 2 B 74.992 1 ATOM 2198 C CD . GLN 101 1221 ? B 0.557 -18.193 -6.209 1.000 2 B 74.992 1 ATOM 2199 O OE1 . GLN 101 1221 ? B 1.225 -17.318 -5.649 1.000 2 B 74.992 1 ATOM 2200 N NE2 . GLN 101 1221 ? B -0.722 -18.410 -5.922 1.000 2 B 74.992 1 ATOM 2201 N N . VAL 102 1222 ? B 3.491 -18.367 -10.468 1.000 2 B 67.287 1 ATOM 2202 C CA . VAL 102 1222 ? B 3.053 -17.963 -11.800 1.000 2 B 67.287 1 ATOM 2203 C C . VAL 102 1222 ? B 3.578 -18.952 -12.839 1.000 2 B 67.287 1 ATOM 2204 O O . VAL 102 1222 ? B 2.964 -19.140 -13.892 1.000 2 B 67.287 1 ATOM 2205 C CB . VAL 102 1222 ? B 3.524 -16.531 -12.142 1.000 2 B 67.287 1 ATOM 2206 C CG1 . VAL 102 1222 ? B 2.382 -15.719 -12.752 1.000 2 B 67.287 1 ATOM 2207 C CG2 . VAL 102 1222 ? B 4.071 -15.838 -10.896 1.000 2 B 67.287 1 ATOM 2208 N N . SER 103 1223 ? B 4.742 -19.511 -12.566 1.000 2 B 63.054 1 ATOM 2209 C CA . SER 103 1223 ? B 5.291 -20.475 -13.514 1.000 2 B 63.054 1 ATOM 2210 C C . SER 103 1223 ? B 4.601 -21.828 -13.389 1.000 2 B 63.054 1 ATOM 2211 O O . SER 103 1223 ? B 4.528 -22.586 -14.359 1.000 2 B 63.054 1 ATOM 2212 C CB . SER 103 1223 ? B 6.797 -20.639 -13.299 1.000 2 B 63.054 1 ATOM 2213 O OG . SER 103 1223 ? B 7.478 -19.425 -13.561 1.000 2 B 63.054 1 ATOM 2214 N N . ALA 104 1224 ? B 4.169 -22.124 -12.217 1.000 2 B 58.798 1 ATOM 2215 C CA . ALA 104 1224 ? B 3.511 -23.418 -12.057 1.000 2 B 58.798 1 ATOM 2216 C C . ALA 104 1224 ? B 2.166 -23.443 -12.779 1.000 2 B 58.798 1 ATOM 2217 O O . ALA 104 1224 ? B 1.701 -24.504 -13.202 1.000 2 B 58.798 1 ATOM 2218 C CB . ALA 104 1224 ? B 3.323 -23.741 -10.577 1.000 2 B 58.798 1 ATOM 2219 N N . ALA 105 1225 ? B 1.665 -22.212 -13.042 1.000 2 B 55.599 1 ATOM 2220 C CA . ALA 105 1225 ? B 0.354 -22.195 -13.687 1.000 2 B 55.599 1 ATOM 2221 C C . ALA 105 1225 ? B 0.488 -22.302 -15.203 1.000 2 B 55.599 1 ATOM 2222 O O . ALA 105 1225 ? B -0.465 -22.675 -15.892 1.000 2 B 55.599 1 ATOM 2223 C CB . ALA 105 1225 ? B -0.407 -20.926 -13.311 1.000 2 B 55.599 1 ATOM 2224 N N . ASP 106 1226 ? B 1.708 -22.294 -15.741 1.000 2 B 49.500 1 ATOM 2225 C CA . ASP 106 1226 ? B 1.801 -22.515 -17.181 1.000 2 B 49.500 1 ATOM 2226 C C . ASP 106 1226 ? B 2.192 -23.958 -17.491 1.000 2 B 49.500 1 ATOM 2227 O O . ASP 106 1226 ? B 2.320 -24.335 -18.658 1.000 2 B 49.500 1 ATOM 2228 C CB . ASP 106 1226 ? B 2.810 -21.550 -17.808 1.000 2 B 49.500 1 ATOM 2229 C CG . ASP 106 1226 ? B 2.279 -20.863 -19.053 1.000 2 B 49.500 1 ATOM 2230 O OD1 . ASP 106 1226 ? B 1.621 -21.527 -19.883 1.000 2 B 49.500 1 ATOM 2231 O OD2 . ASP 106 1226 ? B 2.523 -19.646 -19.207 1.000 2 B 49.500 1 ATOM 2232 N N . GLY 107 1227 ? B 1.947 -24.858 -16.500 1.000 2 B 48.609 1 ATOM 2233 C CA . GLY 107 1227 ? B 2.209 -26.171 -17.065 1.000 2 B 48.609 1 ATOM 2234 C C . GLY 107 1227 ? B 1.076 -27.155 -16.841 1.000 2 B 48.609 1 ATOM 2235 O O . GLY 107 1227 ? B 0.756 -27.492 -15.699 1.000 2 B 48.609 1 ATOM 2236 N N . LYS 108 1228 ? B -0.136 -26.763 -16.970 1.000 2 B 42.796 1 ATOM 2237 C CA . LYS 108 1228 ? B -1.084 -27.861 -17.140 1.000 2 B 42.796 1 ATOM 2238 C C . LYS 108 1228 ? B -0.621 -28.823 -18.230 1.000 2 B 42.796 1 ATOM 2239 O O . LYS 108 1228 ? B -0.170 -28.393 -19.294 1.000 2 B 42.796 1 ATOM 2240 C CB . LYS 108 1228 ? B -2.475 -27.321 -17.474 1.000 2 B 42.796 1 ATOM 2241 C CG . LYS 108 1228 ? B -3.298 -26.934 -16.254 1.000 2 B 42.796 1 ATOM 2242 C CD . LYS 108 1228 ? B -4.780 -26.830 -16.589 1.000 2 B 42.796 1 ATOM 2243 C CE . LYS 108 1228 ? B -5.582 -26.277 -15.418 1.000 2 B 42.796 1 ATOM 2244 N NZ . LYS 108 1228 ? B -7.043 -26.546 -15.571 1.000 2 B 42.796 1 ATOM 2245 N N . PRO 109 1229 ? B -0.669 -30.167 -18.024 1.000 2 B 47.219 1 ATOM 2246 C CA . PRO 109 1229 ? B -0.034 -31.427 -18.418 1.000 2 B 47.219 1 ATOM 2247 C C . PRO 109 1229 ? B -0.561 -31.963 -19.748 1.000 2 B 47.219 1 ATOM 2248 O O . PRO 109 1229 ? B -1.770 -31.931 -19.994 1.000 2 B 47.219 1 ATOM 2249 C CB . PRO 109 1229 ? B -0.387 -32.374 -17.269 1.000 2 B 47.219 1 ATOM 2250 C CG . PRO 109 1229 ? B -1.758 -31.961 -16.840 1.000 2 B 47.219 1 ATOM 2251 C CD . PRO 109 1229 ? B -2.140 -30.719 -17.595 1.000 2 B 47.219 1 ATOM 2252 N N . GLY 110 1230 ? B -0.069 -31.561 -20.808 1.000 2 B 39.589 1 ATOM 2253 C CA . GLY 110 1230 ? B -0.004 -32.302 -22.058 1.000 2 B 39.589 1 ATOM 2254 C C . GLY 110 1230 ? B 0.444 -33.740 -21.876 1.000 2 B 39.589 1 ATOM 2255 O O . GLY 110 1230 ? B 1.458 -34.003 -21.227 1.000 2 B 39.589 1 ATOM 2256 N N . ARG 111 1231 ? B -0.382 -34.640 -21.337 1.000 2 B 34.266 1 ATOM 2257 C CA . ARG 111 1231 ? B -0.893 -35.849 -21.975 1.000 2 B 34.266 1 ATOM 2258 C C . ARG 111 1231 ? B 0.019 -36.294 -23.114 1.000 2 B 34.266 1 ATOM 2259 O O . ARG 111 1231 ? B 0.337 -35.504 -24.006 1.000 2 B 34.266 1 ATOM 2260 C CB . ARG 111 1231 ? B -2.313 -35.622 -22.499 1.000 2 B 34.266 1 ATOM 2261 C CG . ARG 111 1231 ? B -3.385 -36.358 -21.710 1.000 2 B 34.266 1 ATOM 2262 C CD . ARG 111 1231 ? B -4.671 -36.508 -22.511 1.000 2 B 34.266 1 ATOM 2263 N NE . ARG 111 1231 ? B -5.790 -36.906 -21.663 1.000 2 B 34.266 1 ATOM 2264 C CZ . ARG 111 1231 ? B -6.328 -38.123 -21.638 1.000 2 B 34.266 1 ATOM 2265 N NH1 . ARG 111 1231 ? B -5.856 -39.089 -22.418 1.000 2 B 34.266 1 ATOM 2266 N NH2 . ARG 111 1231 ? B -7.345 -38.376 -20.828 1.000 2 B 34.266 1 ATOM 2267 N N . GLN 112 1232 ? B 1.103 -37.130 -22.872 1.000 2 B 39.633 1 ATOM 2268 C CA . GLN 112 1232 ? B 1.506 -38.220 -23.754 1.000 2 B 39.633 1 ATOM 2269 C C . GLN 112 1232 ? B 2.670 -39.007 -23.159 1.000 2 B 39.633 1 ATOM 2270 O O . GLN 112 1232 ? B 3.704 -38.431 -22.815 1.000 2 B 39.633 1 ATOM 2271 C CB . GLN 112 1232 ? B 1.887 -37.681 -25.134 1.000 2 B 39.633 1 ATOM 2272 C CG . GLN 112 1232 ? B 0.692 -37.309 -26.001 1.000 2 B 39.633 1 ATOM 2273 C CD . GLN 112 1232 ? B 1.077 -37.025 -27.441 1.000 2 B 39.633 1 ATOM 2274 O OE1 . GLN 112 1232 ? B 2.153 -36.485 -27.715 1.000 2 B 39.633 1 ATOM 2275 N NE2 . GLN 112 1232 ? B 0.199 -37.386 -28.371 1.000 2 B 39.633 1 ATOM 2276 N N . SER 113 1233 ? B 2.420 -40.097 -22.487 1.000 2 B 32.698 1 ATOM 2277 C CA . SER 113 1233 ? B 2.408 -41.436 -23.066 1.000 2 B 32.698 1 ATOM 2278 C C . SER 113 1233 ? B 3.676 -42.205 -22.709 1.000 2 B 32.698 1 ATOM 2279 O O . SER 113 1233 ? B 4.785 -41.689 -22.864 1.000 2 B 32.698 1 ATOM 2280 C CB . SER 113 1233 ? B 2.257 -41.363 -24.586 1.000 2 B 32.698 1 ATOM 2281 O OG . SER 113 1233 ? B 3.493 -41.038 -25.199 1.000 2 B 32.698 1 ATOM 2282 N N . ARG 114 1234 ? B 3.623 -43.074 -21.677 1.000 2 B 33.297 1 ATOM 2283 C CA . ARG 114 1234 ? B 3.651 -44.529 -21.791 1.000 2 B 33.297 1 ATOM 2284 C C . ARG 114 1234 ? B 5.084 -45.047 -21.843 1.000 2 B 33.297 1 ATOM 2285 O O . ARG 114 1234 ? B 5.888 -44.583 -22.653 1.000 2 B 33.297 1 ATOM 2286 C CB . ARG 114 1234 ? B 2.883 -44.986 -23.033 1.000 2 B 33.297 1 ATOM 2287 C CG . ARG 114 1234 ? B 2.686 -46.491 -23.116 1.000 2 B 33.297 1 ATOM 2288 C CD . ARG 114 1234 ? B 1.833 -46.882 -24.315 1.000 2 B 33.297 1 ATOM 2289 N NE . ARG 114 1234 ? B 1.492 -48.302 -24.293 1.000 2 B 33.297 1 ATOM 2290 C CZ . ARG 114 1234 ? B 1.387 -49.073 -25.372 1.000 2 B 33.297 1 ATOM 2291 N NH1 . ARG 114 1234 ? B 1.596 -48.574 -26.585 1.000 2 B 33.297 1 ATOM 2292 N NH2 . ARG 114 1234 ? B 1.071 -50.353 -25.237 1.000 2 B 33.297 1 ATOM 2293 N N . LYS 115 1235 ? B 5.626 -45.568 -20.767 1.000 2 B 38.590 1 ATOM 2294 C CA . LYS 115 1235 ? B 6.108 -46.925 -20.525 1.000 2 B 38.590 1 ATOM 2295 C C . LYS 115 1235 ? B 7.537 -46.913 -19.989 1.000 2 B 38.590 1 ATOM 2296 O O . LYS 115 1235 ? B 8.445 -46.388 -20.638 1.000 2 B 38.590 1 ATOM 2297 C CB . LYS 115 1235 ? B 6.036 -47.756 -21.807 1.000 2 B 38.590 1 ATOM 2298 C CG . LYS 115 1235 ? B 4.643 -48.276 -22.130 1.000 2 B 38.590 1 ATOM 2299 C CD . LYS 115 1235 ? B 4.596 -48.933 -23.504 1.000 2 B 38.590 1 ATOM 2300 C CE . LYS 115 1235 ? B 3.192 -49.410 -23.848 1.000 2 B 38.590 1 ATOM 2301 N NZ . LYS 115 1235 ? B 3.162 -50.155 -25.143 1.000 2 B 38.590 1 ATOM 2302 N N . GLU 116 1236 ? B 7.849 -46.860 -18.744 1.000 2 B 36.797 1 ATOM 2303 C CA . GLU 116 1236 ? B 8.807 -47.912 -18.417 1.000 2 B 36.797 1 ATOM 2304 C C . GLU 116 1236 ? B 9.027 -48.009 -16.911 1.000 2 B 36.797 1 ATOM 2305 O O . GLU 116 1236 ? B 9.503 -47.059 -16.285 1.000 2 B 36.797 1 ATOM 2306 C CB . GLU 116 1236 ? B 10.139 -47.666 -19.130 1.000 2 B 36.797 1 ATOM 2307 C CG . GLU 116 1236 ? B 10.333 -48.510 -20.381 1.000 2 B 36.797 1 ATOM 2308 C CD . GLU 116 1236 ? B 11.667 -48.268 -21.068 1.000 2 B 36.797 1 ATOM 2309 O OE1 . GLU 116 1236 ? B 11.952 -48.931 -22.091 1.000 2 B 36.797 1 ATOM 2310 O