data_1Z5L # _entry.id 1Z5L # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 1Z5L RCSB RCSB032326 WWPDB D_1000032326 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 1CD1 _pdbx_database_related.details ;structure of "unliganded" CD1d ; _pdbx_database_related.content_type unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 1Z5L _pdbx_database_status.recvd_initial_deposition_date 2005-03-18 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Zajonc, D.M.' 1 'Cantu, C.' 2 'Mattner, J.' 3 'Zhou, D.' 4 'Savage, P.B.' 5 'Bendelac, A.' 6 'Wilson, I.A.' 7 'Teyton, L.' 8 # _citation.id primary _citation.title 'Structure and function of a potent agonist for the semi-invariant natural killer T cell receptor.' _citation.journal_abbrev Nat.Immunol. _citation.journal_volume 6 _citation.page_first 810 _citation.page_last 818 _citation.year 2005 _citation.journal_id_ASTM ? _citation.country UK _citation.journal_id_ISSN 1529-2908 _citation.journal_id_CSD ? _citation.book_publisher ? _citation.pdbx_database_id_PubMed 16007091 _citation.pdbx_database_id_DOI 10.1038/ni1224 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Zajonc, D.M.' 1 primary 'Cantu, C.' 2 primary 'Mattner, J.' 3 primary 'Zhou, D.' 4 primary 'Savage, P.B.' 5 primary 'Bendelac, A.' 6 primary 'Wilson, I.A.' 7 primary 'Teyton, L.' 8 # _cell.entry_id 1Z5L _cell.length_a 59.451 _cell.length_b 77.045 _cell.length_c 111.014 _cell.angle_alpha 90.00 _cell.angle_beta 107.63 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? # _symmetry.entry_id 1Z5L _symmetry.space_group_name_H-M 'P 1 21 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 4 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'T-cell surface glycoprotein CD1d antigen' 32632.668 2 ? ? 'extracellular domain' ? 2 polymer man Beta-2-microglobulin 11660.350 2 ? ? 'extracellular domain' ? 3 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 7 ? ? ? ? 4 non-polymer syn '(2S,3S,4R)-N-OCTANOYL-1-[(ALPHA-D-GALACTOPYRANOSYL)OXY]-2-AMINO-OCTADECANE-3,4-DIOL' 605.844 2 ? ? ? ? 5 non-polymer syn HEXADECANE 226.441 2 ? ? ? ? 6 water nat water 18.015 165 ? ? ? ? # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;SEAQQKNYTFRCLQMSSFANRSWSRTDSVVWLGDLQTHRWSNDSATISFTKPWSQGKLSNQQWEKLQHMFQVYRVSFTRD IQELVKMMSPKEDYPIEIQLSAGCEMYPGNASESFLHVAFQGKYVVRFWGTSWQTVPGAPSWLDLPIKVLNADQGTSATV QMLLNDTCPLFVRGLLEAGKSDLEKQEKPVAWLSSVPSSAHGHRQLVCHVSGFYPKPVWVMWMRGDQEQQGTHRGDFLPN ADETWYLQATLDVEAGEEAGLACRVKHSSLGGQDIILYWHHHHHH ; ;SEAQQKNYTFRCLQMSSFANRSWSRTDSVVWLGDLQTHRWSNDSATISFTKPWSQGKLSNQQWEKLQHMFQVYRVSFTRD IQELVKMMSPKEDYPIEIQLSAGCEMYPGNASESFLHVAFQGKYVVRFWGTSWQTVPGAPSWLDLPIKVLNADQGTSATV QMLLNDTCPLFVRGLLEAGKSDLEKQEKPVAWLSSVPSSAHGHRQLVCHVSGFYPKPVWVMWMRGDQEQQGTHRGDFLPN ADETWYLQATLDVEAGEEAGLACRVKHSSLGGQDIILYWHHHHHH ; A,C ? 2 'polypeptide(L)' no no ;IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDWSFYILAHTEFTPTETDTYAC RVKHASMAEPKTVYWDRDM ; ;IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDWSFYILAHTEFTPTETDTYAC RVKHASMAEPKTVYWDRDM ; B,D ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 SER n 1 2 GLU n 1 3 ALA n 1 4 GLN n 1 5 GLN n 1 6 LYS n 1 7 ASN n 1 8 TYR n 1 9 THR n 1 10 PHE n 1 11 ARG n 1 12 CYS n 1 13 LEU n 1 14 GLN n 1 15 MET n 1 16 SER n 1 17 SER n 1 18 PHE n 1 19 ALA n 1 20 ASN n 1 21 ARG n 1 22 SER n 1 23 TRP n 1 24 SER n 1 25 ARG n 1 26 THR n 1 27 ASP n 1 28 SER n 1 29 VAL n 1 30 VAL n 1 31 TRP n 1 32 LEU n 1 33 GLY n 1 34 ASP n 1 35 LEU n 1 36 GLN n 1 37 THR n 1 38 HIS n 1 39 ARG n 1 40 TRP n 1 41 SER n 1 42 ASN n 1 43 ASP n 1 44 SER n 1 45 ALA n 1 46 THR n 1 47 ILE n 1 48 SER n 1 49 PHE n 1 50 THR n 1 51 LYS n 1 52 PRO n 1 53 TRP n 1 54 SER n 1 55 GLN n 1 56 GLY n 1 57 LYS n 1 58 LEU n 1 59 SER n 1 60 ASN n 1 61 GLN n 1 62 GLN n 1 63 TRP n 1 64 GLU n 1 65 LYS n 1 66 LEU n 1 67 GLN n 1 68 HIS n 1 69 MET n 1 70 PHE n 1 71 GLN n 1 72 VAL n 1 73 TYR n 1 74 ARG n 1 75 VAL n 1 76 SER n 1 77 PHE n 1 78 THR n 1 79 ARG n 1 80 ASP n 1 81 ILE n 1 82 GLN n 1 83 GLU n 1 84 LEU n 1 85 VAL n 1 86 LYS n 1 87 MET n 1 88 MET n 1 89 SER n 1 90 PRO n 1 91 LYS n 1 92 GLU n 1 93 ASP n 1 94 TYR n 1 95 PRO n 1 96 ILE n 1 97 GLU n 1 98 ILE n 1 99 GLN n 1 100 LEU n 1 101 SER n 1 102 ALA n 1 103 GLY n 1 104 CYS n 1 105 GLU n 1 106 MET n 1 107 TYR n 1 108 PRO n 1 109 GLY n 1 110 ASN n 1 111 ALA n 1 112 SER n 1 113 GLU n 1 114 SER n 1 115 PHE n 1 116 LEU n 1 117 HIS n 1 118 VAL n 1 119 ALA n 1 120 PHE n 1 121 GLN n 1 122 GLY n 1 123 LYS n 1 124 TYR n 1 125 VAL n 1 126 VAL n 1 127 ARG n 1 128 PHE n 1 129 TRP n 1 130 GLY n 1 131 THR n 1 132 SER n 1 133 TRP n 1 134 GLN n 1 135 THR n 1 136 VAL n 1 137 PRO n 1 138 GLY n 1 139 ALA n 1 140 PRO n 1 141 SER n 1 142 TRP n 1 143 LEU n 1 144 ASP n 1 145 LEU n 1 146 PRO n 1 147 ILE n 1 148 LYS n 1 149 VAL n 1 150 LEU n 1 151 ASN n 1 152 ALA n 1 153 ASP n 1 154 GLN n 1 155 GLY n 1 156 THR n 1 157 SER n 1 158 ALA n 1 159 THR n 1 160 VAL n 1 161 GLN n 1 162 MET n 1 163 LEU n 1 164 LEU n 1 165 ASN n 1 166 ASP n 1 167 THR n 1 168 