OE2 . GLU 116 1236 ? B 12.433 -47.408 -20.580 1.000 2 B 36.797 1 ATOM 2311 N N . VAL 117 1237 ? B 8.170 -48.463 -16.134 1.000 2 B 36.548 1 ATOM 2312 C CA . VAL 117 1237 ? B 8.180 -49.462 -15.071 1.000 2 B 36.548 1 ATOM 2313 C C . VAL 117 1237 ? B 9.017 -50.665 -15.499 1.000 2 B 36.548 1 ATOM 2314 O O . VAL 117 1237 ? B 8.704 -51.323 -16.495 1.000 2 B 36.548 1 ATOM 2315 C CB . VAL 117 1237 ? B 6.749 -49.912 -14.701 1.000 2 B 36.548 1 ATOM 2316 C CG1 . VAL 117 1237 ? B 6.787 -51.148 -13.803 1.000 2 B 36.548 1 ATOM 2317 C CG2 . VAL 117 1237 ? B 5.993 -48.774 -14.018 1.000 2 B 36.548 1 ATOM 2318 N N . THR 118 1238 ? B 10.346 -50.644 -15.541 1.000 2 B 38.346 1 ATOM 2319 C CA . THR 118 1238 ? B 11.217 -51.792 -15.313 1.000 2 B 38.346 1 ATOM 2320 C C . THR 118 1238 ? B 12.248 -51.482 -14.231 1.000 2 B 38.346 1 ATOM 2321 O O . THR 118 1238 ? B 12.959 -50.479 -14.313 1.000 2 B 38.346 1 ATOM 2322 C CB . THR 118 1238 ? B 11.938 -52.211 -16.607 1.000 2 B 38.346 1 ATOM 2323 O OG1 . THR 118 1238 ? B 11.040 -52.071 -17.715 1.000 2 B 38.346 1 ATOM 2324 C CG2 . THR 118 1238 ? B 12.409 -53.660 -16.530 1.000 2 B 38.346 1 ATOM 2325 N N . GLN 119 1239 ? B 12.004 -51.724 -12.953 1.000 2 B 29.327 1 ATOM 2326 C CA . GLN 119 1239 ? B 12.558 -52.705 -12.025 1.000 2 B 29.327 1 ATOM 2327 C C . GLN 119 1239 ? B 13.892 -53.246 -12.529 1.000 2 B 29.327 1 ATOM 2328 O O . GLN 119 1239 ? B 13.994 -53.695 -13.673 1.000 2 B 29.327 1 ATOM 2329 C CB . GLN 119 1239 ? B 11.573 -53.855 -11.808 1.000 2 B 29.327 1 ATOM 2330 C CG . GLN 119 1239 ? B 11.707 -54.533 -10.452 1.000 2 B 29.327 1 ATOM 2331 C CD . GLN 119 1239 ? B 10.625 -55.566 -10.202 1.000 2 B 29.327 1 ATOM 2332 O OE1 . GLN 119 1239 ? B 10.208 -56.282 -11.118 1.000 2 B 29.327 1 ATOM 2333 N NE2 . GLN 119 1239 ? B 10.162 -55.651 -8.959 1.000 2 B 29.327 1 ATOM 2334 N N . ALA 120 1240 ? B 15.118 -52.801 -12.152 1.000 2 B 32.290 1 ATOM 2335 C CA . ALA 120 1240 ? B 16.232 -53.670 -11.784 1.000 2 B 32.290 1 ATOM 2336 C C . ALA 120 1240 ? B 17.571 -52.982 -12.035 1.000 2 B 32.290 1 ATOM 2337 O O . ALA 120 1240 ? B 17.828 -52.496 -13.139 1.000 2 B 32.290 1 ATOM 2338 C CB . ALA 120 1240 ? B 16.160 -54.985 -12.557 1.000 2 B 32.290 1 ATOM 2339 N N . THR 121 1241 ? B 18.214 -52.343 -11.030 1.000 2 B 32.014 1 ATOM 2340 C CA . THR 121 1241 ? B 19.568 -52.780 -10.708 1.000 2 B 32.014 1 ATOM 2341 C C . THR 121 1241 ? B 20.373 -51.638 -10.092 1.000 2 B 32.014 1 ATOM 2342 O O . THR 121 1241 ? B 20.453 -50.549 -10.664 1.000 2 B 32.014 1 ATOM 2343 C CB . THR 121 1241 ? B 20.297 -53.308 -11.958 1.000 2 B 32.014 1 ATOM 2344 O OG1 . THR 121 1241 ? B 19.453 -54.249 -12.633 1.000 2 B 32.014 1 ATOM 2345 C CG2 . THR 121 1241 ? B 21.606 -53.995 -11.582 1.000 2 B 32.014 1 ATOM 2346 N N . GLN 122 1242 ? B 20.319 -51.400 -8.866 1.000 2 B 25.260 1 ATOM 2347 C CA . GLN 122 1242 ? B 21.466 -51.355 -7.965 1.000 2 B 25.260 1 ATOM 2348 C C . GLN 122 1242 ? B 22.770 -51.586 -8.723 1.000 2 B 25.260 1 ATOM 2349 O O . GLN 122 1242 ? B 22.906 -52.573 -9.449 1.000 2 B 25.260 1 ATOM 2350 C CB . GLN 122 1242 ? B 21.315 -52.393 -6.851 1.000 2 B 25.260 1 ATOM 2351 C CG . GLN 122 1242 ? B 20.534 -51.890 -5.644 1.000 2 B 25.260 1 ATOM 2352 C CD . GLN 122 1242 ? B 21.368 -51.013 -4.729 1.000 2 B 25.260 1 ATOM 2353 O OE1 . GLN 122 1242 ? B 22.447 -50.546 -5.109 1.000 2 B 25.260 1 ATOM 2354 N NE2 . GLN 122 1242 ? B 20.876 -50.786 -3.516 1.000 2 B 25.260 1 ATOM 2355 N N . PRO 123 1243 ? B 23.761 -50.656 -8.754 1.000 2 B 41.993 1 ATOM 2356 C CA . PRO 123 1243 ? B 25.156 -51.071 -8.582 1.000 2 B 41.993 1 ATOM 2357 C C . PRO 123 1243 ? B 25.842 -50.366 -7.414 1.000 2 B 41.993 1 ATOM 2358 O O . PRO 123 1243 ? B 25.596 -49.182 -7.173 1.000 2 B 41.993 1 ATOM 2359 C CB . PRO 123 1243 ? B 25.805 -50.682 -9.913 1.000 2 B 41.993 1 ATOM 2360 C CG . PRO 123 1243 ? B 25.046 -49.479 -10.371 1.000 2 B 41.993 1 ATOM 2361 C CD . PRO 123 1243 ? B 23.887 -49.264 -9.441 1.000 2 B 41.993 1 ATOM 2362 N N . GLU 124 1244 ? B 25.807 -50.895 -6.252 1.000 2 B 29.581 1 ATOM 2363 C CA . GLU 124 1244 ? B 26.835 -51.230 -5.271 1.000 2 B 29.581 1 ATOM 2364 C C . GLU 124 1244 ? B 28.135 -51.645 -5.954 1.000 2 B 29.581 1 ATOM 2365 O O . GLU 124 1244 ? B 28.175 -52.651 -6.665 1.000 2 B 29.581 1 ATOM 2366 C CB . GLU 124 1244 ? B 26.349 -52.346 -4.342 1.000 2 B 29.581 1 ATOM 2367 C CG . GLU 124 1244 ? B 26.842 -52.210 -2.908 1.000 2 B 29.581 1 ATOM 2368 C CD . GLU 124 1244 ? B 26.383 -53.345 -2.006 1.000 2 B 29.581 1 ATOM 2369 O OE1 . GLU 124 1244 ? B 27.037 -53.599 -0.970 1.000 2 B 29.581 1 ATOM 2370 O OE2 . GLU 124 1244 ? B 25.361 -53.986 -2.340 1.000 2 B 29.581 1 ATOM 2371 N N . ALA 125 1245 ? B 29.116 -50.777 -6.297 1.000 2 B 42.912 1 ATOM 2372 C CA . ALA 125 1245 ? B 30.525 -51.159 -6.329 1.000 2 B 42.912 1 ATOM 2373 C C . ALA 125 1245 ? B 31.412 -50.024 -5.824 1.000 2 B 42.912 1 ATOM 2374 O O . ALA 125 1245 ? B 31.281 -48.881 -6.269 1.000 2 B 42.912 1 ATOM 2375 C CB . ALA 125 1245 ? B 30.936 -51.562 -7.743 1.000 2 B 42.912 1 ATOM 2376 N N . ILE 126 1246 ? B 31.763 -49.867 -4.563 1.000 2 B 35.959 1 ATOM 2377 C CA . ILE 126 1246 ? B 32.937 -49.728 -3.708 1.000 2 B 35.959 1 ATOM 2378 C C . ILE 126 1246 ? B 34.201 -50.005 -4.519 1.000 2 B 35.959 1 ATOM 2379 O O . ILE 126 1246 ? B 34.239 -50.942 -5.320 1.000 2 B 35.959 1 ATOM 2380 C CB . ILE 126 1246 ? B 32.864 -50.675 -2.489 1.000 2 B 35.959 1 ATOM 2381 C CG1 . ILE 126 1246 ? B 31.591 -50.404 -1.678 1.000 2 B 35.959 1 ATOM 2382 C CG2 . ILE 126 1246 ? B 34.113 -50.527 -1.615 1.000 2 B 35.959 1 ATOM 2383 C CD1 . ILE 126 1246 ? B 31.351 -51.400 -0.552 1.000 2 B 35.959 1 ATOM 2384 N N . PRO 127 1247 ? B 35.507 -49.428 -4.195 1.000 2 B 48.390 1 ATOM 2385 C CA . PRO 127 1247 ? B 36.550 -48.407 -4.320 1.000 2 B 48.390 1 ATOM 2386 C C . PRO 127 1247 ? B 37.886 -48.982 -4.782 1.000 2 B 48.390 1 ATOM 2387 O O . PRO 127 1247 ? B 38.112 -50.190 -4.676 1.000 2 B 48.390 1 ATOM 2388 C CB . PRO 127 1247 ? B 36.660 -47.840 -2.903 1.000 2 B 48.390 1 ATOM 2389 C CG . PRO 127 1247 ? B 36.428 -49.011 -2.004 1.000 2 B 48.390 1 ATOM 2390 C CD . PRO 127 1247 ? B 36.044 -50.192 -2.848 1.000 2 B 48.390 1 ATOM 2391 N N . GLN 128 1248 ? B 38.619 -48.349 -5.797 1.000 2 B 38.056 1 ATOM 2392 C CA . GLN 128 1248 ? B 40.012 -48.624 -6.129 1.000 2 B 38.056 1 ATOM 2393 C C . GLN 128 1248 ? B 40.689 -47.394 -6.726 1.000 2 B 38.056 1 ATOM 2394 O O . GLN 128 1248 ? B 40.164 -46.780 -7.658 1.000 2 B 38.056 1 ATOM 2395 C CB . GLN 128 1248 ? B 40.111 -49.801 -7.101 1.000 2 B 38.056 1 ATOM 2396 C CG . GLN 128 1248 ? B 40.718 -51.056 -6.489 1.000 2 B 38.056 1 ATOM 2397 C CD . GLN 128 1248 ? B 41.122 -52.082 -7.531 1.000 2 B 38.056 1 ATOM 2398 O OE1 . GLN 128 1248 ? B 40.519 -52.165 -8.605 1.000 2 B 38.056 1 ATOM 2399 N NE2 . GLN 128 1248 ? B 42.145 -52.870 -7.221 1.000 2 B 38.056 1 ATOM 2400 N N . GLY 129 1249 ? B 41.444 -46.500 -5.965 1.000 2 B 32.787 1 ATOM 2401 C CA . GLY 129 1249 ? B 42.880 -46.486 -6.197 1.000 2 B 32.787 1 ATOM 2402 C C . GLY 129 1249 ? B 43.343 -45.287 -7.002 1.000 2 B 32.787 1 ATOM 2403 O O . GLY 129 1249 ? B 42.721 -44.927 -8.003 1.000 2 B 32.787 1 ATOM 2404 N N . THR 130 1250 ? B 44.010 -44.269 -6.333 1.000 2 B 30.119 1 ATOM 2405 C CA . THR 130 1250 ? B 45.383 -43.778 -6.322 1.000 2 B 30.119 1 ATOM 2406 C C . THR 130 1250 ? B 45.737 -43.127 -7.656 1.000 2 B 30.119 1 ATOM 2407 O O . THR 130 1250 ? B 45.431 -43.673 -8.719 1.000 2 B 30.119 1 ATOM 2408 C CB . THR 130 1250 ? B 46.380 -44.912 -6.021 1.000 2 B 30.119 1 ATOM 2409 O OG1 . THR 130 1250 ? B 45.686 -46.166 -6.033 1.000 2 B 30.119 1 ATOM 2410 C CG2 . THR 130 1250 ? B 47.036 -44.721 -4.657 1.000 2 B 30.119 1 ATOM 2411 N N . ASN 131 1251 ? B 45.956 -41.727 -7.708 1.000 2 B 35.268 1 ATOM 2412 C CA . ASN 131 1251 ? B 47.202 -41.151 -8.203 1.000 2 B 35.268 1 ATOM 2413 C C . ASN 131 1251 ? B 46.993 -39.736 -8.736 1.000 2 B 35.268 1 ATOM 2414 O O . ASN 131 1251 ? B 46.123 -39.508 -9.579 1.000 2 B 35.268 1 ATOM 2415 C CB . ASN 131 1251 ? B 47.812 -42.042 -9.287 1.000 2 B 35.268 1 ATOM 2416 C CG . ASN 131 1251 ? B 48.521 -43.254 -8.716 1.000 2 B 35.268 1 ATOM 2417 O OD1 . ASN 131 1251 ? B 49.607 -43.141 -8.143 1.000 2 B 35.268 1 ATOM 2418 N ND2 . ASN 131 1251 ? B 47.910 -44.424 -8.867 1.000 2 B 35.268 1 ATOM 2419 N N . ILE 132 1252 ? B 47.173 -38.661 -8.023 1.000 2 B 39.503 1 ATOM 2420 C CA . ILE 132 1252 ? B 48.064 -37.506 -8.066 1.000 2 B 39.503 1 ATOM 2421 C C . ILE 132 1252 ? B 48.958 -37.591 -9.301 1.000 2 B 39.503 1 ATOM 2422 O O . ILE 132 1252 ? B 