CYS n 1 169 PRO n 1 170 LEU n 1 171 PHE n 1 172 VAL n 1 173 ARG n 1 174 GLY n 1 175 LEU n 1 176 LEU n 1 177 GLU n 1 178 ALA n 1 179 GLY n 1 180 LYS n 1 181 SER n 1 182 ASP n 1 183 LEU n 1 184 GLU n 1 185 LYS n 1 186 GLN n 1 187 GLU n 1 188 LYS n 1 189 PRO n 1 190 VAL n 1 191 ALA n 1 192 TRP n 1 193 LEU n 1 194 SER n 1 195 SER n 1 196 VAL n 1 197 PRO n 1 198 SER n 1 199 SER n 1 200 ALA n 1 201 HIS n 1 202 GLY n 1 203 HIS n 1 204 ARG n 1 205 GLN n 1 206 LEU n 1 207 VAL n 1 208 CYS n 1 209 HIS n 1 210 VAL n 1 211 SER n 1 212 GLY n 1 213 PHE n 1 214 TYR n 1 215 PRO n 1 216 LYS n 1 217 PRO n 1 218 VAL n 1 219 TRP n 1 220 VAL n 1 221 MET n 1 222 TRP n 1 223 MET n 1 224 ARG n 1 225 GLY n 1 226 ASP n 1 227 GLN n 1 228 GLU n 1 229 GLN n 1 230 GLN n 1 231 GLY n 1 232 THR n 1 233 HIS n 1 234 ARG n 1 235 GLY n 1 236 ASP n 1 237 PHE n 1 238 LEU n 1 239 PRO n 1 240 ASN n 1 241 ALA n 1 242 ASP n 1 243 GLU n 1 244 THR n 1 245 TRP n 1 246 TYR n 1 247 LEU n 1 248 GLN n 1 249 ALA n 1 250 THR n 1 251 LEU n 1 252 ASP n 1 253 VAL n 1 254 GLU n 1 255 ALA n 1 256 GLY n 1 257 GLU n 1 258 GLU n 1 259 ALA n 1 260 GLY n 1 261 LEU n 1 262 ALA n 1 263 CYS n 1 264 ARG n 1 265 VAL n 1 266 LYS n 1 267 HIS n 1 268 SER n 1 269 SER n 1 270 LEU n 1 271 GLY n 1 272 GLY n 1 273 GLN n 1 274 ASP n 1 275 ILE n 1 276 ILE n 1 277 LEU n 1 278 TYR n 1 279 TRP n 1 280 HIS n 1 281 HIS n 1 282 HIS n 1 283 HIS n 1 284 HIS n 1 285 HIS n 2 1 ILE n 2 2 GLN n 2 3 LYS n 2 4 THR n 2 5 PRO n 2 6 GLN n 2 7 ILE n 2 8 GLN n 2 9 VAL n 2 10 TYR n 2 11 SER n 2 12 ARG n 2 13 HIS n 2 14 PRO n 2 15 PRO n 2 16 GLU n 2 17 ASN n 2 18 GLY n 2 19 LYS n 2 20 PRO n 2 21 ASN n 2 22 ILE n 2 23 LEU n 2 24 ASN n 2 25 CYS n 2 26 TYR n 2 27 VAL n 2 28 THR n 2 29 GLN n 2 30 PHE n 2 31 HIS n 2 32 PRO n 2 33 PRO n 2 34 HIS n 2 35 ILE n 2 36 GLU n 2 37 ILE n 2 38 GLN n 2 39 MET n 2 40 LEU n 2 41 LYS n 2 42 ASN n 2 43 GLY n 2 44 LYS n 2 45 LYS n 2 46 ILE n 2 47 PRO n 2 48 LYS n 2 49 VAL n 2 50 GLU n 2 51 MET n 2 52 SER n 2 53 ASP n 2 54 MET n 2 55 SER n 2 56 PHE n 2 57 SER n 2 58 LYS n 2 59 ASP n 2 60 TRP n 2 61 SER n 2 62 PHE n 2 63 TYR n 2 64 ILE n 2 65 LEU n 2 66 ALA n 2 67 HIS n 2 68 THR n 2 69 GLU n 2 70 PHE n 2 71 THR n 2 72 PRO n 2 73 THR n 2 74 GLU n 2 75 THR n 2 76 ASP n 2 77 THR n 2 78 TYR n 2 79 ALA n 2 80 CYS n 2 81 ARG n 2 82 VAL n 2 83 LYS n 2 84 HIS n 2 85 ALA n 2 86 SER n 2 87 MET n 2 88 ALA n 2 89 GLU n 2 90 PRO n 2 91 LYS n 2 92 THR n 2 93 VAL n 2 94 TYR n 2 95 TRP n 2 96 ASP n 2 97 ARG n 2 98 ASP n 2 99 MET n # loop_ _entity_src_gen.entity_id _entity_src_gen.pdbx_src_id _entity_src_gen.pdbx_alt_source_flag _entity_src_gen.pdbx_seq_type _entity_src_gen.pdbx_beg_seq_num _entity_src_gen.pdbx_end_seq_num _entity_src_gen.gene_src_common_name _entity_src_gen.gene_src_genus _entity_src_gen.pdbx_gene_src_gene _entity_src_gen.gene_src_species _entity_src_gen.gene_src_strain _entity_src_gen.gene_src_tissue _entity_src_gen.gene_src_tissue_fraction _entity_src_gen.gene_src_details _entity_src_gen.pdbx_gene_src_fragment _entity_src_gen.pdbx_gene_src_scientific_name _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id _entity_src_gen.pdbx_gene_src_variant _entity_src_gen.pdbx_gene_src_cell_line _entity_src_gen.pdbx_gene_src_atcc _entity_src_gen.pdbx_gene_src_organ _entity_src_gen.pdbx_gene_src_organelle _entity_src_gen.pdbx_gene_src_cell _entity_src_gen.pdbx_gene_src_cellular_location _entity_src_gen.host_org_common_name _entity_src_gen.pdbx_host_org_scientific_name _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id _entity_src_gen.host_org_genus _entity_src_gen.pdbx_host_org_gene _entity_src_gen.pdbx_host_org_organ _entity_src_gen.host_org_species _entity_src_gen.pdbx_host_org_tissue _entity_src_gen.pdbx_host_org_tissue_fraction _entity_src_gen.pdbx_host_org_strain _entity_src_gen.pdbx_host_org_variant _entity_src_gen.pdbx_host_org_cell_line _entity_src_gen.pdbx_host_org_atcc _entity_src_gen.pdbx_host_org_culture_collection _entity_src_gen.pdbx_host_org_cell _entity_src_gen.pdbx_host_org_organelle _entity_src_gen.pdbx_host_org_cellular_location _entity_src_gen.pdbx_host_org_vector_type _entity_src_gen.pdbx_host_org_vector _entity_src_gen.host_org_details _entity_src_gen.expression_system_id _entity_src_gen.plasmid_name _entity_src_gen.plasmid_details _entity_src_gen.pdbx_description 1 1 sample ? ? ? 'house mouse' Mus ? ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? 'fruit fly' 'Drosophila melanogaster' 7227 Drosophila ? ? ? ? ? ? ? ? ? ? 'S2 cells' ? ? plasmid ? ? ? pRMHa3 ? ? 2 1 sample ? ? ? 'house mouse' Mus ? ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? 'fruit fly' 'Drosophila melanogaster' 7227 Drosophila ? ? ? ? ? ? ? ? ? ? 'S2 cells' ? ? plasmid ? ? ? pRMHa3 ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin _struct_ref.pdbx_db_isoform 1 GB CAA31568 50333 1 ;SEAQQKNYTFRCLQMSSFANRSWSRTDSVVWLGDLQTHRWSNDSATISFTKPWSQGKLSNQQWEKLQHMFQVYRVSFTRD IQELVKMMSPKEDYPIEIQLSAGCEMYPGNASESFLHVAFQGKYVVRFWGTSWQTVPGAPSWLDLPIKVLNADQGTSATV QMLLNDTCPLFVRGLLEAGKSDLEKQEKPVAWLSSVPSSAHGHRQLVCHVSGFYPKPVWVMWMRGDQEQQGTHRGDFLPN ADETWYLQATLDVEAGEEAGLACRVKHSSLGGQDIILYW ; 19 ? 2 GB AAH85164 55153801 2 ;IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDWSFYILAHTEFTPTETDTYAC RVKHASMAEPKTVYWDRDM ; 21 ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 1Z5L A 1 ? 279 ? 50333 19 ? 297 ? 1 279 2 1 1Z5L C 1 ? 279 ? 50333 19 ? 297 ? 1 279 3 2 1Z5L B 1 ? 99 ? 55153801 21 ? 119 ? 1 99 4 2 1Z5L D 1 ? 99 ? 55153801 21 ? 119 ? 1 99 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 1Z5L HIS A 280 ? GB 50333 ? ? 'EXPRESSION TAG' 280 1 1 1Z5L HIS A 281 ? GB 50333 ? ? 'EXPRESSION TAG' 281 2 1 1Z5L HIS A 282 ? GB 50333 ? ? 'EXPRESSION TAG' 282 3 1 1Z5L HIS A 283 ? GB 50333 ? ? 'EXPRESSION TAG' 283 4 1 1Z5L HIS A 284 ? GB 50333 ? ? 'EXPRESSION TAG' 284 5 1 1Z5L HIS A 285 ? GB 50333 ? ? 'EXPRESSION TAG' 285 6 2 1Z5L HIS C 280 ? GB 50333 ? ? 'EXPRESSION TAG' 280 7 2 1Z5L HIS C 281 ? GB 50333 ? ? 'EXPRESSION TAG' 281 8 2 1Z5L HIS C 282 ? GB 50333 ? ? 'EXPRESSION TAG' 282 9 2 1Z5L HIS C 283 ? GB 50333 ? ? 'EXPRESSION TAG' 283 10 2 1Z5L HIS C 284 ? GB 50333 ? ? 'EXPRESSION TAG' 284 11 2 1Z5L HIS C 285 ? GB 50333 ? ? 'EXPRESSION TAG' 285 12 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PBS non-polymer . '(2S,3S,4R)-N-OCTANOYL-1-[(ALPHA-D-GALACTOPYRANOSYL)OXY]-2-AMINO-OCTADECANE-3,4-DIOL' ? 'C32 H63 N O9' 605.844 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 R16 non-polymer . HEXADECANE ? 'C16 H34' 226.441 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 1Z5L _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.42 _exptl_crystal.density_percent_sol 49.2 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' _exptl_crystal_grow.temp 277.0 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.3 _exptl_crystal_grow.pdbx_details 'PEG 4000, calcium acetate, pH 7.3, VAPOR DIFFUSION, SITTING DROP, temperature 277.0K' _exptl_crystal_grow.pdbx_pH_range . # _diffrn.id 1 _diffrn.ambient_temp 120 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'ADSC QUANTUM 315' _diffrn_detector.pdbx_collection_date 2004-12-03 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'Double crystal, Si(111)' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.9537 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ALS BEAMLINE 8.2.2' _diffrn_source.pdbx_synchrotron_site ALS _diffrn_source.pdbx_synchrotron_beamline 8.2.2 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 0.9537 # _reflns.entry_id 1Z5L _reflns.observed_criterion_sigma_I 0 _reflns.observed_criterion_sigma_F 0 _reflns.d_resolution_low 50.0 _reflns.d_resolution_high 2.2 _reflns.number_obs 48471 _reflns.number_all ? _reflns.percent_possible_obs ? _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.075 _reflns.pdbx_netI_over_sigmaI 20.8 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 2.4 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.2 _reflns_shell.d_res_low 2.25 _reflns_shell.percent_possible_all 86.9 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value 0.37 _reflns_shell.meanI_over_sigI_obs 2.0 _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 1Z5L _refine.ls_number_reflns_obs 44014 _refine.ls_number_reflns_all 44014 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 39.68 _refine.ls_d_res_high 2.20 _refine.ls_percent_reflns_obs 93.72 _refine.ls_R_factor_obs 0.24321 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.24156 _refine.ls_R_factor_R_free 0.29368 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 3.1 _refine.ls_number_reflns_R_free 1414 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc .951 _refine.correlation_coeff_Fo_to_Fc_free .927 _refine.B_iso_mean 71.352 _refine.aniso_B[1][1] -.01 _refine.aniso_B[2][2] -.04 _refine.aniso_B[3][3] .07 _refine.aniso_B[1][2] .00 _refine.aniso_B[1][3] .02 _refine.aniso_B[2][3] .00 _refine.solvent_model_details MASK _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii .80 _refine.pdbx_solvent_shrinkage_radii .80 _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' _refine.pdbx_starting_model 'PDB Entry 1CD1' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model isotropic _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R .307 _refine.pdbx_overall_ESU_R_Free .249 _refine.overall_SU_ML .256 _refine.overall_SU_B 22.637 _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_TLS_residual_ADP_flag 'LIKELY RESIDUAL' _refine.pdbx_diffrn_id 1 _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_analyze.entry_id 1Z5L _refine_analyze.Luzzati_coordinate_error_obs 0.45 _refine_analyze.Luzzati_sigma_a_obs ? _refine_analyze.Luzzati_d_res_low_obs ? _refine_analyze.Luzzati_coordinate_error_free ? _refine_analyze.Luzzati_sigma_a_free ? _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.pdbx_Luzzati_d_res_high_obs ? _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 5911 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 214 _refine_hist.number_atoms_solvent 165 _refine_hist.number_atoms_total 6290 _refine_hist.d_res_high 2.20 _refine_hist.d_res_low 39.68 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function r_bond_refined_d .015 .021 ? 