49.712 -38.552 -9.465 1.000 2 B 39.503 1 ATOM 2423 C CB . ILE 132 1252 ? B 48.925 -37.409 -6.787 1.000 2 B 39.503 1 ATOM 2424 C CG1 . ILE 132 1252 ? B 49.621 -38.746 -6.509 1.000 2 B 39.503 1 ATOM 2425 C CG2 . ILE 132 1252 ? B 48.070 -36.978 -5.592 1.000 2 B 39.503 1 ATOM 2426 C CD1 . ILE 132 1252 ? B 50.893 -38.622 -5.681 1.000 2 B 39.503 1 ATOM 2427 N N . THR 133 1253 ? B 48.636 -37.095 -10.485 1.000 2 B 45.767 1 ATOM 2428 C CA . THR 133 1253 ? B 49.430 -36.638 -11.620 1.000 2 B 45.767 1 ATOM 2429 C C . THR 133 1253 ? B 49.315 -35.125 -11.785 1.000 2 B 45.767 1 ATOM 2430 O O . THR 133 1253 ? B 48.211 -34.577 -11.789 1.000 2 B 45.767 1 ATOM 2431 C CB . THR 133 1253 ? B 48.994 -37.333 -12.923 1.000 2 B 45.767 1 ATOM 2432 O OG1 . THR 133 1253 ? B 48.603 -38.681 -12.630 1.000 2 B 45.767 1 ATOM 2433 C CG2 . THR 133 1253 ? B 50.130 -37.356 -13.941 1.000 2 B 45.767 1 ATOM 2434 N N . GLU 134 1254 ? B 50.217 -34.249 -11.217 1.000 2 B 33.591 1 ATOM 2435 C CA . GLU 134 1254 ? B 51.396 -33.572 -11.748 1.000 2 B 33.591 1 ATOM 2436 C C . GLU 134 1254 ? B 51.030 -32.660 -12.915 1.000 2 B 33.591 1 ATOM 2437 O O . GLU 134 1254 ? B 50.484 -33.119 -13.921 1.000 2 B 33.591 1 ATOM 2438 C CB . GLU 134 1254 ? B 52.450 -34.592 -12.187 1.000 2 B 33.591 1 ATOM 2439 C CG . GLU 134 1254 ? B 53.882 -34.149 -11.923 1.000 2 B 33.591 1 ATOM 2440 C CD . GLU 134 1254 ? B 54.913 -34.965 -12.687 1.000 2 B 33.591 1 ATOM 2441 O OE1 . GLU 134 1254 ? B 55.940 -34.394 -13.119 1.000 2 B 33.591 1 ATOM 2442 O OE2 . GLU 134 1254 ? B 54.691 -36.185 -12.856 1.000 2 B 33.591 1 ATOM 2443 N N . GLU 135 1255 ? B 50.826 -31.308 -12.782 1.000 2 B 44.227 1 ATOM 2444 C CA . GLU 135 1255 ? B 51.458 -30.297 -13.625 1.000 2 B 44.227 1 ATOM 2445 C C . GLU 135 1255 ? B 51.153 -28.889 -13.121 1.000 2 B 44.227 1 ATOM 2446 O O . GLU 135 1255 ? B 49.988 -28.518 -12.967 1.000 2 B 44.227 1 ATOM 2447 C CB . GLU 135 1255 ? B 51.001 -30.446 -15.078 1.000 2 B 44.227 1 ATOM 2448 C CG . GLU 135 1255 ? B 51.935 -29.793 -16.087 1.000 2 B 44.227 1 ATOM 2449 C CD . GLU 135 1255 ? B 51.281 -29.546 -17.437 1.000 2 B 44.227 1 ATOM 2450 O OE1 . GLU 135 1255 ? B 51.295 -28.389 -17.915 1.000 2 B 44.227 1 ATOM 2451 O OE2 . GLU 135 1255 ? B 50.750 -30.517 -18.021 1.000 2 B 44.227 1 ATOM 2452 N N . LYS 136 1256 ? B 51.929 -28.359 -12.155 1.000 2 B 45.191 1 ATOM 2453 C CA . LYS 136 1256 ? B 52.795 -27.200 -11.959 1.000 2 B 45.191 1 ATOM 2454 C C . LYS 136 1256 ? B 52.213 -25.959 -12.628 1.000 2 B 45.191 1 ATOM 2455 O O . LYS 136 1256 ? B 51.734 -26.025 -13.762 1.000 2 B 45.191 1 ATOM 2456 C CB . LYS 136 1256 ? B 54.197 -27.480 -12.502 1.000 2 B 45.191 1 ATOM 2457 C CG . LYS 136 1256 ? B 55.106 -28.210 -11.523 1.000 2 B 45.191 1 ATOM 2458 C CD . LYS 136 1256 ? B 56.060 -27.250 -10.824 1.000 2 B 45.191 1 ATOM 2459 C CE . LYS 136 1256 ? B 56.830 -27.941 -9.707 1.000 2 B 45.191 1 ATOM 2460 N NZ . LYS 136 1256 ? B 57.998 -27.127 -9.254 1.000 2 B 45.191 1 ATOM 2461 N N . PRO 137 1257 ? B 52.538 -24.665 -12.147 1.000 2 B 49.829 1 ATOM 2462 C CA . PRO 137 1257 ? B 51.997 -23.335 -11.858 1.000 2 B 49.829 1 ATOM 2463 C C . PRO 137 1257 ? B 52.540 -22.260 -12.797 1.000 2 B 49.829 1 ATOM 2464 O O . PRO 137 1257 ? B 53.586 -22.453 -13.423 1.000 2 B 49.829 1 ATOM 2465 C CB . PRO 137 1257 ? B 52.444 -23.077 -10.417 1.000 2 B 49.829 1 ATOM 2466 C CG . PRO 137 1257 ? B 53.786 -23.726 -10.312 1.000 2 B 49.829 1 ATOM 2467 C CD . PRO 137 1257 ? B 54.063 -24.460 -11.593 1.000 2 B 49.829 1 ATOM 2468 N N . GLY 138 1258 ? B 51.707 -21.309 -13.454 1.000 2 B 41.267 1 ATOM 2469 C CA . GLY 138 1258 ? B 52.275 -20.055 -13.922 1.000 2 B 41.267 1 ATOM 2470 C C . GLY 138 1258 ? B 51.275 -18.914 -13.930 1.000 2 B 41.267 1 ATOM 2471 O O . GLY 138 1258 ? B 50.116 -19.100 -14.305 1.000 2 B 41.267 1 ATOM 2472 N N . ARG 139 1259 ? B 51.210 -18.032 -12.913 1.000 2 B 38.493 1 ATOM 2473 C CA . ARG 139 1259 ? B 51.575 -16.621 -12.838 1.000 2 B 38.493 1 ATOM 2474 C C . ARG 139 1259 ? B 50.617 -15.763 -13.658 1.000 2 B 38.493 1 ATOM 2475 O O . ARG 139 1259 ? B 50.337 -16.072 -14.818 1.000 2 B 38.493 1 ATOM 2476 C CB . ARG 139 1259 ? B 53.012 -16.410 -13.321 1.000 2 B 38.493 1 ATOM 2477 C CG . ARG 139 1259 ? B 54.060 -16.591 -12.235 1.000 2 B 38.493 1 ATOM 2478 C CD . ARG 139 1259 ? B 55.312 -15.773 -12.518 1.000 2 B 38.493 1 ATOM 2479 N NE . ARG 139 1259 ? B 56.526 -16.515 -12.188 1.000 2 B 38.493 1 ATOM 2480 C CZ . ARG 139 1259 ? B 57.556 -16.019 -11.508 1.000 2 B 38.493 1 ATOM 2481 N NH1 . ARG 139 1259 ? B 57.539 -14.765 -11.070 1.000 2 B 38.493 1 ATOM 2482 N NH2 . ARG 139 1259 ? B 58.612 -16.781 -11.263 1.000 2 B 38.493 1 ATOM 2483 N N . LYS 140 1260 ? B 49.607 -15.020 -13.091 1.000 2 B 48.746 1 ATOM 2484 C CA . LYS 140 1260 ? B 49.427 -13.580 -13.255 1.000 2 B 48.746 1 ATOM 2485 C C . LYS 140 1260 ? B 47.996 -13.164 -12.928 1.000 2 B 48.746 1 ATOM 2486 O O . LYS 140 1260 ? B 47.041 -13.747 -13.445 1.000 2 B 48.746 1 ATOM 2487 C CB . LYS 140 1260 ? B 49.785 -13.153 -14.679 1.000 2 B 48.746 1 ATOM 2488 C CG . LYS 140 1260 ? B 51.131 -12.453 -14.796 1.000 2 B 48.746 1 ATOM 2489 C CD . LYS 140 1260 ? B 51.328 -11.849 -16.181 1.000 2 B 48.746 1 ATOM 2490 C CE . LYS 140 1260 ? B 52.637 -11.076 -16.273 1.000 2 B 48.746 1 ATOM 2491 N NZ . LYS 140 1260 ? B 52.833 -10.479 -17.627 1.000 2 B 48.746 1 ATOM 2492 N N . ARG 141 1261 ? B 47.604 -12.759 -11.751 1.000 2 B 34.215 1 ATOM 2493 C CA . ARG 141 1261 ? B 47.011 -11.525 -11.245 1.000 2 B 34.215 1 ATOM 2494 C C . ARG 141 1261 ? B 46.122 -10.873 -12.298 1.000 2 B 34.215 1 ATOM 2495 O O . ARG 141 1261 ? B 46.535 -10.702 -13.447 1.000 2 B 34.215 1 ATOM 2496 C CB . ARG 141 1261 ? B 48.102 -10.548 -10.801 1.000 2 B 34.215 1 ATOM 2497 C CG . ARG 141 1261 ? B 47.675 -9.619 -9.676 1.000 2 B 34.215 1 ATOM 2498 C CD . ARG 141 1261 ? B 48.805 -8.691 -9.251 1.000 2 B 34.215 1 ATOM 2499 N NE . ARG 141 1261 ? B 48.723 -8.356 -7.832 1.000 2 B 34.215 1 ATOM 2500 C CZ . ARG 141 1261 ? B 49.582 -7.570 -7.188 1.000 2 B 34.215 1 ATOM 2501 N NH1 . ARG 141 1261 ? B 50.609 -7.022 -7.826 1.000 2 B 34.215 1 ATOM 2502 N NH2 . ARG 141 1261 ? B 49.413 -7.331 -5.896 1.000 2 B 34.215 1 ATOM 2503 N N . ALA 142 1262 ? B 44.822 -10.974 -12.221 1.000 2 B 44.111 1 ATOM 2504 C CA . ALA 142 1262 ? B 44.027 -9.758 -12.374 1.000 2 B 44.111 1 ATOM 2505 C C . ALA 142 1262 ? B 42.637 -9.932 -11.769 1.000 2 B 44.111 1 ATOM 2506 O O . ALA 142 1262 ? B 41.897 -10.842 -12.149 1.000 2 B 44.111 1 ATOM 2507 C CB . ALA 142 1262 ? B 43.919 -9.376 -13.848 1.000 2 B 44.111 1 ATOM 2508 N N . GLU 143 1263 ? B 42.459 -9.829 -10.485 1.000 2 B 38.654 1 ATOM 2509 C CA . GLU 143 1263 ? B 41.424 -9.102 -9.755 1.000 2 B 38.654 1 ATOM 2510 C C . GLU 143 1263 ? B 40.913 -7.911 -10.561 1.000 2 B 38.654 1 ATOM 2511 O O . GLU 143 1263 ? B 41.668 -6.980 -10.849 1.000 2 B 38.654 1 ATOM 2512 C CB . GLU 143 1263 ? B 41.954 -8.631 -8.398 1.000 2 B 38.654 1 ATOM 2513 C CG . GLU 143 1263 ? B 41.735 -9.630 -7.272 1.000 2 B 38.654 1 ATOM 2514 C CD . GLU 143 1263 ? B 41.983 -9.043 -5.892 1.000 2 B 38.654 1 ATOM 2515 O OE1 . GLU 143 1263 ? B 41.525 -9.636 -4.888 1.000 2 B 38.654 1 ATOM 2516 O OE2 . GLU 143 1263 ? B 42.639 -7.981 -5.813 1.000 2 B 38.654 1 ATOM 2517 N N . ALA 144 1264 ? B 40.226 -8.095 -11.694 1.000 2 B 41.395 1 ATOM 2518 C CA . ALA 144 1264 ? B 39.362 -7.054 -12.244 1.000 2 B 41.395 1 ATOM 2519 C C . ALA 144 1264 ? B 37.891 -7.440 -12.120 1.000 2 B 41.395 1 ATOM 2520 O O . ALA 144 1264 ? B 37.481 -8.505 -12.587 1.000 2 B 41.395 1 ATOM 2521 C CB . ALA 144 1264 ? B 39.717 -6.785 -13.705 1.000 2 B 41.395 1 ATOM 2522 N N . LYS 145 1265 ? B 37.283 -7.338 -10.966 1.000 2 B 44.941 1 ATOM 2523 C CA . LYS 145 1265 ? B 36.045 -6.643 -10.625 1.000 2 B 44.941 1 ATOM 2524 C C . LYS 145 1265 ? B 35.397 -6.033 -11.865 1.000 2 B 44.941 1 ATOM 2525 O O . LYS 145 1265 ? B 36.019 -5.233 -12.566 1.000 2 B 44.941 1 ATOM 2526 C CB . LYS 145 1265 ? B 36.309 -5.555 -9.582 1.000 2 B 44.941 1 ATOM 2527 C CG . LYS 145 1265 ? B 35.496 -5.711 -8.306 1.000 2 B 44.941 1 ATOM 2528 C CD . LYS 145 1265 ? B 35.846 -4.635 -7.285 1.000 2 B 44.941 1 ATOM 2529 C CE . LYS 145 1265 ? B 35.024 -4.782 -6.012 1.000 2 B 44.941 1 ATOM 2530 N NZ . LYS 145 1265 ? B 35.302 -3.680 -5.043 1.000 2 B 44.941 1 ATOM 2531 N N . GLY 146 1266 ? B 34.663 -6.721 -12.700 1.000 2 B 43.450 1 ATOM 2532 C CA . GLY 146 1266 ? B 33.496 -6.121 -13.327 1.000 2 B 43.450 1 ATOM 2533 C C . GLY 146 1266 ? B 33.103 -6.798 -14.626 1.000 2 B 43.450 1 ATOM 2534 O O . GLY 146 1266 ? B 