6132 'X-RAY DIFFRACTION' ? r_bond_other_d ? ? ? ? 'X-RAY DIFFRACTION' ? r_angle_refined_deg 1.848 1.946 ? 8322 'X-RAY DIFFRACTION' ? r_angle_other_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 5.792 5.000 ? 719 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg 33.895 24.045 ? 267 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg 17.989 15.000 ? 922 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg 22.531 15.000 ? 24 'X-RAY DIFFRACTION' ? r_chiral_restr .149 .200 ? 875 'X-RAY DIFFRACTION' ? r_gen_planes_refined .002 .020 ? 4618 'X-RAY DIFFRACTION' ? r_gen_planes_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbd_refined .232 .200 ? 2429 'X-RAY DIFFRACTION' ? r_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_refined .313 .200 ? 3991 'X-RAY DIFFRACTION' ? r_nbtor_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_refined .179 .200 ? 260 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_refined .199 .200 ? 50 'X-RAY DIFFRACTION' ? r_symmetry_vdw_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_refined .180 .200 ? 6 'X-RAY DIFFRACTION' ? r_symmetry_hbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcbond_it .737 1.500 ? 3714 'X-RAY DIFFRACTION' ? r_mcbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcangle_it 1.135 2.000 ? 5803 'X-RAY DIFFRACTION' ? r_scbond_it 1.757 3.000 ? 2854 'X-RAY DIFFRACTION' ? r_scangle_it 2.552 4.500 ? 2519 'X-RAY DIFFRACTION' ? r_rigid_bond_restr ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_free ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_bonded ? ? ? ? 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 2.203 _refine_ls_shell.d_res_low 2.260 _refine_ls_shell.number_reflns_R_work 2983 _refine_ls_shell.R_factor_R_work 0.337 _refine_ls_shell.percent_reflns_obs 86.34 _refine_ls_shell.R_factor_R_free 0.438 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 88 _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.number_reflns_all ? _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.R_factor_all ? # _struct.entry_id 1Z5L _struct.title 'Structure of a highly potent short-chain galactosyl ceramide agonist bound to CD1D' _struct.pdbx_descriptor 'T-cell surface glycoprotein CD1d antigen, Beta-2-microglobulin' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1Z5L _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' _struct_keywords.text 'Ig fold, MHC fold, IMMUNE SYSTEM' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 1 ? D N N 2 ? E N N 3 ? F N N 3 ? G N N 3 ? H N N 3 ? I N N 4 ? J N N 5 ? K N N 3 ? L N N 3 ? M N N 3 ? N N N 4 ? O N N 5 ? P N N 6 ? Q N N 6 ? R N N 6 ? S N N 6 ? # loop_ _struct_biol.id _struct_biol.details _struct_biol.pdbx_parent_biol_id 1 'biologically active subunit is a heterodimer fomred by CD1d and beta-2-microglobulin' ? 2 ? ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 SER A 59 ? LYS A 86 ? SER A 59 LYS A 86 1 ? 28 HELX_P HELX_P2 2 PRO A 140 ? TRP A 142 ? PRO A 140 TRP A 142 5 ? 3 HELX_P HELX_P3 3 LEU A 143 ? ALA A 152 ? LEU A 143 ALA A 152 1 ? 10 HELX_P HELX_P4 4 ASP A 153 ? ASP A 166 ? ASP A 153 ASP A 166 1 ? 14 HELX_P HELX_P5 5 ASP A 166 ? GLY A 179 ? ASP A 166 GLY A 179 1 ? 14 HELX_P HELX_P6 6 GLY A 179 ? GLU A 184 ? GLY A 179 GLU A 184 1 ? 6 HELX_P HELX_P7 7 SER A 269 ? GLY A 271 ? SER A 269 GLY A 271 5 ? 3 HELX_P HELX_P8 8 SER C 59 ? LYS C 86 ? SER C 59 LYS C 86 1 ? 28 HELX_P HELX_P9 9 PRO C 140 ? TRP C 142 ? PRO C 140 TRP C 142 5 ? 3 HELX_P HELX_P10 10 LEU C 143 ? ASN C 151 ? LEU C 143 ASN C 151 1 ? 9 HELX_P HELX_P11 11 ASP C 153 ? ASP C 166 ? ASP C 153 ASP C 166 1 ? 14 HELX_P HELX_P12 12 ASP C 166 ? GLY C 179 ? ASP C 166 GLY C 179 1 ? 14 HELX_P HELX_P13 13 GLY C 179 ? GLU C 184 ? GLY C 179 GLU C 184 1 ? 6 HELX_P HELX_P14 14 HIS C 267 ? GLY C 271 ? HIS C 267 GLY C 271 5 ? 5 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 104 SG ? ? ? 1_555 A CYS 168 SG ? ? A CYS 104 A CYS 168 1_555 ? ? ? ? ? ? ? 2.120 ? disulf2 disulf ? ? A CYS 208 SG ? ? ? 1_555 A CYS 263 SG ? ? A CYS 208 A CYS 263 1_555 ? ? ? ? ? ? ? 2.050 ? disulf3 disulf ? ? B CYS 25 SG ? ? ? 1_555 B CYS 80 SG ? ? B CYS 25 B CYS 80 1_555 ? ? ? ? ? ? ? 2.029 ? disulf4 disulf ? ? C CYS 104 SG ? ? ? 1_555 C CYS 168 SG ? ? C CYS 104 C CYS 168 1_555 ? ? ? ? ? ? ? 2.112 ? disulf5 disulf ? ? C CYS 208 SG ? ? ? 1_555 C CYS 263 SG ? ? C CYS 208 C CYS 263 1_555 ? ? ? ? ? ? ? 2.067 ? disulf6 disulf ? ? D CYS 25 SG ? ? ? 1_555 D CYS 80 SG ? ? D CYS 25 D CYS 80 1_555 ? ? ? ? ? ? ? 2.049 ? covale1 covale ? ? A ASN 20 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 20 A NAG 500 1_555 ? ? ? ? ? ? ? 1.447 ? covale2 covale ? ? A ASN 42 ND2 ? ? ? 1_555 F NAG . C1 ? ? A ASN 42 A NAG 501 1_555 ? ? ? ? ? ? ? 1.448 ? covale3 covale ? ? A ASN 165 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 165 A NAG 511 1_555 ? ? ? ? ? ? ? 1.436 ? covale4 covale ? ? C ASN 42 ND2 ? ? ? 1_555 K NAG . C1 ? ? C ASN 42 C NAG 501 1_555 ? ? ? ? ? ? ? 1.456 ? covale5 covale ? ? C ASN 165 ND2 ? ? ? 1_555 L NAG . C1 ? ? C ASN 165 C NAG 511 1_555 ? ? ? ? ? ? ? 1.435 ? covale6 covale ? ? G NAG . O4 ? ? ? 1_555 H NAG . C1 ? ? A NAG 511 A NAG 512 1_555 ? ? ? ? ? ? ? 1.442 ? covale7 covale ? ? L NAG . O4 ? ? ? 1_555 M NAG . C1 ? ? C NAG 511 C NAG 512 1_555 ? ? ? ? ? ? ? 1.450 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 TYR 214 A . ? TYR 214 A PRO 215 A ? PRO 215 A 1 3.07 2 HIS 31 B . ? HIS 31 B PRO 32 B ? PRO 32 B 1 2.33 3 TYR 214 C . ? TYR 214 C PRO 215 C ? PRO 215 C 1 -6.19 4 HIS 31 D . ? HIS 31 D PRO 32 D ? PRO 32 D 1 5.22 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 8 ? B ? 4 ? C ? 4 ? D ? 4 ? E ? 4 ? F ? 4 ? G ? 4 ? H ? 8 ? I ? 4 ? J ? 4 ? K ? 4 ? L ? 4 ? M ? 4 ? N ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? anti-parallel A 6 7 ? anti-parallel A 7 8 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel G 3 4 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel H 4 5 ? anti-parallel H 5 6 ? anti-parallel H 6 7 ? anti-parallel H 7 8 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel J 3 4 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel L 3 4 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel N 1 2 ? anti-parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 SER A 48 ? PHE A 49 ? SER A 48 PHE A 49 A 2 LEU A 35 ? TRP A 40 ? LEU A 35 TRP A 40 A 3 TRP A 23 ? LEU A 32 ? TRP A 23 LEU A 32 A 4 THR A 9 ? ASN A 20 ? THR A 9 ASN A 20 A 5 ILE A 96 ? GLU A 105 ? ILE A 96 GLU A 105 A 6 GLU A 113 ? PHE A 120 ? GLU A 113 PHE A 120 A 7 LYS A 123 ? TRP A 129 ? LYS A 123 TRP A 129 A 8 SER A 132 ? THR A 135 ? SER A 132 THR A 135 B 1 VAL A 190 ? VAL A 196 ? VAL A 190 VAL A 196 B 2 ARG A 204 ? PHE A 213 ? ARG A 204 PHE A 213 B 3 TRP A 245 ? VAL A 253 ? TRP A 245 VAL A 253 B 4 HIS A 233 ? ARG A 234 ? HIS A 233 ARG A 234 C 1 VAL A 190 ? VAL A 196 ? VAL A 190 VAL A 196 C 2 ARG A 204 ? PHE A 213 ? ARG A 204 PHE A 213 C 3 TRP A 245 ? VAL A 253 ? TRP A 245 VAL A 253 C 4 LEU A 238 ? PRO A 239 ? LEU A 238 PRO A 239 D 1 GLN A 227 ? GLU A 228 ? GLN A 227 GLU A 228 D 2 VAL A 218 ? ARG A 224 ? VAL A 218 ARG A 224 D 3 ALA A 262 ? HIS A 267 ? ALA A 262 HIS A 267 D 4 ILE A 275 ? TYR A 278 ? ILE A 275 TYR A 278 E 1 GLN B 6 ? SER B 11 ? GLN B 6 SER B 11 E 2 ASN B 21 ? PHE B 30 ? ASN B 21 PHE B 30 E 3 PHE B 62 ? PHE B 70 ? PHE B 62 PHE B 70 E 4 GLU B 50 ? MET B 51 ? GLU B 50 MET B 51 F 1 GLN B 6 ? SER B 11 ? GLN B 6 SER B 11 F 2 ASN B 21 ? PHE B 30 ? ASN B 21 PHE B 30 F 3 PHE B 62 ? PHE B 70 ? PHE B 62 PHE B 70 F 4 SER B 55 ? PHE B 56 ? SER B 55 PHE B 56 G 1 LYS B 44 ? LYS B 45 ? LYS B 44 LYS B 45 G 2 ILE B 35 ? LYS B 41 ? ILE B 35 LYS B 41 G 3 TYR B 78 ? HIS B 84 ? TYR B 78 HIS B 84 G 4 LYS B 91 ? TYR B 94 ? LYS B 91 TYR B 94 H 1 SER C 48 ? PHE C 49 ? SER C 48 PHE C 49 H 2 LEU C 35 ? TRP C 40 ? LEU C 35 TRP C 40 H 3 TRP C 23 ? LEU C 32 ? TRP C 23 LEU C 32 H 4 TYR C 8 ? ASN C 20 ? TYR C 8 ASN C 20 H 5 ILE C 96 ? MET C 106 ? ILE C 96 MET C 106 H 6 GLU C 113 ? PHE C 120 ? GLU C 113 PHE C 120 H 7 LYS C 123 ? TRP C 129 ? LYS C 123 TRP C 129 H 8 SER C 132 ? THR C 135 ? SER C 132 THR C 135 I 1 VAL C 190 ? VAL C 196 ? VAL C 190 VAL C 196 I 2 HIS C 203 ? PHE C 213 ? HIS C 203 PHE C 213 I 3 TRP C 245 ? GLU C 254 ? TRP C 245 GLU C 254 I 4 HIS C 233 ? ARG C 234 ? HIS C 233 ARG C 234 J 1 VAL C 190 ? VAL C 196 ? VAL C 190 VAL C 196 J 2 HIS C 203 ? PHE C 213 ? HIS C 203 PHE C 213 J 3 TRP C 245 ? GLU C 254 ? TRP C 245 GLU C 254 J 4 LEU C 238 ? PRO C 239 ? LEU C 238 PRO C 239 K 1 GLN C 227 ? GLU C 228 ? GLN C 227 GLU C 228 K 2 TRP C 219 ? ARG C 224 ? TRP C 219 ARG C 224 K 3 ALA C 262 ? LYS C 266 ? ALA C 262 LYS C 266 K 4 ILE C 275 ? TYR C 278 ? ILE C 275 TYR C 278 L 1 GLN D 6 ? SER D 11 ? GLN D 6 SER D 11 L 2 ASN D 21 ? PHE D 30 ? ASN D 21 PHE D 30 L 3 PHE D 62 ? PHE D 70 ? PHE D 62 PHE D 70 L 4 VAL D 49 ? MET D 51 ? VAL D 49 MET D 51 M 1 GLN D 6 ? SER D 11 ? GLN D 6 SER D 11 M 2 ASN D 21 ? PHE D 30 ? ASN D 21 PHE D 30 M 3 PHE D 62 ? PHE D 70 ? PHE D 62 PHE D 70 M 4 SER D 55 ? PHE D 56 ? SER D 55 PHE D 56 N 1 LYS D 44 ? LYS D 45 ? LYS D 44 LYS D 45 N 2 ILE D 35 ? LYS D 41 ? ILE D 35 LYS D 41 N 3 TYR D 78 ? HIS D 84 ? TYR D 78 HIS D 84 N 4 LYS D 91 ? TYR D 94 ? LYS D 91 TYR D 94 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 O SER A 48 ? O SER A 48 N ARG A 39 ? N ARG A 39 A 2 3 O LEU A 35 ? O LEU A 35 N LEU A 32 ? N LEU A 32 A 3 4 O ASP A 27 ? O ASP A 27 N MET A 15 ? N MET A 15 A 4 5 N CYS A 12 ? N CYS A 12 O ALA A 102 ? O ALA A 102 A 5 6 N GLN A 99 ? N GLN A 99 O ALA A 119 ? O ALA A 119 A 6 7 N VAL A 118 ? N VAL A 118 O VAL A 126 ? O VAL A 126 A 7 8 N TRP A 129 ? N TRP A 129 O SER A 132 ? O SER A 132 B 1 2 N SER A 194 ? N SER A 194 O VAL A 207 ? O VAL A 207 B 2 3 N LEU A 206 ? N LEU A 206 O LEU A 