33.933 -6.964 -15.522 1.000 2 B 43.450 1 ATOM 2535 N N . ASN 147 1267 ? B 32.257 -7.835 -14.650 1.000 2 B 43.347 1 ATOM 2536 C CA . ASN 147 1267 ? B 31.145 -7.814 -15.595 1.000 2 B 43.347 1 ATOM 2537 C C . ASN 147 1267 ? B 30.558 -9.208 -15.801 1.000 2 B 43.347 1 ATOM 2538 O O . ASN 147 1267 ? B 31.164 -10.049 -16.467 1.000 2 B 43.347 1 ATOM 2539 C CB . ASN 147 1267 ? B 31.589 -7.223 -16.934 1.000 2 B 43.347 1 ATOM 2540 C CG . ASN 147 1267 ? B 32.128 -5.812 -16.800 1.000 2 B 43.347 1 ATOM 2541 O OD1 . ASN 147 1267 ? B 32.679 -5.441 -15.760 1.000 2 B 43.347 1 ATOM 2542 N ND2 . ASN 147 1267 ? B 31.973 -5.015 -17.850 1.000 2 B 43.347 1 ATOM 2543 N N . ARG 148 1268 ? B 30.023 -9.796 -14.881 1.000 2 B 60.331 1 ATOM 2544 C CA . ARG 148 1268 ? B 29.043 -10.871 -14.986 1.000 2 B 60.331 1 ATOM 2545 C C . ARG 148 1268 ? B 27.856 -10.449 -15.846 1.000 2 B 60.331 1 ATOM 2546 O O . ARG 148 1268 ? B 27.114 -9.534 -15.481 1.000 2 B 60.331 1 ATOM 2547 C CB . ARG 148 1268 ? B 28.559 -11.296 -13.598 1.000 2 B 60.331 1 ATOM 2548 C CG . ARG 148 1268 ? B 27.910 -12.670 -13.565 1.000 2 B 60.331 1 ATOM 2549 C CD . ARG 148 1268 ? B 27.424 -13.031 -12.168 1.000 2 B 60.331 1 ATOM 2550 N NE . ARG 148 1268 ? B 28.323 -13.978 -11.513 1.000 2 B 60.331 1 ATOM 2551 C CZ . ARG 148 1268 ? B 27.977 -15.198 -11.112 1.000 2 B 60.331 1 ATOM 2552 N NH1 . ARG 148 1268 ? B 26.740 -15.646 -11.293 1.000 2 B 60.331 1 ATOM 2553 N NH2 . ARG 148 1268 ? B 28.875 -15.977 -10.527 1.000 2 B 60.331 1 ATOM 2554 N N . SER 149 1269 ? B 27.994 -9.953 -17.114 1.000 2 B 45.695 1 ATOM 2555 C CA . SER 149 1269 ? B 27.218 -9.935 -18.350 1.000 2 B 45.695 1 ATOM 2556 C C . SER 149 1269 ? B 26.563 -11.287 -18.611 1.000 2 B 45.695 1 ATOM 2557 O O . SER 149 1269 ? B 27.220 -12.327 -18.533 1.000 2 B 45.695 1 ATOM 2558 C CB . SER 149 1269 ? B 28.106 -9.553 -19.535 1.000 2 B 45.695 1 ATOM 2559 O OG . SER 149 1269 ? B 28.848 -8.380 -19.250 1.000 2 B 45.695 1 ATOM 2560 N N . TRP 150 1270 ? B 25.426 -11.657 -18.043 1.000 2 B 31.222 1 ATOM 2561 C CA . TRP 150 1270 ? B 24.467 -12.669 -18.474 1.000 2 B 31.222 1 ATOM 2562 C C . TRP 150 1270 ? B 24.339 -12.686 -19.994 1.000 2 B 31.222 1 ATOM 2563 O O . TRP 150 1270 ? B 24.116 -11.644 -20.615 1.000 2 B 31.222 1 ATOM 2564 C CB . TRP 150 1270 ? B 23.097 -12.420 -17.837 1.000 2 B 31.222 1 ATOM 2565 C CG . TRP 150 1270 ? B 23.084 -12.565 -16.345 1.000 2 B 31.222 1 ATOM 2566 C CD1 . TRP 150 1270 ? B 23.194 -11.566 -15.418 1.000 2 B 31.222 1 ATOM 2567 C CD2 . TRP 150 1270 ? B 22.959 -13.785 -15.607 1.000 2 B 31.222 1 ATOM 2568 N NE1 . TRP 150 1270 ? B 23.144 -12.091 -14.148 1.000 2 B 31.222 1 ATOM 2569 C CE2 . TRP 150 1270 ? B 23.000 -13.449 -14.235 1.000 2 B 31.222 1 ATOM 2570 C CE3 . TRP 150 1270 ? B 22.815 -15.130 -15.972 1.000 2 B 31.222 1 ATOM 2571 C CZ2 . TRP 150 1270 ? B 22.902 -14.412 -13.228 1.000 2 B 31.222 1 ATOM 2572 C CZ3 . TRP 150 1270 ? B 22.717 -16.086 -14.968 1.000 2 B 31.222 1 ATOM 2573 C CH2 . TRP 150 1270 ? B 22.762 -15.720 -13.613 1.000 2 B 31.222 1 ATOM 2574 N N . SER 151 1271 ? B 25.221 -13.290 -20.756 1.000 2 B 39.725 1 ATOM 2575 C CA . SER 151 1271 ? B 25.258 -13.850 -22.103 1.000 2 B 39.725 1 ATOM 2576 C C . SER 151 1271 ? B 23.864 -14.254 -22.572 1.000 2 B 39.725 1 ATOM 2577 O O . SER 151 1271 ? B 23.162 -14.996 -21.882 1.000 2 B 39.725 1 ATOM 2578 C CB . SER 151 1271 ? B 26.193 -15.060 -22.155 1.000 2 B 39.725 1 ATOM 2579 O OG . SER 151 1271 ? B 25.997 -15.896 -21.027 1.000 2 B 39.725 1 ATOM 2580 N N . GLU 152 1272 ? B 23.111 -13.402 -23.208 1.000 2 B 42.026 1 ATOM 2581 C CA . GLU 152 1272 ? B 22.136 -13.563 -24.283 1.000 2 B 42.026 1 ATOM 2582 C C . GLU 152 1272 ? B 22.669 -14.484 -25.377 1.000 2 B 42.026 1 ATOM 2583 O O . GLU 152 1272 ? B 23.730 -14.228 -25.950 1.000 2 B 42.026 1 ATOM 2584 C CB . GLU 152 1272 ? B 21.761 -12.203 -24.878 1.000 2 B 42.026 1 ATOM 2585 C CG . GLU 152 1272 ? B 20.439 -12.204 -25.630 1.000 2 B 42.026 1 ATOM 2586 C CD . GLU 152 1272 ? B 19.984 -10.814 -26.047 1.000 2 B 42.026 1 ATOM 2587 O OE1 . GLU 152 1272 ? B 19.908 -10.541 -27.267 1.000 2 B 42.026 1 ATOM 2588 O OE2 . GLU 152 1272 ? B 19.703 -9.992 -25.147 1.000 2 B 42.026 1 ATOM 2589 N N . GLU 153 1273 ? B 22.921 -15.690 -25.186 1.000 2 B 41.224 1 ATOM 2590 C CA . GLU 153 1273 ? B 22.861 -16.852 -26.068 1.000 2 B 41.224 1 ATOM 2591 C C . GLU 153 1273 ? B 22.021 -16.561 -27.308 1.000 2 B 41.224 1 ATOM 2592 O O . GLU 153 1273 ? B 20.910 -16.038 -27.203 1.000 2 B 41.224 1 ATOM 2593 C CB . GLU 153 1273 ? B 22.296 -18.064 -25.323 1.000 2 B 41.224 1 ATOM 2594 C CG . GLU 153 1273 ? B 22.362 -19.360 -26.118 1.000 2 B 41.224 1 ATOM 2595 C CD . GLU 153 1273 ? B 23.074 -20.482 -25.378 1.000 2 B 41.224 1 ATOM 2596 O OE1 . GLU 153 1273 ? B 23.163 -21.607 -25.922 1.000 2 B 41.224 1 ATOM 2597 O OE2 . GLU 153 1273 ? B 23.545 -20.235 -24.246 1.000 2 B 41.224 1 ATOM 2598 N N . SER 154 1274 ? B 22.576 -16.018 -28.413 1.000 2 B 36.581 1 ATOM 2599 C CA . SER 154 1274 ? B 22.838 -16.438 -29.786 1.000 2 B 36.581 1 ATOM 2600 C C . SER 154 1274 ? B 21.549 -16.519 -30.596 1.000 2 B 36.581 1 ATOM 2601 O O . SER 154 1274 ? B 20.726 -17.411 -30.375 1.000 2 B 36.581 1 ATOM 2602 C CB . SER 154 1274 ? B 23.548 -17.793 -29.806 1.000 2 B 36.581 1 ATOM 2603 O OG . SER 154 1274 ? B 24.824 -17.701 -29.196 1.000 2 B 36.581 1 ATOM 2604 N N . LEU 155 1275 ? B 20.885 -15.460 -30.865 1.000 2 B 43.154 1 ATOM 2605 C CA . LEU 155 1275 ? B 20.003 -15.493 -32.026 1.000 2 B 43.154 1 ATOM 2606 C C . LEU 155 1275 ? B 20.774 -15.179 -33.304 1.000 2 B 43.154 1 ATOM 2607 O O . LEU 155 1275 ? B 21.419 -14.133 -33.403 1.000 2 B 43.154 1 ATOM 2608 C CB . LEU 155 1275 ? B 18.852 -14.499 -31.853 1.000 2 B 43.154 1 ATOM 2609 C CG . LEU 155 1275 ? B 17.902 -14.758 -30.683 1.000 2 B 43.154 1 ATOM 2610 C CD1 . LEU 155 1275 ? B 16.902 -13.614 -30.548 1.000 2 B 43.154 1 ATOM 2611 C CD2 . LEU 155 1275 ? B 17.179 -16.088 -30.865 1.000 2 B 43.154 1 ATOM 2612 N N . LYS 156 1276 ? B 21.632 -16.024 -33.796 1.000 2 B 34.721 1 ATOM 2613 C CA . LYS 156 1276 ? B 21.979 -16.334 -35.180 1.000 2 B 34.721 1 ATOM 2614 C C . LYS 156 1276 ? B 21.113 -15.542 -36.155 1.000 2 B 34.721 1 ATOM 2615 O O . LYS 156 1276 ? B 19.892 -15.713 -36.190 1.000 2 B 34.721 1 ATOM 2616 C CB . LYS 156 1276 ? B 21.832 -17.833 -35.447 1.000 2 B 34.721 1 ATOM 2617 C CG . LYS 156 1276 ? B 23.004 -18.668 -34.953 1.000 2 B 34.721 1 ATOM 2618 C CD . LYS 156 1276 ? B 23.193 -19.922 -35.798 1.000 2 B 34.721 1 ATOM 2619 C CE . LYS 156 1276 ? B 24.409 -20.720 -35.350 1.000 2 B 34.721 1 ATOM 2620 N NZ . LYS 156 1276 ? B 24.457 -22.066 -35.997 1.000 2 B 34.721 1 ATOM 2621 N N . PRO 157 1277 ? B 21.462 -14.354 -36.673 1.000 2 B 39.442 1 ATOM 2622 C CA . PRO 157 1277 ? B 20.910 -14.170 -38.016 1.000 2 B 39.442 1 ATOM 2623 C C . PRO 157 1277 ? B 21.881 -14.590 -39.117 1.000 2 B 39.442 1 ATOM 2624 O O . PRO 157 1277 ? B 23.095 -14.426 -38.970 1.000 2 B 39.442 1 ATOM 2625 C CB . PRO 157 1277 ? B 20.631 -12.666 -38.080 1.000 2 B 39.442 1 ATOM 2626 C CG . PRO 157 1277 ? B 21.593 -12.058 -37.111 1.000 2 B 39.442 1 ATOM 2627 C CD . PRO 157 1277 ? B 22.327 -13.165 -36.409 1.000 2 B 39.442 1 ATOM 2628 N N . SER 158 1278 ? B 21.889 -15.821 -39.493 1.000 2 B 35.134 1 ATOM 2629 C CA . SER 158 1278 ? B 22.039 -16.382 -40.832 1.000 2 B 35.134 1 ATOM 2630 C C . SER 158 1278 ? B 21.863 -15.311 -41.903 1.000 2 B 35.134 1 ATOM 2631 O O . SER 158 1278 ? B 20.957 -14.479 -41.814 1.000 2 B 35.134 1 ATOM 2632 C CB . SER 158 1278 ? B 21.031 -17.510 -41.057 1.000 2 B 35.134 1 ATOM 2633 O OG . SER 158 1278 ? B 20.280 -17.756 -39.880 1.000 2 B 35.134 1 ATOM 2634 N N . ASP 159 1279 ? B 22.960 -14.896 -42.592 1.000 2 B 37.118 1 ATOM 2635 C CA . ASP 159 1279 ? B 23.080 -15.010 -44.042 1.000 2 B 37.118 1 ATOM 2636 C C . ASP 159 1279 ? B 23.738 -13.768 -44.638 1.000 2 B 37.118 1 ATOM 2637 O O . ASP 159 1279 ? B 23.286 -12.645 -44.402 1.000 2 B 37.118 1 ATOM 2638 C CB . ASP 159 1279 ? B 21.706 -15.233 -44.678 1.000 2 B 37.118 1 ATOM 2639 C CG . ASP 159 1279 ? B 21.779 -15.969 -46.004 1.000 2 B 37.118 1 ATOM 2640 O OD1 . ASP 159 1279 ? B 22.864 -16.477 -46.361 1.000 2 B 37.118 1 ATOM 2641 O OD2 . ASP 159 1279 ? B 20.743 -16.038 -46.701 1.000 2 B 37.118 1 ATOM 2642 N N . ASN 160 1280 ? B 25.059 -13.771 -44.834 1.000 2 B 35.334 1 ATOM 2643 C CA . ASN 160 1280 ? B 25.790 -13.763 -46.097 1.000 2 B 35.334 1 ATOM 2644 C C . ASN 160 1280 ? B 25.971 -12.345 -46.630 1.000 2 B 35.334 1 ATOM 2645 O O . ASN 160 1280 ? B 25.014 -11.571 -46.686 1.000 2 B 35.334 1 ATOM 2646 C CB . ASN 160 1280 ? B 25.078 -14.634 -47.134 1.000 2 B 35.334 1 ATOM 2647 C CG . ASN 160 1280 ? B 25.953 -15.758 -47.652 1.000 2 B 35.334 1 ATOM 2648 O OD1 . ASN 160 1280 ? B 27.143 -15.833 -47.333 1.000 2 B 35.334 1 ATOM 2649 N ND2 . ASN 160 1280 ? B 25.371 -16.642 -48.454 1.000 2 B 35.334 1 ATOM 2650 N N . GLU 161 1281 ? B 27.260 -11.746 -46.662 1.000 2 B 34.407 1 ATOM 2651 C CA . GLU 161 1281 ? B 28.300 -11.378 -47.617 1.000 2 B 34.407 1 ATOM 2652 C C . GLU 161 1281 ? B 27.957 -10.074 -48.332 1.000 2 B 34.407 1 ATOM 2653 O O . GLU 161 1281 ? B 26.852 -9.920 -48.855 1.000 2 B 34.407 1 ATOM 2654 C CB . GLU 161 1281 ? B 28.514 -12.498 -48.638 1.000 2 B 34.407 1 ATOM 2655 C CG . GLU 161 1281 ? B 29.972 -12.891 -48.825 1.000 2 B 34.407 1 ATOM 2656 C CD . GLU 161 1281 ? B 30.192 -13.849 -49.985 1.000 2 B 34.407 1 ATOM 2657 O OE1 . GLU 161 1281 ? B 30.487 -13.383 -51.109 1.000 2 B 34.407 1 ATOM 2658 O OE2 . GLU 161 1281 ? B 30.067 -15.075 -49.768 1.000 2 B 34.407 1 ATOM 2659 N N . GLN 162 1282 ? B 28.429 -8.896 -47.880 1.000 2 B 39.503 1 ATOM 2660 C CA . GLN 162 1282 ? B 29.057 -7.887 -48.726 1.000 2 B 39.503 1 ATOM 2661 C C . GLN 162 1282 ? B 29.200 -6.560 -47.985 1.000 2 B 39.503 1 ATOM 2662 O O . GLN 162 1282 ? B 28.233 -6.059 -47.408 1.000 2 B 39.503 1 ATOM 2663 C CB . GLN 162 1282 ? B 28.253 -7.686 -50.012 1.000 2 B 39.503 1 ATOM 2664 C CG . GLN 162 1282 ? B 28.372 -8.841 -50.997 1.000 2 B 39.503 1 ATOM 2665 C CD . GLN 162 1282 ? B 27.700 -8.550 -52.326 1.000 2 B 39.503 1 ATOM 2666 O OE1 . GLN 162 1282 ? B 27.025 -7.528 -52.485 1.000 2 B 39.503 1 ATOM 2667 N NE2 . GLN 162 1282 ? B 27.879 -9.447 -53.290 1.000 2 B 39.503 1 ATOM 2668 N N . GLY 163 1283 ? B 30.352 -6.213 -47.282 1.000 2 B 37.662 1 ATOM 2669 C CA . GLY 163 1283 ? B 31.055 -4.994 -47.651 1.000 2 B 37.662 1 ATOM 2670 C C . GLY 163 1283 ? B 31.275 -4.054 -46.481 1.000 2 B 37.662 1 ATOM 2671 O O . GLY 163 1283 ? B 30.328 -3.701 -45.776 1.000 2 B 37.662 1 ATOM 2672 N N . LEU 164 1284 ? B 32.252 -4.170 -45.655 1.000 2 B 30.507 1 ATOM 2673 C CA . LEU 164 1284 ? B 33.113 -3.157 -45.054 1.000 2 B 30.507 1 ATOM 2674 C C . LEU 164 1284 ? B 32.607 -1.755 -45.375 1.000 2 B 30.507 1 ATOM 2675 O O . LEU 164 1284 ? B 32.199 -1.481 -46.506 1.000 2 B 30.507 1 ATOM 2676 C CB . LEU 164 1284 ? B 34.554 -3.317 -45.547 1.000 2 B 30.507 1 ATOM 2677 C CG . LEU 164 1284 ? B 35.288 -4.581 -45.095 1.000 2 B 30.507 1 ATOM 2678 C CD1 . LEU 164 1284 ? B 36.619 -4.711 -45.829 1.000 2 B 30.507 1 ATOM 2679 C CD2 . LEU 164 1284 ? B 35.503 -4.564 -43.586 1.000 2 B 30.507 1 ATOM 2680 N N . PRO 165 1285 ? B 32.822 -0.802 -44.399 1.000 2 B 45.475 1 ATOM 2681 C CA . PRO 165 1285 ? B 34.009 -0.007 -44.076 1.000 2 B 45.475 1 ATOM 2682 C C . PRO 165 1285 ? B 34.042 0.438 -42.615 1.000 2 B 45.475 1 ATOM 2683 O O . PRO 165 1285 ? B 32.994 0.528 -41.970 1.000 2 B 45.475 1 ATOM 2684 C CB . PRO 165 1285 ? B 33.890 1.199 -45.011 1.000 2 B 45.475 1 ATOM 2685 C CG . PRO 165 1285 ? B 32.423 1.465 -45.108 1.000 2 B 45.475 1 ATOM 2686 C CD . PRO 165 1285 ? B 31.691 0.375 -44.379 1.000 2 B 45.475 1 ATOM 2687 N N . VAL 166 1286 ? B 35.051 0.082 -41.832 1.000 2 B 33.562 1 ATOM 2688 C CA . VAL 166 1286 ? B 36.080 0.656 -40.972 1.000 2 B 33.562 1 ATOM 2689 C C . VAL 166 1286 ? B 36.201 2.155 -41.239 1.000 2 B 33.562 1 ATOM 2690 O O . VAL 166 1286 ? B 36.304 2.579 -42.393 1.000 2 B 33.562 1 ATOM 2691 C CB . VAL 166 1286 ? B 37.446 -0.034 -41.181 1.000 2 B 33.562 1 ATOM 2692 C CG1 . VAL 166 1286 ? B 38.540 0.680 -40.389 1.000 2 B 33.562 1 ATOM 2693 C CG2 . VAL 166 1286 ? B 37.367 -1.506 -40.781 1.000 2 B 33.562 1 ATOM 2694 N N . PHE 167 1287 ? B 35.561 3.060 -40.529 1.000 2 B 37.426 1 ATOM 2695 C CA . PHE 167 1287 ? B 36.107 4.405 -40.395 1.000 2 B 37.426 1 ATOM 2696 C C . PHE 167 1287 ? B 36.077 4.860 -38.941 1.000 2 B 37.426 1 ATOM 2697 O O . PHE 167 1287 ? B 35.033 4.800 -38.288 1.000 2 B 37.426 1 ATOM 2698 C CB . PHE 167 1287 ? B 35.328 5.393 -41.270 1.000 2 B 37.426 1 ATOM 2699 C CG . PHE 167 1287 ? B 35.756 5.394 -42.712 1.000 2 B 37.426 1 ATOM 2700 C CD1 . PHE 167 1287 ? B 36.929 6.028 -43.104 1.000 2 B 37.426 1 ATOM 2701 C CD2 . PHE 167 1287 ? B 34.985 4.760 -43.678 1.000 2 B 37.426 1 ATOM 2702 C CE1 . PHE 167 1287 ? B 37.327 6.031 -44.438 1.000 2 B 37.426 1 ATOM 2703 C CE2 . PHE 167 1287 ? B 35.377 4.759 -45.014 1.000 2 B 37.426 1 ATOM 2704 C CZ . PHE 167 1287 ? B 36.548 5.396 -45.392 1.000 2 B 37.426 1 ATOM 2705 N N . SER 168 1288 ? B 37.177 4.751 -38.201 1.000 2 B 35.952 1 ATOM 2706 C CA . SER 168 1288 ? B 38.110 5.578 -37.443 1.000 2 B 35.952 1 ATOM 2707 C C . SER 168 1288 ? B 38.117 7.014 -37.956 1.000 2 B 35.952 1 ATOM 2708 O O . SER 168 1288 ? B 38.343 7.253 -39.144 1.000 2 B 35.952 1 ATOM 2709 C CB . SER 168 1288 ? B 39.522 4.996 -37.512 1.000 2 B 35.952 1 ATOM 2710 O OG . SER 168 1288 ? B 39.563 3.704 -36.930 1.000 2 B 35.952 1 ATOM 2711 N N . GLY 169 1289 ? B 37.395 7.991 -37.415 1.000 2 B 34.169 1 ATOM 2712 C CA . GLY 169 1289 ? B 37.949 9.336 -37.456 1.000 2 B 34.169 1 ATOM 2713 C C . GLY 169 1289 ? B 37.123 10.345 -36.681 1.000 2 B 34.169 1 ATOM 2714 O O . GLY 169 1289 ? B 35.911 10.447 -36.880 1.000 2 B 34.169 1 ATOM 2715 N N . SER 170 1290 ? B 37.369 10.565 -35.476 1.000 2 B 33.139 1 ATOM 2716 C CA . SER 170 1290 ? B 37.539 11.845 -34.796 1.000 2 B 33.139 1 ATOM 2717 C C . SER 170 1290 ? B 37.449 13.009 -35.777 1.000 2 B 33.139 1 ATOM 2718 O O . SER 170 1290 ? B 38.073 12.982 -36.840 1.000 2 B 33.139 1 ATOM 2719 C CB . SER 170 1290 ? B 38.880 11.889 -34.063 1.000 2 B 33.139 1 ATOM 2720 O OG . SER 170 1290 ? B 39.579 13.085 -34.362 1.000 2 B 33.139 1 ATOM 2721 N N . PRO 171 1291 ? B 36.613 14.008 -35.562 1.000 2 B 47.150 1 ATOM 2722 C CA . PRO 171 1291 ? B 36.927 15.342 -36.080 1.000 2 B 47.150 1 ATOM 2723 C C . PRO 171 1291 ? B 37.176 16.362 -34.972 1.000 2 B 47.150 1 ATOM 2724 O O . PRO 171 1291 ? B 36.636 16.227 -33.871 1.000 2 B 47.150 1 ATOM 2725 C CB . PRO 171 1291 ? B 35.681 15.708 -36.890 1.000 2 B 47.150 1 ATOM 2726 C CG . PRO 171 1291 ? B 34.558 14.994 -36.208 1.000 2 B 47.150 1 ATOM 2727 C CD . PRO 171 1291 ? B 35.128 14.166 -35.092 1.000 2 B 47.150 1 ATOM 2728 N N . PRO 172 1292 ? B 38.156 17.286 -35.047 1.000 2 B 38.226 1 ATOM 2729 C CA . PRO 172 1292 ? B 39.037 18.372 -34.610 1.000 2 B 38.226 1 ATOM 2730 C C . PRO 172 1292 ? B 38.291 19.688 -34.400 1.000 2 B 38.226 1 ATOM 2731 O O . PRO 172 1292 ? B 37.205 19.881 -34.951 1.000 2 B 38.226 1 ATOM 2732 C CB . PRO 172 1292 ? B 40.044 18.492 -35.756 1.000 2 B 38.226 1 ATOM 2733 C CG . PRO 172 1292 ? B 39.258 18.185 -36.989 1.000 2 B 38.226 1 ATOM 2734 C CD . PRO 172 1292 ? B 37.880 17.750 -36.581 1.000 2 B 38.226 1 ATOM 2735 N N . MET 173 1293 ? B 38.475 20.365 -33.218 1.000 2 B 32.899 1 ATOM 2736 C CA . MET 173 1293 ? B 38.832 21.681 -32.694 1.000 2 B 32.899 1 ATOM 2737 C C . MET 173 1293 ? B 38.863 22.721 -33.809 1.000 2 B 32.899 1 ATOM 2738 O O . MET 173 1293 ? B 39.462 22.491 -34.861 1.000 2 B 32.899 1 ATOM 2739 C CB . MET 173 1293 ? B 40.188 21.629 -31.988 1.000 2 B 32.899 1 ATOM 2740 C CG . MET 173 1293 ? B 40.207 20.731 -30.762 1.000 2 B 32.899 1 ATOM 2741 S SD . MET 173 1293 ? B 40.707 21.627 -29.241 1.000 2 B 32.899 1 ATOM 2742 C CE . MET 173 1293 ? B 39.868 20.621 -27.985 1.000 2 B 32.899 1 ATOM 2743 N N . LYS 174 1294 ? B 37.893 23.659 -33.840 1.000 2 B 38.699 1 ATOM 2744 C CA . LYS 174 1294 ? B 37.975 25.004 -34.401 1.000 2 B 38.699 1 ATOM 2745 C C . LYS 174 1294 ? B 37.189 26.002 -33.555 1.000 2 B 38.699 1 ATOM 2746 O O . LYS 174 1294 ? B 36.028 25.761 -33.220 1.000 2 B 38.699 1 ATOM 2747 C CB . LYS 174 1294 ? B 37.459 25.018 -35.841 1.000 2 B 38.699 1 ATOM 2748 C CG . LYS 174 1294 ? B 38.091 23.961 -36.735 1.000 2 B 38.699 1 ATOM 2749 C CD . LYS 174 1294 ? B 37.407 23.897 -38.095 1.000 2 B 38.699 1 ATOM 2750 C CE . LYS 174 1294 ? B 38.038 22.840 -38.990 1.000 2 B 38.699 1 ATOM 2751 N NZ . LYS 174 1294 ? B 37.517 22.914 -40.388 1.000 2 B 38.699 1 ATOM 2752 N N . SER 175 1295 ? B 37.779 26.735 -32.675 1.000 2 B 29.630 1 ATOM 2753 C CA . SER 175 1295 ? B 38.199 28.113 -32.440 1.000 2 B 29.630 1 ATOM 2754 C C . SER 175 1295 ? B 37.736 29.032 -33.566 1.000 2 B 29.630 1 ATOM 2755 O O . SER 175 1295 ? B 37.859 28.690 -34.744 1.000 2 B 29.630 1 ATOM 2756 C CB . SER 175 1295 ? B 39.719 28.194 -32.298 1.000 2 B 29.630 1 ATOM 2757 O OG . SER 175 1295 ? B 40.151 27.524 -31.126 1.000 2 B 29.630 1 ATOM 2758 N N . LEU 176 1296 ? B 36.831 30.049 -33.279 