251 ? O LEU A 251 B 3 4 O THR A 250 ? O THR A 250 N HIS A 233 ? N HIS A 233 C 1 2 N SER A 194 ? N SER A 194 O VAL A 207 ? O VAL A 207 C 2 3 N LEU A 206 ? N LEU A 206 O LEU A 251 ? O LEU A 251 C 3 4 O TYR A 246 ? O TYR A 246 N LEU A 238 ? N LEU A 238 D 1 2 O GLN A 227 ? O GLN A 227 N ARG A 224 ? N ARG A 224 D 2 3 N MET A 223 ? N MET A 223 O ALA A 262 ? O ALA A 262 D 3 4 N VAL A 265 ? N VAL A 265 O ILE A 275 ? O ILE A 275 E 1 2 N TYR B 10 ? N TYR B 10 O ASN B 24 ? O ASN B 24 E 2 3 N ASN B 21 ? N ASN B 21 O PHE B 70 ? O PHE B 70 E 3 4 O HIS B 67 ? O HIS B 67 N GLU B 50 ? N GLU B 50 F 1 2 N TYR B 10 ? N TYR B 10 O ASN B 24 ? O ASN B 24 F 2 3 N ASN B 21 ? N ASN B 21 O PHE B 70 ? O PHE B 70 F 3 4 O TYR B 63 ? O TYR B 63 N SER B 55 ? N SER B 55 G 1 2 O LYS B 44 ? O LYS B 44 N LYS B 41 ? N LYS B 41 G 2 3 N GLN B 38 ? N GLN B 38 O ARG B 81 ? O ARG B 81 G 3 4 N VAL B 82 ? N VAL B 82 O LYS B 91 ? O LYS B 91 H 1 2 O SER C 48 ? O SER C 48 N ARG C 39 ? N ARG C 39 H 2 3 O LEU C 35 ? O LEU C 35 N LEU C 32 ? N LEU C 32 H 3 4 O ASP C 27 ? O ASP C 27 N MET C 15 ? N MET C 15 H 4 5 N TYR C 8 ? N TYR C 8 O MET C 106 ? O MET C 106 H 5 6 N GLN C 99 ? N GLN C 99 O ALA C 119 ? O ALA C 119 H 6 7 N VAL C 118 ? N VAL C 118 O VAL C 126 ? O VAL C 126 H 7 8 N TRP C 129 ? N TRP C 129 O SER C 132 ? O SER C 132 I 1 2 N VAL C 196 ? N VAL C 196 O GLN C 205 ? O GLN C 205 I 2 3 N CYS C 208 ? N CYS C 208 O ALA C 249 ? O ALA C 249 I 3 4 O THR C 250 ? O THR C 250 N HIS C 233 ? N HIS C 233 J 1 2 N VAL C 196 ? N VAL C 196 O GLN C 205 ? O GLN C 205 J 2 3 N CYS C 208 ? N CYS C 208 O ALA C 249 ? O ALA C 249 J 3 4 O TYR C 246 ? O TYR C 246 N LEU C 238 ? N LEU C 238 K 1 2 O GLN C 227 ? O GLN C 227 N ARG C 224 ? N ARG C 224 K 2 3 N MET C 223 ? N MET C 223 O ALA C 262 ? O ALA C 262 K 3 4 N VAL C 265 ? N VAL C 265 O ILE C 275 ? O ILE C 275 L 1 2 N GLN D 8 ? N GLN D 8 O TYR D 26 ? O TYR D 26 L 2 3 N ASN D 21 ? N ASN D 21 O PHE D 70 ? O PHE D 70 L 3 4 O HIS D 67 ? O HIS D 67 N GLU D 50 ? N GLU D 50 M 1 2 N GLN D 8 ? N GLN D 8 O TYR D 26 ? O TYR D 26 M 2 3 N ASN D 21 ? N ASN D 21 O PHE D 70 ? O PHE D 70 M 3 4 O TYR D 63 ? O TYR D 63 N SER D 55 ? N SER D 55 N 1 2 O LYS D 44 ? O LYS D 44 N LYS D 41 ? N LYS D 41 N 2 3 N GLN D 38 ? N GLN D 38 O ARG D 81 ? O ARG D 81 N 3 4 N VAL D 82 ? N VAL D 82 O LYS D 91 ? O LYS D 91 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 500' AC2 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 501' AC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG A 511' AC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 512' AC5 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG C 501' AC6 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG C 511' AC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG C 512' AC8 Software ? ? ? ? 11 'BINDING SITE FOR RESIDUE PBS A 601' AC9 Software ? ? ? ? 11 'BINDING SITE FOR RESIDUE PBS C 602' BC1 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE R16 A 701' BC2 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE R16 C 702' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 2 ASN A 20 ? ASN A 20 . ? 1_555 ? 2 AC1 2 SER A 22 ? SER A 22 . ? 1_555 ? 3 AC2 3 TRP A 23 ? TRP A 23 . ? 1_555 ? 4 AC2 3 SER A 24 ? SER A 24 . ? 1_555 ? 5 AC2 3 ASN A 42 ? ASN A 42 . ? 1_555 ? 6 AC3 5 GLN A 161 ? GLN A 161 . ? 1_555 ? 7 AC3 5 ASN A 165 ? ASN A 165 . ? 1_555 ? 8 AC3 5 PRO A 197 ? PRO A 197 . ? 1_655 ? 9 AC3 5 NAG H . ? NAG A 512 . ? 1_555 ? 10 AC3 5 ASP B 96 ? ASP B 96 . ? 1_655 ? 11 AC4 3 TRP A 129 ? TRP A 129 . ? 1_555 ? 12 AC4 3 GLY A 130 ? GLY A 130 . ? 1_555 ? 13 AC4 3 NAG G . ? NAG A 511 . ? 1_555 ? 14 AC5 3 TRP C 23 ? TRP C 23 . ? 1_555 ? 15 AC5 3 SER C 24 ? SER C 24 . ? 1_555 ? 16 AC5 3 ASN C 42 ? ASN C 42 . ? 1_555 ? 17 AC6 7 GLY C 130 ? GLY C 130 . ? 1_555 ? 18 AC6 7 THR C 131 ? THR C 131 . ? 1_555 ? 19 AC6 7 GLN C 161 ? GLN C 161 . ? 1_555 ? 20 AC6 7 ASN C 165 ? ASN C 165 . ? 1_555 ? 21 AC6 7 PRO C 197 ? PRO C 197 . ? 1_655 ? 22 AC6 7 NAG M . ? NAG C 512 . ? 1_555 ? 23 AC6 7 ASP D 96 ? ASP D 96 . ? 1_655 ? 24 AC7 3 TRP C 129 ? TRP C 129 . ? 1_555 ? 25 AC7 3 GLY C 130 ? GLY C 130 . ? 1_555 ? 26 AC7 3 NAG L . ? NAG C 511 . ? 1_555 ? 27 AC8 11 TYR A 73 ? TYR A 73 . ? 1_555 ? 28 AC8 11 SER A 76 ? SER A 76 . ? 1_555 ? 29 AC8 11 PHE A 77 ? PHE A 77 . ? 1_555 ? 30 AC8 11 ARG A 79 ? ARG A 79 . ? 1_555 ? 31 AC8 11 ASP A 80 ? ASP A 80 . ? 1_555 ? 32 AC8 11 LEU A 84 ? LEU A 84 . ? 1_555 ? 33 AC8 11 VAL A 85 ? VAL A 85 . ? 1_555 ? 34 AC8 11 TRP A 133 ? TRP A 133 . ? 1_555 ? 35 AC8 11 ASP A 153 ? ASP A 153 . ? 1_555 ? 36 AC8 11 GLY A 155 ? GLY A 155 . ? 1_555 ? 37 AC8 11 THR A 156 ? THR A 156 . ? 1_555 ? 38 AC9 11 TYR C 73 ? TYR C 73 . ? 1_555 ? 39 AC9 11 SER C 76 ? SER C 76 . ? 1_555 ? 40 AC9 11 ASP C 80 ? ASP C 80 . ? 1_555 ? 41 AC9 11 VAL C 85 ? VAL C 85 . ? 1_555 ? 42 AC9 11 TRP C 133 ? TRP C 133 . ? 1_555 ? 43 AC9 11 TRP C 142 ? TRP C 142 . ? 1_555 ? 44 AC9 11 LEU C 143 ? LEU C 143 . ? 1_555 ? 45 AC9 11 LEU C 150 ? LEU C 150 . ? 