1.000 2 B 44.639 1 ATOM 2759 C CA . LEU 176 1296 ? B 36.829 31.465 -33.627 1.000 2 B 44.639 1 ATOM 2760 C C . LEU 176 1296 ? B 35.579 32.155 -33.093 1.000 2 B 44.639 1 ATOM 2761 O O . LEU 176 1296 ? B 34.463 31.668 -33.292 1.000 2 B 44.639 1 ATOM 2762 C CB . LEU 176 1296 ? B 36.916 31.645 -35.145 1.000 2 B 44.639 1 ATOM 2763 C CG . LEU 176 1296 ? B 38.155 31.063 -35.827 1.000 2 B 44.639 1 ATOM 2764 C CD1 . LEU 176 1296 ? B 37.993 31.101 -37.343 1.000 2 B 44.639 1 ATOM 2765 C CD2 . LEU 176 1296 ? B 39.407 31.821 -35.399 1.000 2 B 44.639 1 ATOM 2766 N N . SER 177 1297 ? B 35.668 33.115 -32.132 1.000 2 B 32.400 1 ATOM 2767 C CA . SER 177 1297 ? B 35.751 34.571 -32.078 1.000 2 B 32.400 1 ATOM 2768 C C . SER 177 1297 ? B 34.429 35.215 -32.480 1.000 2 B 32.400 1 ATOM 2769 O O . SER 177 1297 ? B 33.831 34.838 -33.490 1.000 2 B 32.400 1 ATOM 2770 C CB . SER 177 1297 ? B 36.872 35.078 -32.986 1.000 2 B 32.400 1 ATOM 2771 O OG . SER 177 1297 ? B 38.135 34.634 -32.522 1.000 2 B 32.400 1 ATOM 2772 N N . SER 178 1298 ? B 33.700 35.986 -31.601 1.000 2 B 30.050 1 ATOM 2773 C CA . SER 178 1298 ? B 33.367 37.370 -31.279 1.000 2 B 30.050 1 ATOM 2774 C C . SER 178 1298 ? B 32.501 37.998 -32.365 1.000 2 B 30.050 1 ATOM 2775 O O . SER 178 1298 ? B 32.798 37.870 -33.555 1.000 2 B 30.050 1 ATOM 2776 C CB . SER 178 1298 ? B 34.639 38.197 -31.089 1.000 2 B 30.050 1 ATOM 2777 O OG . SER 178 1298 ? B 35.470 38.113 -32.234 1.000 2 B 30.050 1 ATOM 2778 N N . THR 179 1299 ? B 31.203 38.310 -32.087 1.000 2 B 37.935 1 ATOM 2779 C CA . THR 179 1299 ? B 30.546 39.511 -32.589 1.000 2 B 37.935 1 ATOM 2780 C C . THR 179 1299 ? B 29.350 39.878 -31.715 1.000 2 B 37.935 1 ATOM 2781 O O . THR 179 1299 ? B 28.502 39.032 -31.426 1.000 2 B 37.935 1 ATOM 2782 C CB . THR 179 1299 ? B 30.082 39.326 -34.046 1.000 2 B 37.935 1 ATOM 2783 O OG1 . THR 179 1299 ? B 29.971 40.611 -34.672 1.000 2 B 37.935 1 ATOM 2784 C CG2 . THR 179 1299 ? B 28.730 38.624 -34.108 1.000 2 B 37.935 1 ATOM 2785 N N . SER 180 1300 ? B 29.556 40.751 -30.699 1.000 2 B 27.997 1 ATOM 2786 C CA . SER 180 1300 ? B 29.206 42.135 -30.398 1.000 2 B 27.997 1 ATOM 2787 C C . SER 180 1300 ? B 28.052 42.616 -31.272 1.000 2 B 27.997 1 ATOM 2788 O O . SER 180 1300 ? B 28.024 42.348 -32.475 1.000 2 B 27.997 1 ATOM 2789 C CB . SER 180 1300 ? B 30.417 43.049 -30.590 1.000 2 B 27.997 1 ATOM 2790 O OG . SER 180 1300 ? B 30.604 43.354 -31.961 1.000 2 B 27.997 1 ATOM 2791 N N . ALA 181 1301 ? B 26.909 43.059 -30.634 1.000 2 B 41.311 1 ATOM 2792 C CA . ALA 181 1301 ? B 26.232 44.323 -30.914 1.000 2 B 41.311 1 ATOM 2793 C C . ALA 181 1301 ? B 24.833 44.343 -30.303 1.000 2 B 41.311 1 ATOM 2794 O O . ALA 181 1301 ? B 24.050 43.411 -30.500 1.000 2 B 41.311 1 ATOM 2795 C CB . ALA 181 1301 ? B 26.155 44.563 -32.420 1.000 2 B 41.311 1 ATOM 2796 N N . GLY 182 1302 ? B 24.649 44.877 -29.097 1.000 2 B 31.502 1 ATOM 2797 C CA . GLY 182 1302 ? B 24.012 46.133 -28.735 1.000 2 B 31.502 1 ATOM 2798 C C . GLY 182 1302 ? B 22.743 46.408 -29.519 1.000 2 B 31.502 1 ATOM 2799 O O . GLY 182 1302 ? B 22.761 46.426 -30.752 1.000 2 B 31.502 1 ATOM 2800 N N . GLY 183 1303 ? B 21.496 46.179 -28.988 1.000 2 B 37.787 1 ATOM 2801 C CA . GLY 183 1303 ? B 20.379 47.066 -29.273 1.000 2 B 37.787 1 ATOM 2802 C C . GLY 183 1303 ? B 19.266 46.971 -28.248 1.000 2 B 37.787 1 ATOM 2803 O O . GLY 183 1303 ? B 18.936 45.879 -27.780 1.000 2 B 37.787 1 ATOM 2804 N N . LYS 184 1304 ? B 19.249 47.811 -27.216 1.000 2 B 33.255 1 ATOM 2805 C CA . LYS 184 1304 ? B 18.469 48.949 -26.736 1.000 2 B 33.255 1 ATOM 2806 C C . LYS 184 1304 ? B 17.094 48.990 -27.395 1.000 2 B 33.255 1 ATOM 2807 O O . LYS 184 1304 ? B 16.981 48.862 -28.616 1.000 2 B 33.255 1 ATOM 2808 C CB . LYS 184 1304 ? B 19.215 50.259 -26.996 1.000 2 B 33.255 1 ATOM 2809 C CG . LYS 184 1304 ? B 20.501 50.408 -26.197 1.000 2 B 33.255 1 ATOM 2810 C CD . LYS 184 1304 ? B 21.127 51.782 -26.397 1.000 2 B 33.255 1 ATOM 2811 C CE . LYS 184 1304 ? B 22.251 52.035 -25.402 1.000 2 B 33.255 1 ATOM 2812 N NZ . LYS 184 1304 ? B 22.777 53.430 -25.503 1.000 2 B 33.255 1 ATOM 2813 N N . LYS 185 1305 ? B 15.987 48.670 -26.712 1.000 2 B 39.218 1 ATOM 2814 C CA . LYS 185 1305 ? B 14.731 49.414 -26.677 1.000 2 B 39.218 1 ATOM 2815 C C . LYS 185 1305 ? B 13.536 48.471 -26.581 1.000 2 B 39.218 1 ATOM 2816 O O . LYS 185 1305 ? B 13.440 47.502 -27.337 1.000 2 B 39.218 1 ATOM 2817 C CB . LYS 185 1305 ? B 14.599 50.303 -27.915 1.000 2 B 39.218 1 ATOM 2818 C CG . LYS 185 1305 ? B 15.559 51.484 -27.934 1.000 2 B 39.218 1 ATOM 2819 C CD . LYS 185 1305 ? B 15.096 52.564 -28.904 1.000 2 B 39.218 1 ATOM 2820 C CE . LYS 185 1305 ? B 16.009 53.782 -28.862 1.000 2 B 39.218 1 ATOM 2821 N NZ . LYS 185 1305 ? B 15.539 54.859 -29.784 1.000 2 B 39.218 1 ATOM 2822 N N . GLN 186 1306 ? B 12.924 48.361 -25.395 1.000 2 B 34.430 1 ATOM 2823 C CA . GLN 186 1306 ? B 11.575 48.848 -25.124 1.000 2 B 34.430 1 ATOM 2824 C C . GLN 186 1306 ? B 10.529 47.794 -25.476 1.000 2 B 34.430 1 ATOM 2825 O O . GLN 186 1306 ? B 10.510 47.281 -26.597 1.000 2 B 34.430 1 ATOM 2826 C CB . GLN 186 1306 ? B 11.303 50.137 -25.900 1.000 2 B 34.430 1 ATOM 2827 C CG . GLN 186 1306 ? B 10.048 50.873 -25.450 1.000 2 B 34.430 1 ATOM 2828 C CD . GLN 186 1306 ? B 9.934 52.261 -26.052 1.000 2 B 34.430 1 ATOM 2829 O OE1 . GLN 186 1306 ? B 10.898 52.791 -26.612 1.000 2 B 34.430 1 ATOM 2830 N NE2 . GLN 186 1306 ? B 8.753 52.859 -25.941 1.000 2 B 34.430 1 ATOM 2831 N N . ALA 187 1307 ? B 10.076 46.987 -24.591 1.000 2 B 40.298 1 ATOM 2832 C CA . ALA 187 1307 ? B 8.625 46.841 -24.516 1.000 2 B 40.298 1 ATOM 2833 C C . ALA 187 1307 ? B 8.229 45.842 -23.432 1.000 2 B 40.298 1 ATOM 2834 O O . ALA 187 1307 ? B 8.698 44.701 -23.430 1.000 2 B 40.298 1 ATOM 2835 C CB . ALA 187 1307 ? B 8.062 46.406 -25.867 1.000 2 B 40.298 1 ATOM 2836 N N . GLN 188 1308 ? B 8.169 46.200 -22.208 1.000 2 B 30.215 1 ATOM 2837 C CA . GLN 188 1308 ? B 7.070 46.024 -21.265 1.000 2 B 30.215 1 ATOM 2838 C C . GLN 188 1308 ? B 5.724 46.018 -21.984 1.000 2 B 30.215 1 ATOM 2839 O O . GLN 188 1308 ? B 5.435 46.914 -22.780 1.000 2 B 30.215 1 ATOM 2840 C CB . GLN 188 1308 ? B 7.092 47.124 -20.203 1.000 2 B 30.215 1 ATOM 2841 C CG . GLN 188 1308 ? B 8.079 46.866 -19.071 1.000 2 B 30.215 1 ATOM 2842 C CD . GLN 188 1308 ? B 7.591 45.811 -18.097 1.000 2 B 30.215 1 ATOM 2843 O OE1 . GLN 188 1308 ? B 6.415 45.790 -17.720 1.000 2 B 30.215 1 ATOM 2844 N NE2 . GLN 188 1308 ? B 8.492 44.927 -17.680 1.000 2 B 30.215 1 ATOM 2845 N N . PRO 189 1309 ? B 4.928 44.934 -21.873 1.000 2 B 46.262 1 ATOM 2846 C CA . PRO 189 1309 ? B 3.606 44.864 -21.247 1.000 2 B 46.262 1 ATOM 2847 C C . PRO 189 1309 ? B 3.441 43.639 -20.351 1.000 2 B 46.262 1 ATOM 2848 O O . PRO 189 1309 ? B 4.126 42.631 -20.545 1.000 2 B 46.262 1 ATOM 2849 C CB . PRO 189 1309 ? B 2.653 44.799 -22.442 1.000 2 B 46.262 1 ATOM 2850 C CG . PRO 189 1309 ? B 3.388 44.005 -23.474 1.000 2 B 46.262 1 ATOM 2851 C CD . PRO 189 1309 ? B 4.777 43.737 -22.969 1.000 2 B 46.262 1 ATOM 2852 N N . SER 190 1310 ? B 3.417 43.826 -19.087 1.000 2 B 34.724 1 ATOM 2853 C CA . SER 190 1310 ? B 2.286 43.783 -18.167 1.000 2 B 34.724 1 ATOM 2854 C C . SER 190 1310 ? B 1.375 42.597 -18.465 1.000 2 B 34.724 1 ATOM 2855 O O . SER 190 1310 ? B 0.922 42.426 -19.599 1.000 2 B 34.724 1 ATOM 2856 C CB . SER 190 1310 ? B 1.485 45.084 -18.241 1.000 2 B 34.724 1 ATOM 2857 O OG . SER 190 1310 ? B 0.232 44.940 -17.594 1.000 2 B 34.724 1 ATOM 2858 N N . CYS 191 1311 ? B 1.620 41.458 -17.821 1.000 2 B 41.547 1 ATOM 2859 C CA . CYS 191 1311 ? B 0.472 40.674 -17.378 1.000 2 B 41.547 1 ATOM 2860 C C . CYS 191 1311 ? B 0.782 39.936 -16.082 1.000 2 B 41.547 1 ATOM 2861 O O . CYS 191 1311 ? B 1.790 39.233 -15.989 1.000 2 B 41.547 1 ATOM 2862 C CB . CYS 191 1311 ? B 0.056 39.675 -18.458 1.000 2 B 41.547 1 ATOM 2863 S SG . CYS 191 1311 ? B -1.654 39.114 -18.311 1.000 2 B 41.547 1 ATOM 2864 N N . ALA 192 1312 ? B 0.819 40.582 -14.937 1.000 2 B 43.028 1 ATOM 2865 C CA . ALA 192 1312 ? B 0.398 40.336 -13.560 1.000 2 B 43.028 1 ATOM 2866 C C . ALA 192 1312 ? B -0.296 38.983 -13.433 1.000 2 B 43.028 1 ATOM 2867 O O . ALA 192 1312 ? B -1.279 38.714 -14.128 1.000 2 B 43.028 1 ATOM 2868 C CB . ALA 192 1312 ? B -0.526 41.452 -13.079 1.000 2 B 43.028 1 ATOM 2869 N N . PRO 193 1313 ? B 0.378 37.971 -12.878 1.000 2 B 53.964 1 ATOM 2870 C CA . PRO 193 1313 ? B -0.383 36.839 -12.344 1.000 2 B 53.964 1 ATOM 2871 C C . PRO 193 1313 ? B -1.020 37.142 -10.990 1.000 2 B 53.964 1 ATOM 2872 O