1_555 ? 46 AC9 11 ASP C 153 ? ASP C 153 . ? 1_555 ? 47 AC9 11 GLY C 155 ? GLY C 155 . ? 1_555 ? 48 AC9 11 THR C 156 ? THR C 156 . ? 1_555 ? 49 BC1 4 CYS A 12 ? CYS A 12 . ? 1_555 ? 50 BC1 4 GLN A 14 ? GLN A 14 . ? 1_555 ? 51 BC1 4 SER A 28 ? SER A 28 . ? 1_555 ? 52 BC1 4 PHE A 171 ? PHE A 171 . ? 1_555 ? 53 BC2 5 CYS C 12 ? CYS C 12 . ? 1_555 ? 54 BC2 5 GLN C 14 ? GLN C 14 . ? 1_555 ? 55 BC2 5 SER C 28 ? SER C 28 . ? 1_555 ? 56 BC2 5 PHE C 70 ? PHE C 70 . ? 1_555 ? 57 BC2 5 ALA C 102 ? ALA C 102 . ? 1_555 ? # _database_PDB_matrix.entry_id 1Z5L _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 1Z5L _atom_sites.fract_transf_matrix[1][1] 0.016821 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.005345 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.012979 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 0.009452 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . TYR A 1 8 ? 4.426 -2.931 39.872 1.00 78.79 ? 8 TYR A N 1 ATOM 2 C CA . TYR A 1 8 ? 4.208 -1.949 38.743 1.00 78.41 ? 8 TYR A CA 1 ATOM 3 C C . TYR A 1 8 ? 4.970 -2.243 37.443 1.00 78.06 ? 8 TYR A C 1 ATOM 4 O O . TYR A 1 8 ? 6.198 -2.396 37.453 1.00 78.47 ? 8 TYR A O 1 ATOM 5 C CB . TYR A 1 8 ? 4.577 -0.524 39.174 1.00 78.62 ? 8 TYR A CB 1 ATOM 6 C CG . TYR A 1 8 ? 3.831 0.011 40.382 1.00 78.70 ? 8 TYR A CG 1 ATOM 7 C CD1 . TYR A 1 8 ? 4.351 -0.149 41.664 1.00 78.56 ? 8 TYR A CD1 1 ATOM 8 C CD2 . TYR A 1 8 ? 2.615 0.681 40.238 1.00 77.49 ? 8 TYR A CD2 1 ATOM 9 C CE1 . TYR A 1 8 ? 3.683 0.339 42.773 1.00 79.17 ? 8 TYR A CE1 1 ATOM 10 C CE2 . TYR A 1 8 ? 1.936 1.171 41.342 1.00 78.71 ? 8 TYR A CE2 1 ATOM 11 C CZ . TYR A 1 8 ? 2.474 1.000 42.611 1.00 79.29 ? 8 TYR A CZ 1 ATOM 12 O OH . TYR A 1 8 ? 1.812 1.484 43.725 1.00 78.25 ? 8 TYR A OH 1 ATOM 13 N N . THR A 1 9 ? 4.234 -2.310 36.329 1.00 77.07 ? 9 THR A N 1 ATOM 14 C CA . THR A 1 9 ? 4.826 -2.475 35.025 1.00 75.98 ? 9 THR A CA 1 ATOM 15 C C . THR A 1 9 ? 4.767 -1.144 34.305 1.00 75.38 ? 9 THR A C 1 ATOM 16 O O . THR A 1 9 ? 3.721 -0.495 34.235 1.00 74.75 ? 9 THR A O 1 ATOM 17 C CB . THR A 1 9 ? 4.119 -3.570 34.182 1.00 76.73 ? 9 THR A CB 1 ATOM 18 O OG1 . THR A 1 9 ? 4.244 -4.847 34.823 1.00 78.32 ? 9 THR A OG1 1 ATOM 19 C CG2 . THR A 1 9 ? 4.855 -3.790 32.863 1.00 74.59 ? 9 THR A CG2 1 ATOM 20 N N . PHE A 1 10 ? 5.920 -0.749 33.773 1.00 74.22 ? 10 PHE A N 1 ATOM 21 C CA . PHE A 1 10 ? 6.035 0.461 32.983 1.00 72.81 ? 10 PHE A CA 1 ATOM 22 C C . PHE A 1 10 ? 6.004 -0.003 31.558 1.00 72.95 ? 10 PHE A C 1 ATOM 23 O O . PHE A 1 10 ? 6.791 -0.854 31.161 1.00 73.06 ? 10 PHE A O 1 ATOM 24 C CB . PHE A 1 10 ? 7.345 1.175 33.279 1.00 71.07 ? 10 PHE A CB 1 ATOM 25 C CG . PHE A 1 10 ? 7.540 2.449 32.527 1.00 68.12 ? 10 PHE A CG 1 ATOM 26 C CD1 . PHE A 1 10 ? 6.739 3.561 32.781 1.00 66.23 ? 10 PHE A CD1 1 ATOM 27 C CD2 . PHE A 1 10 ? 8.532 2.552 31.578 1.00 66.25 ? 10 PHE A CD2 1 ATOM 28 C CE1 . PHE A 1 10 ? 6.925 4.737 32.083 1.00 62.90 ? 10 PHE A CE1 1 ATOM 29 C CE2 . PHE A 1 10 ? 8.730 3.737 30.874 1.00 65.68 ? 10 PHE A CE2 1 ATOM 30 C CZ . PHE A 1 10 ? 7.920 4.833 31.129 1.00 63.53 ? 10 PHE A CZ 1 ATOM 31 N N . ARG A 1 11 ? 5.081 0.545 30.790 1.00 73.01 ? 11 ARG A N 1 ATOM 32 C CA . ARG A 1 11 ? 5.046 0.235 29.371 1.00 74.42 ? 11 ARG A CA 1 ATOM 33 C C . ARG A 1 11 ? 4.912 1.441 28.461 1.00 73.49 ? 11 ARG A C 1 ATOM 34 O O . ARG A 1 11 ? 3.995 2.246 28.629 1.00 73.58 ? 11 ARG A O 1 ATOM 35 C CB . ARG A 1 11 ? 4.065 -0.905 29.009 1.00 72.79 ? 11 ARG A CB 1 ATOM 36 C CG . ARG A 1 11 ? 2.786 -0.992 29.788 1.00 74.28 ? 11 ARG A CG 1 ATOM 37 C CD . ARG A 1 11 ? 2.060 -2.339 29.627 1.00 78.21 ? 11 ARG A CD 1 ATOM 38 N NE . ARG A 1 11 ? 2.886 -3.486 30.058 1.00 86.86 ? 11 ARG A NE 1 ATOM 39 C CZ . ARG A 1 11 ? 2.862 -4.726 29.510 1.00 90.65 ? 11 ARG A CZ 1 ATOM 40 N NH1 . ARG A 1 11 ? 2.058 -5.027 28.482 1.00 91.47 ? 11 ARG A NH1 1 ATOM 41 N NH2 . ARG A 1 11 ? 3.661 -5.679 29.988 1.00 91.38 ? 11 ARG A NH2 1 ATOM 42 N N . CYS A 1 12 ? 5.855 1.541 27.520 1.00 74.06 ? 12 CYS A N 1 ATOM 43 C CA . CYS A 1 12 ? 5.757 2.436 26.354 1.00 75.67 ? 12 CYS A CA 1 ATOM 44 C C . CYS A 1 12 ? 5.143 1.595 25.224 1.00 74.98 ? 12 CYS A C 1 ATOM 45 O O . CYS A 1 12 ? 5.631 0.513 24.864 1.00 75.34 ? 12 CYS A O 1 ATOM 46 C CB . CYS A 1 12 ? 7.092 3.003 25.907 1.00 75.09 ? 12 CYS A CB 1 ATOM 47 S SG . CYS A 1 12 ? 7.970 3.896 27.189 1.00 84.28 ? 12 CYS A SG 1 ATOM 48 N N . LEU A 1 13 ? 4.066 2.138 24.687 1.00 74.34 ? 13 LEU A N 1 ATOM 49 C CA . LEU A 1 13 ? 3.189 1.490 23.738 1.00 73.10 ? 13 LEU A CA 1 ATOM 50 C C . LEU A 1 13 ? 3.137 2.375 22.507 1.00 73.42 ? 13 LEU A C 1 ATOM 51 O O . LEU A 1 13 ? 2.654 3.508 22.555 1.00 74.51 ? 13 LEU A O 1 ATOM 52 C CB . LEU A 1 13 ? 1.815 1.339 24.392 1.00 71.61 ? 13 LEU A CB 1 ATOM 53 C CG . LEU A 1 13 ? 1.409 -0.025 24.928 1.00 71.93 ? 13 LEU A CG 1 ATOM 54 C CD1 . LEU A 1 13 ? 2.498 -0.988 25.553 1.00 67.72 ? 13 LEU A CD1 1 ATOM 55 C CD2 . LEU A 1 13 ? 0.187 0.095 25.776 1.00 71.96 ? 13 LEU A CD2 1 ATOM 56 N N . GLN A 1 14 ? 