O . PRO 193 1313 ? B -0.457 37.898 -10.194 1.000 2 B 53.964 1 ATOM 2873 C CB . PRO 193 1313 ? B 0.669 35.735 -12.217 1.000 2 B 53.964 1 ATOM 2874 C CG . PRO 193 1313 ? B 1.977 36.457 -12.169 1.000 2 B 53.964 1 ATOM 2875 C CD . PRO 193 1313 ? B 1.764 37.861 -12.657 1.000 2 B 53.964 1 ATOM 2876 N N . ALA 194 1314 ? B -2.216 37.799 -10.955 1.000 2 B 41.963 1 ATOM 2877 C CA . ALA 194 1314 ? B -3.265 37.707 -9.943 1.000 2 B 41.963 1 ATOM 2878 C C . ALA 194 1314 ? B -2.812 36.857 -8.760 1.000 2 B 41.963 1 ATOM 2879 O O . ALA 194 1314 ? B -2.353 35.726 -8.939 1.000 2 B 41.963 1 ATOM 2880 C CB . ALA 194 1314 ? B -4.542 37.130 -10.551 1.000 2 B 41.963 1 ATOM 2881 N N . SER 195 1315 ? B -2.036 37.349 -7.925 1.000 2 B 41.932 1 ATOM 2882 C CA . SER 195 1315 ? B -1.861 37.407 -6.477 1.000 2 B 41.932 1 ATOM 2883 C C . SER 195 1315 ? B -3.160 37.075 -5.750 1.000 2 B 41.932 1 ATOM 2884 O O . SER 195 1315 ? B -4.144 37.809 -5.859 1.000 2 B 41.932 1 ATOM 2885 C CB . SER 195 1315 ? B -1.369 38.791 -6.052 1.000 2 B 41.932 1 ATOM 2886 O OG . SER 195 1315 ? B -2.341 39.448 -5.256 1.000 2 B 41.932 1 ATOM 2887 N N . ARG 196 1316 ? B -3.644 35.886 -5.782 1.000 2 B 46.959 1 ATOM 2888 C CA . ARG 196 1316 ? B -4.645 35.446 -4.815 1.000 2 B 46.959 1 ATOM 2889 C C . ARG 196 1316 ? B -4.014 35.195 -3.450 1.000 2 B 46.959 1 ATOM 2890 O O . ARG 196 1316 ? B -2.891 34.694 -3.362 1.000 2 B 46.959 1 ATOM 2891 C CB . ARG 196 1316 ? B -5.349 34.180 -5.308 1.000 2 B 46.959 1 ATOM 2892 C CG . ARG 196 1316 ? B -6.282 34.413 -6.485 1.000 2 B 46.959 1 ATOM 2893 C CD . ARG 196 1316 ? B -7.048 33.151 -6.856 1.000 2 B 46.959 1 ATOM 2894 N NE . ARG 196 1316 ? B -7.904 33.362 -8.020 1.000 2 B 46.959 1 ATOM 2895 C CZ . ARG 196 1316 ? B -9.196 33.052 -8.076 1.000 2 B 46.959 1 ATOM 2896 N NH1 . ARG 196 1316 ? B -9.809 32.508 -7.031 1.000 2 B 46.959 1 ATOM 2897 N NH2 . ARG 196 1316 ? B -9.882 33.287 -9.186 1.000 2 B 46.959 1 ATOM 2898 N N . PRO 197 1317 ? B -4.445 35.942 -2.383 1.000 2 B 42.218 1 ATOM 2899 C CA . PRO 197 1317 ? B -3.974 35.965 -0.996 1.000 2 B 42.218 1 ATOM 2900 C C . PRO 197 1317 ? B -4.013 34.588 -0.337 1.000 2 B 42.218 1 ATOM 2901 O O . PRO 197 1317 ? B -4.795 33.726 -0.746 1.000 2 B 42.218 1 ATOM 2902 C CB . PRO 197 1317 ? B -4.945 36.927 -0.308 1.000 2 B 42.218 1 ATOM 2903 C CG . PRO 197 1317 ? B -6.153 36.944 -1.189 1.000 2 B 42.218 1 ATOM 2904 C CD . PRO 197 1317 ? B -5.845 36.168 -2.437 1.000 2 B 42.218 1 ATOM 2905 N N . PRO 198 1318 ? B -2.930 34.249 0.347 1.000 2 B 49.591 1 ATOM 2906 C CA . PRO 198 1318 ? B -2.626 33.059 1.145 1.000 2 B 49.591 1 ATOM 2907 C C . PRO 198 1318 ? B -3.680 32.781 2.214 1.000 2 B 49.591 1 ATOM 2908 O O . PRO 198 1318 ? B -4.178 33.712 2.853 1.000 2 B 49.591 1 ATOM 2909 C CB . PRO 198 1318 ? B -1.277 33.398 1.783 1.000 2 B 49.591 1 ATOM 2910 C CG . PRO 198 1318 ? B -1.258 34.890 1.868 1.000 2 B 49.591 1 ATOM 2911 C CD . PRO 198 1318 ? B -2.340 35.432 0.978 1.000 2 B 49.591 1 ATOM 2912 N N . ALA 199 1319 ? B -4.787 32.139 1.917 1.000 2 B 46.869 1 ATOM 2913 C CA . ALA 199 1319 ? B -5.854 31.674 2.800 1.000 2 B 46.869 1 ATOM 2914 C C . ALA 199 1319 ? B -5.286 30.888 3.978 1.000 2 B 46.869 1 ATOM 2915 O O . ALA 199 1319 ? B -4.416 30.032 3.800 1.000 2 B 46.869 1 ATOM 2916 C CB . ALA 199 1319 ? B -6.852 30.818 2.025 1.000 2 B 46.869 1 ATOM 2917 N N . LYS 200 1320 ? B -4.813 31.436 5.115 1.000 2 B 37.223 1 ATOM 2918 C CA . LYS 200 1320 ? B -4.893 30.950 6.489 1.000 2 B 37.223 1 ATOM 2919 C C . LYS 200 1320 ? B -5.346 29.494 6.533 1.000 2 B 37.223 1 ATOM 2920 O O . LYS 200 1320 ? B -6.332 29.126 5.890 1.000 2 B 37.223 1 ATOM 2921 C CB . LYS 200 1320 ? B -5.844 31.820 7.312 1.000 2 B 37.223 1 ATOM 2922 C CG . LYS 200 1320 ? B -5.287 33.194 7.654 1.000 2 B 37.223 1 ATOM 2923 C CD . LYS 200 1320 ? B -6.368 34.114 8.208 1.000 2 B 37.223 1 ATOM 2924 C CE . LYS 200 1320 ? B -5.824 35.506 8.499 1.000 2 B 37.223 1 ATOM 2925 N NZ . LYS 200 1320 ? B -6.877 36.407 9.056 1.000 2 B 37.223 1 loop_ _atom_type.symbol C N O S loop_ _ma_entry_associated_files.id _ma_entry_associated_files.entry_id _ma_entry_associated_files.file_url _ma_entry_associated_files.file_type _ma_entry_associated_files.file_format _ma_entry_associated_files.file_content _ma_entry_associated_files.details 1 ma-t3vr3-210 https://modelarchive.org/api/projects/ma-t3vr3-210?type=materials_procedures__accompanying_data_file_name archive zip 'archive with multiple files' . loop_ _ma_associated_archive_file_details.id _ma_associated_archive_file_details.archive_file_id _ma_associated_archive_file_details.file_path _ma_associated_archive_file_details.file_format _ma_associated_archive_file_details.file_content _ma_associated_archive_file_details.description _ma_associated_archive_file_details.data_id 1 1 ma-t3vr3-210_predicted_aligned_error_v1.cif cif 'local pairwise QA scores' 'Predicted aligned error and contact probability' . 2 1 O95931-D2_Q6W2J9-D8.i95.fas fasta 'multiple sequence alignments' 'Paired MSAs' 4 loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.description _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.type_other_details _ma_qa_metric.software_group_id 1 pLDDT 'Predicted accuracy according to the CA-only lDDT in [0,100]' pLDDT global . . 2 pLDDT 'Predicted accuracy according to the CA-only lDDT in [0,100]' pLDDT local . . 3 PAE 'Predicted aligned error (in Angstroms)' PAE local-pairwise . . 4 'contact probability' 'Contact probability of a pairwise interaction in [0,1]' 'contact probability' local-pairwise . . loop_ _ma_qa_metric_global.ordinal_id _ma_qa_metric_global.model_id _ma_qa_metric_global.metric_id _ma_qa_metric_global.metric_value 1 1 1 47.091 loop_ _ma_qa_metric_local.ordinal_id _ma_qa_metric_local.model_id _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value 1 1 A 1 PRO 2 57.539 2 1 A 2 LYS 2 56.683 3 1 A 3 ARG 2 57.407 4 1 A 4 LEU 2 59.149 5 1 A 5 LEU 2 58.027 6 1 A 6 LEU 2 57.987 7 1 A 7 GLN 2 65.176 8 1 A 8 ARG 2 58.523 9 1 A 9 LEU 2 58.447 10 1 A 10 TYR 2 55.961 11 1 A 11 SER 2 56.170 12 1 A 12 MET 2 49.893 13 1 A 13 ASP 2 54.832 14 1 A 14 LEU 2 57.202 15 1 A 15 ARG 2 60.050 16 1 A 16 SER 2 55.340 17 1 A 17 SER 2 54.973 18 1 A 18 HIS 2 52.407 19 1 A 19 LYS 2 49.150 20 1 A 20 ALA 2 51.828 21 1 A 21 LYS 2 50.843 22 1 A 22 GLY 2 51.847 23 1 A 23 LYS 2 52.829 24 1 A 24 GLU 2 55.743 25 1 A 25 LYS 2 46.698 26 1 A 26 LEU 2 52.267 27 1 A 27 CYS 2 43.221 28 1 A 28 PHE 2 43.739 29 1 A 29 SER 2 41.401 30 1 A 30 LEU 2 46.661 31 1 A 31 THR 2 45.004 32 1 A 32 CYS 2 38.368 33 1 A 33 PRO 2 45.445 34 1 A 34 LEU 2 43.523 35 1 A 35 GLY 2 42.669 36 1 A 36 SER 2 38.526 37 1 A 37 GLY 2 40.587 38 1 A 38 SER 2 37.311 39 1 A 39 PRO 2 44.204 40 1 A 40 GLU 2 29.912 41 1 A 41 GLY 2 32.520 42 1 A 42 VAL 2 31.285 43 1 A 43 VAL 2 33.890 44 1 A 44 LYS 2 33.609 45 1 A 45 ALA 2 32.177 46 1 A 46 GLY 2 28.980 47 1 A 47 ALA 2 30.946 48 1 A 48 PRO 2 43.153 49 1 A 49 GLU 2 32.759 50 1 A 50 LEU 2 35.218 51 1 A 51 VAL 2 35.925 52 1 A 52 ASP 2 35.968 53 1 A 53 LYS 2 38.866 54 1 A 54 GLY 2 35.359 55 1 A 55 PRO 2 45.814 56 1 A 56 LEU 2 41.683 57 1 A 57 VAL 2 45.832 58 1 A 58 PRO 2 48.438 59 1 A 59 THR 2 47.479 60 1 A 60 LEU 2 52.980 61 1 A 61 PRO 2 60.356 62 1 A 62 PHE 2 51.122 63 1 A 63 PRO 2 49.394 64 1 A 64 LEU 2 53.882 65 1 A 65 ARG 2 51.939 66 1 A 66 LYS 2 53.710 67 1 A 67 PRO 2 54.562 68 1 A 68 ARG 2 52.047 69 1 A 69 LYS 2 57.041 70 1 A 70 ALA 2 48.312 71 1 A 71 HIS 2 46.041 72 1 A 72 LYS 2 54.896 73 1 A 73 TYR 2 44.072 74 1 A 74 LEU 2 47.357 75 1 A 75 ARG 2 51.683 76 1 A 76 LEU 2 50.360 77 1 A 77 SER 2 53.509 78 1 A 78 ARG 2 46.831 79 1 A 79 LYS 2 53.725 80 1 A 80 LYS 2 57.369 81 1 A 81 PHE 2 48.094 82 1 A 82 PRO 2 45.565 83 1 A 83 PRO 2 54.748 84 1 A 84 ARG 2 47.400 85 1 A 85 GLY 2 43.521 86 1 A 86 PRO 2 48.052 87 1 A 87 ASN 2 37.774 88 1 A 88 LEU 2 37.823 89 1 A 89 GLU 2 38.008 90 1 A 90 SER 2 44.219 91 1 A 91 HIS 2 38.521 92 1 A 92 SER 2 40.123 93 1 A 93 HIS 2 36.840 94 1 A 94 ARG 2 39.048 95 1 A 95 ARG 2 36.599 96 1 A 96 GLU 2 36.068 97 1 A 97 LEU 2 43.067 98 1 A 98 PHE 2 36.751 99 1 A 99 LEU 2 38.021 100 1 A 100 GLN 2 31.709 101 1 A 101 GLU 2 30.364 102 1 A 102 PRO 2 36.927 103 1 A 103 PRO 2 32.653 104 1 A 104 ALA 2 32.422 105 1 A 105 PRO 2 40.461 106 1 A 106 ASP 2 31.989 107 1 A 107 VAL 2 39.043 108 1 A 108 LEU 2 35.000 109 1 A 109 GLN 2 32.403 110 1 A 110 ALA 2 33.174 111 1 A 111 ALA 2 35.033 112 1 A 112 GLY 2 28.940 113 1 A 113 GLU 2 29.320 114 1 A 114 TRP 2 35.594 115 1 A 115 GLU 2 32.597 116 1 A 116 PRO 2 43.604 117 1 A 117 ALA 2 36.301 118 1 A 118 ALA 2 32.691 119 1 A 119 GLN 2 32.183 120 1 A 120 PRO 2 47.430 121 1 A 121 PRO 2 41.684 122 1 A 122 GLU 2 29.625 123 1 A 123 GLU 2 40.405 124 1 A 124 GLU 2 31.524 125 1 A 125 ALA 2 41.194 126 1 A 126 ASP 2 33.916 127 1 A 127 ALA 2 41.294 128 1 A 128 ASP 2 37.537 129 1 A 129 LEU 2 44.098 130 1 A 130 ALA 2 51.281 131 1 A 131 GLU 2 50.628 132 1 A 132 GLY 2 65.971 133 1 A 133 PRO 2 63.240 134 1 A 134 PRO 2 65.513 135 1 A 135 PRO 2 63.660 136 1 A 136 TRP 2 53.238 137 1 A 137 THR 2 60.670 138 1 A 138 PRO 2 58.581 139 1 A 139 ALA 2 64.326 140 1 A 140 LEU 2 60.612 141 1 A 141 PRO 2 64.963 142 1 A 142 SER 2 61.028 143 1 A 143 SER 2 66.321 144 1 A 144 GLU 2 69.554 145 1 A 145 VAL 2 71.752 146 1 A 146 THR 2 78.050 147 1 A 147 VAL 2 79.038 148 1 A 148 THR 2 83.611 149 1 A 149 ASP 2 83.860 150 1 A 150 ILE 2 81.827 151 1 A 151 THR 2 82.712 152 1 A 152 ALA 2 78.175 153 1 A 153 ASN 2 79.465 154 1 A 154 SER 2 81.480 155 1 A 155 ILE 2 85.548 156 1 A 156 THR 2 84.104 157 1 A 157 VAL 2 83.913 158 1 A 158 THR 2 78.050 159 1 A 159 PHE 2 72.191 160 1 A 160 ARG 2 67.086 161 1 A 161 GLU 2 59.722 162 1 A 162 ALA 2 50.630 163 1 A 163 GLN 2 47.636 164 1 A 164 ALA 2 47.163 165 1 A 165 ALA 2 45.366 166 1 A 166 GLU 2 44.251 167 1 A 167 GLY 2 47.163 168 1 A 168 PHE 2 50.171 169 1 A 169 PHE 2 51.718 170 1 A 170 ARG 2 46.227 171 1 A 171 ASP 2 45.077 172 1 A 172 ARG 2 50.380 173 1 A 173 SER 2 51.296 174 1 A 174 GLY 2 48.519 175 1 A 175 LYS 2 42.977 176 1 A 176 PHE 2 40.917 177 1 B 1 ALA 2 34.918 178 1 B 2 SER 2 40.559 179 1 B 3 ASP 2 36.301 180 1 B 4 MET 2 46.790 181 1 B 5 PRO 2 44.020 182 1 B 6 HIS 2 40.607 183 1 B 7 SER 2 33.372 184 1 B 8 PRO 2 44.670 185 1 B 9 THR 2 34.749 186 1 B 10 LEU 2 41.184 187 1 B 11 ARG 2 39.605 188 1 B 12 VAL 2 40.129 189 1 B 13 ASP 2 34.818 190 1 B 14 ARG 2 42.065 191 1 B 15 LYS 2 46.688 192 1 B 16 ARG 2 51.269 193 1 B 17 LYS 2 45.023 194 1 B 18 VAL 2 39.595 195 1 B 19 SER 2 40.697 196 1 B 20 GLY 2 30.265 197 1 B 21 ASP 2 37.234 198 1 B 22 SER 2 37.768 199 1 B 23 SER 2 30.628 200 1 B 24 HIS 2 34.015 201 1 B 25 THR 2 35.590 202 1 B 26 GLU 2 29.417 203 1 B 27 THR 2 42.678 204 1 B 28 THR 2 30.364 205 1 B 29 ALA 2 37.011 206 1 B 30 GLU 2 37.558 207 1 B 31 GLU 2 29.968 208 1 B 32 VAL 2 42.448 209 1 B 33 PRO 2 51.005 210 1 B 34 GLU 2 44.393 211 1 B 35 ASP 2 44.156 212 1 B 36 PRO 2 45.874 213 1 B 37 LEU 2 41.193 214 1 B 38 LEU 2 48.281 215 1 B 39 LYS 2 44.309 216 1 B 40 ALA 2 51.868 217 1 B 41 LYS 2 46.030 218 1 B 42 ARG 2 42.922 219 1 B 43 ARG 2 56.908 220 1 B 44 ARG 2 48.048 221 1 B 45 VAL 2 47.985 222 1 B 46 SER 2 46.792 223 1 B 47 LYS 2 49.627 224 1 B 48 ASP 2 44.262 225 1 B 49 ASP 2 45.960 226 1 B 50 TRP 2 38.116 227 1 B 51 PRO 2 46.414 228 1 B 52 GLU 2 52.298 229 1 B 53 ARG 2 49.318 230 1 B 54 GLU 2 47.000 231 1 B 55 MET 2 44.452 232 1 B 56 THR 2 45.557 233 1 B 57 ASN 2 46.416 234 1 B 58 SER 2 32.773 235 1 B 59 SER 2 47.016 236 1 B 60 SER 2 42.586 237 1 B 61 ASN 2 38.811 238 1 B 62 HIS 2 40.327 239 1 B 63 LEU 2 40.841 240 1 B 64 GLU 2 40.351 241 1 B 65 ASP 2 43.771 242 1 B 66 PRO 2 49.717 243 1 B 67 HIS 2 44.801 244 1 B 68 TYR 2 43.906 245 1 B 69 SER 2 51.498 246 1 B 70 GLU 2 47.857 247 1 B 71 LEU 2 50.634 248 1 B 72 THR 2 60.598 249 1 B 73 ASN 2 64.831 250 1 B 74 LEU 2 74.552 251 1 B 75 LYS 2 80.522 252 1 B 76 VAL 2 81.339 253 1 B 77 CYS 2 81.277 254 1 B 78 ILE 2 79.133 255 1 B 79 GLU 2 81.482 256 1 B 80 LEU 2 72.698 257 1 B 81 THR 2 65.083 258 1 B 82 GLY 2 59.418 259 1 B 83 LEU 2 53.913 260 1 B 84 HIS 2 54.399 261 1 B 85 PRO 2 54.023 262 1 B 86 LYS 2 60.868 263 1 B 87 LYS 2 52.315 264 1 B 88 GLN 2 56.674 265 1 B 89 ARG 2 61.788 266 1 B 90 HIS 2 65.541 267 1 B 91 LEU 2 66.436 268 1 B 92 LEU 2 69.414 269 1 B 93 HIS 2 75.683 270 1 B 94 LEU 2 78.086 271 1 B 95 ARG 2 78.298 272 1 B 96 GLU 2 80.524 273 1 B 97 ARG 2 79.956 274 1 B 98 TRP 2 77.455 275 1 B 99 GLU 2 81.283 276 1 B 100 GLN 2 77.054 277 1 B 101 GLN 2 74.992 278 1 B 102 VAL 2 67.287 279 1 B 103 SER 2 63.054 280 1 B 104 ALA 2 58.798 281 1 B 105 ALA 2 55.599 282 1 B 106 ASP 2 49.500 283 1 B 107 GLY 2 48.609 284 1 B 108 LYS 2 42.796 285 1 B 109 PRO 2 47.219 286 1 B 110 GLY 2 39.589 287 1 B 111 ARG 2 34.266 288 1 B 112 GLN 2 39.633 289 1 B 113 SER 2 32.698 290 1 B 114 ARG 2 33.297 291 1 B 115 LYS 2 38.590 292 1 B 116 GLU 2 36.797 293 1 B 117 VAL 2 36.548 294 1 B 118 THR 2 38.346 295 1 B 119 GLN 2 29.327 296 1 B 120 ALA 2 32.290 297 1 B 121 THR 2 32.014 298 1 B 122 GLN 2 25.260 299 1 B 123 PRO 2 41.993 300 1 B 124 GLU 2 29.581 301 1 B 125 ALA 2 42.912 302 1 B 126 ILE 2 35.959 303 1 B 127 PRO 2 48.390 304 1 B 128 GLN 2 38.056 305 1 B 129 GLY 2 32.787 306 1 B 130 THR 2 30.119 307 1 B 131 ASN 2 35.268 308 1 B 132 ILE 2 39.503 309 1 B 133 THR 2 45.767 310 1 B 134 GLU 2 33.591 311 1 B 135 GLU 2 44.227 312 1 B 136 LYS 2 45.191 313 1 B 137 PRO 2 49.829 314 1 B 138 GLY 2 41.267 315 1 B 139 ARG 2 38.493 316 1 B 140 LYS 2 48.746 317 1 B 141 ARG 2 34.215 318 1 B 142 ALA 2 44.111 319 1 B 143 GLU 2 38.654 320 1 B 144 ALA 2 41.395 321 1 B 145 LYS 2 44.941 322 1 B 146 GLY 2 43.450 323 1 B 147 ASN 2 43.347 324 1 B 148 ARG 2 60.331 325 1 B 149 SER 2 45.695 326 1 B 150 TRP 2 31.222 327 1 B 151 SER 2 39.725 328 1 B 152 GLU 2 42.026 329 1 B 153 GLU 2 41.224 330 1 B 154 SER 2 36.581 331 1 B 155 LEU 2 43.154 332 1 B 156 LYS 2 34.721 333 1 B 157 PRO 2 39.442 334 1 B 158 SER 2 35.134 335 1 B 159 ASP 2 37.118 336 1 B 160 ASN 2 35.334 337 1 B 161 GLU 2 34.407 338 1 B 162 GLN 2 39.503 339 1 B 163 GLY 2 37.662 340 1 B 164 LEU 2 30.507 341 1 B 165 PRO 2 45.475 342 1 B 166 VAL 2 33.562 343 1 B 167 PHE 2 37.426 344 1 B 168 SER 2 35.952 345 1 B 169 GLY 2 34.169 346 1 B 170 SER 2 33.139 347 1 B 171 PRO 2 47.150 348 1 B 172 PRO 2 38.226 349 1 B 173 MET 2 32.899 350 1 B 174 LYS 2 38.699 351 1 B 175 SER 2 29.630 352 1 B 176 LEU 2 44.639 353 1 B 177 SER 2 32.400 354 1 B 178 SER 2 30.050 355 1 B 179 THR 2 37.935 356 1 B 180 SER 2 27.997 357 1 B 181 ALA 2 41.311 358 1 B 182 GLY 2 31.502 359 1 B 183 GLY 2 37.787 360 1 B 184 LYS 2 33.255 361 1 B 185 LYS 2 39.218 362 1 B 186 GLN 2 34.430 363 1 B 187 ALA 2 40.298 364 1 B 188 GLN 2 30.215 365 1 B 189 PRO 2 46.262 366 1 B 190 SER 2 34.724 367 1 B 191 CYS 2 41.547 368 1 B 192 ALA 2 43.028 369 1 B 193 PRO 2 53.964 370 1 B 194 ALA 2 41.963 371 1 B 195 SER 2 41.932 372 1 B 196 ARG 2 46.959 373 1 B 197 PRO 2 42.218 374 1 B 198 PRO 2 49.591 375 1 B 199 ALA 2 46.869 376 1 B 200 LYS 2 37.223 _database_2.database_id ModelArchive _database_2.database_code ma-t3vr3-210 _database_2.pdbx_DOI 10.5452/ma-t3vr3-210 _pdbx_database_status.entry_id ma-t3vr3-210 _pdbx_database_status.date_coordinates 2022-09-28:22:27 _pdbx_database_status.status_code REL loop_ _pdbx_contact_author.id _pdbx_contact_author.name_salutation _pdbx_contact_author.name_first _pdbx_contact_author.name_last _pdbx_contact_author.name_mi _pdbx_contact_author.email _pdbx_contact_author.address_1 _pdbx_contact_author.address_2 _pdbx_contact_author.address_3 5 Prof. Qian Cong . Qian.Cong@UTSouthwestern.edu 'University of Texas Southwestern Medical Center' . . loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2022-12-21 2 'Structure model' 1 1 2023-07-19 3 'Structure model' 1 2 2023-07-25 loop_ _pdbx_audit_revision_details.ordinal _pdbx_audit_revision_details.revision_ordinal _pdbx_audit_revision_details.data_content_type _pdbx_audit_revision_details.provider _pdbx_audit_revision_details.type _pdbx_audit_revision_details.description 1 1 'Structure model' repository 'Initial release' ? 2 3 'Structure model' repository Remediation 'Format compliance remediation' loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' Other 2 3 'Structure model' Other 3 3 'Structure model' 'Version format compliance' loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 2 'Structure model' exptl 2 3 'Structure model' ma_data 3 3 'Structure model' ma_associated_archive_file_details 4 3 'Structure model' audit_conform loop_ _pdbx_audit_revision_item.ordinal _pdbx_audit_revision_item.revision_ordinal _pdbx_audit_revision_item.data_content_type _pdbx_audit_revision_item.item 1 2 'Structure model' '_exptl.entry_id' 2 2 'Structure model' '_exptl.method' 3 3 'Structure model' '_ma_data.content_type' 4 3 'Structure model' '_ma_data.content_type_other_details' 5 3 'Structure model' '_ma_associated_archive_file_details.data_id' 6 3 'Structure model' '_audit_conform.dict_location' 7 3 'Structure model' '_audit_conform.dict_version'