3.659 1.851 21.408 1.00 73.54 ? 14 GLN A N 1 ATOM 57 C CA . GLN A 1 14 ? 3.726 2.539 20.128 1.00 72.93 ? 14 GLN A CA 1 ATOM 58 C C . GLN A 1 14 ? 2.856 1.823 19.121 1.00 73.45 ? 14 GLN A C 1 ATOM 59 O O . GLN A 1 14 ? 2.895 0.562 19.022 1.00 73.81 ? 14 GLN A O 1 ATOM 60 C CB . GLN A 1 14 ? 5.157 2.551 19.626 1.00 73.41 ? 14 GLN A CB 1 ATOM 61 C CG . GLN A 1 14 ? 5.390 3.277 18.333 1.00 73.40 ? 14 GLN A CG 1 ATOM 62 C CD . GLN A 1 14 ? 6.791 3.069 17.817 1.00 76.16 ? 14 GLN A CD 1 ATOM 63 O OE1 . GLN A 1 14 ? 7.742 3.377 18.509 1.00 80.17 ? 14 GLN A OE1 1 ATOM 64 N NE2 . GLN A 1 14 ? 6.922 2.536 16.591 1.00 76.78 ? 14 GLN A NE2 1 ATOM 65 N N . MET A 1 15 ? 2.081 2.596 18.374 1.00 72.55 ? 15 MET A N 1 ATOM 66 C CA . MET A 1 15 ? 1.184 2.013 17.365 1.00 74.86 ? 15 MET A CA 1 ATOM 67 C C . MET A 1 15 ? 1.477 2.665 16.017 1.00 72.90 ? 15 MET A C 1 ATOM 68 O O . MET A 1 15 ? 1.368 3.903 15.869 1.00 69.77 ? 15 MET A O 1 ATOM 69 C CB . MET A 1 15 ? -0.281 2.253 17.749 1.00 75.14 ? 15 MET A CB 1 ATOM 70 C CG . MET A 1 15 ? -0.748 1.484 18.970 1.00 78.16 ? 15 MET A CG 1 ATOM 71 S SD . MET A 1 15 ? -1.691 2.541 20.099 1.00 80.03 ? 15 MET A SD 1 ATOM 72 C CE . MET A 1 15 ? -2.420 3.759 18.984 1.00 80.17 ? 15 MET A CE 1 ATOM 73 N N . SER A 1 16 ? 1.853 1.840 15.038 1.00 70.80 ? 16 SER A N 1 ATOM 74 C CA . SER A 1 16 ? 2.180 2.380 13.702 1.00 70.62 ? 16 SER A CA 1 ATOM 75 C C . SER A 1 16 ? 1.349 1.785 12.570 1.00 70.25 ? 16 SER A C 1 ATOM 76 O O . SER A 1 16 ? 1.197 0.551 12.461 1.00 68.08 ? 16 SER A O 1 ATOM 77 C CB . SER A 1 16 ? 3.689 2.318 13.414 1.00 69.93 ? 16 SER A CB 1 ATOM 78 O OG . SER A 1 16 ? 4.358 3.224 14.297 1.00 72.25 ? 16 SER A OG 1 ATOM 79 N N . SER A 1 17 ? 0.827 2.692 11.746 1.00 70.24 ? 17 SER A N 1 ATOM 80 C CA . SER A 1 17 ? 0.001 2.356 10.614 1.00 70.53 ? 17 SER A CA 1 ATOM 81 C C . SER A 1 17 ? 0.681 2.816 9.339 1.00 70.95 ? 17 SER A C 1 ATOM 82 O O . SER A 1 17 ? 0.972 4.004 9.186 1.00 72.38 ? 17 SER A O 1 ATOM 83 C CB . SER A 1 17 ? -1.363 3.040 10.738 1.00 70.39 ? 17 SER A CB 1 ATOM 84 O OG . SER A 1 17 ? -2.102 2.564 11.867 1.00 71.00 ? 17 SER A OG 1 ATOM 85 N N . PHE A 1 18 ? 0.929 1.875 8.438 1.00 70.89 ? 18 PHE A N 1 ATOM 86 C CA . PHE A 1 18 ? 1.494 2.126 7.101 1.00 71.21 ? 18 PHE A CA 1 ATOM 87 C C . PHE A 1 18 ? 0.440 1.715 6.089 1.00 70.98 ? 18 PHE A C 1 ATOM 88 O O . PHE A 1 18 ? 0.212 0.536 5.887 1.00 70.36 ? 18 PHE A O 1 ATOM 89 C CB . PHE A 1 18 ? 2.774 1.297 6.864 1.00 70.37 ? 18 PHE A CB 1 ATOM 90 C CG . PHE A 1 18 ? 3.893 1.656 7.784 1.00 70.64 ? 18 PHE A CG 1 ATOM 91 C CD1 . PHE A 1 18 ? 3.981 1.081 9.049 1.00 70.83 ? 18 PHE A CD1 1 ATOM 92 C CD2 . PHE A 1 18 ? 4.857 2.580 7.395 1.00 70.49 ? 18 PHE A CD2 1 ATOM 93 C CE1 . PHE A 1 18 ? 5.022 1.415 9.928 1.00 72.64 ? 18 PHE A CE1 1 ATOM 94 C CE2 . PHE A 1 18 ? 5.900 2.926 8.246 1.00 72.31 ? 18 PHE A CE2 1 ATOM 95 C CZ . PHE A 1 18 ? 5.991 2.349 9.528 1.00 72.68 ? 18 PHE A CZ 1 ATOM 96 N N . ALA A 1 19 ? -0.196 2.702 5.465 1.00 72.04 ? 19 ALA A N 1 ATOM 97 C CA . ALA A 1 19 ? -1.244 2.465 4.449 1.00 72.65 ? 19 ALA A CA 1 ATOM 98 C C . ALA A 1 19 ? -0.727 2.206 3.013 1.00 72.93 ? 19 ALA A C 1 ATOM 99 O O . ALA A 1 19 ? -1.321 1.446 2.244 1.00 73.20 ? 19 ALA A O 1 ATOM 100 C CB . ALA A 1 19 ? -2.237 3.613 4.457 1.00 72.88 ? 19 ALA A CB 1 ATOM 101 N N . ASN A 1 20 ? 0.376 2.859 2.666 1.00 72.78 ? 20 ASN A N 1 ATOM 102 C CA . ASN A 1 20 ? 1.042 2.704 1.373 1.00 72.37 ? 20 ASN A CA 1 ATOM 103 C C . ASN A 1 20 ? 2.451 3.287 1.484 1.00 72.27 ? 20 ASN A C 1 ATOM 104 O O . ASN A 1 20 ? 2.874 3.687 2.576 1.00 72.09 ? 20 ASN A O 1 ATOM 105 C CB . ASN A 1 20 ? 0.219 3.294 0.195 1.00 72.57 ? 20 ASN A CB 1 ATOM 106 C CG . ASN A 1 20 ? -0.192 4.767 0.393 1.00 72.50 ? 20 ASN A CG 1 ATOM 107 O OD1 . ASN A 1 20 ? 0.482 5.545 1.067 1.00 71.53 ? 20 ASN A OD1 1 ATOM 108 N ND2 . ASN A 1 20 ? -1.317 5.139 -0.225 1.00 74.32 ? 20 ASN A ND2 1 ATOM 109 N N . ARG A 1 21 ? 3.169 3.335 0.370 1.00 72.02 ? 21 ARG A N 1 ATOM 110 C CA . ARG A 1 21 ? 4.562 3.773 0.349 1.00 72.04 ? 21 ARG A CA 1 ATOM 111 C C . ARG A 1 21 ? 4.748 5.207 0.841 1.00 71.91 ? 21 ARG A C 1 ATOM 112 O O . ARG A 1 21 ? 5.854 5.623 1.151 1.00 71.16 ? 21 ARG A O 1 ATOM 113 C CB . ARG A 1 21 ? 5.129 3.604 -1.077 1.00 71.98 ? 21 ARG A CB 1 ATOM 114 C CG . ARG A 1 21 ? 5.524 2.262 -1.063 0.00 40.00 ? 21 ARG A CG 1 ATOM 115 C CD . ARG A 1 21 ? 5.966 2.001 -2.501 0.00 40.00 ? 21 ARG A CD 1 ATOM 116 N NE . ARG A 1 21 ? 6.770 3.120 -2.998 0.00 40.00 ? 21 ARG A NE 1 ATOM 117 C CZ . ARG A 1 21 ? 6.748 3.585 -4.246 0.00 40.00 ? 21 ARG A CZ 1 ATOM 118 N NH1 . ARG A 1 21 ? 5.952 3.028 -5.154 0.00 40.00 ? 21 ARG A NH1 1 ATOM 119 N NH2 . ARG A 1 21 ? 7.524 4.614 -4.579 0.00 40.00 ? 21 ARG A NH2 1 ATOM 120 N N . SER A 1 22 ? 3.654 5.954 0.919 1.00 72.87 ? 22 SER A N 1 ATOM 121 C CA . SER A 1 22 ? 3.736 7.396 1.171 1.00 73.81 ? 22 SER A CA 1 ATOM 122 C C . SER A 1 22 ? 2.802 8.006 2.226 1.00 74.10 ? 22 SER A C 1 ATOM 123 O O . SER A 1 22 ? 2.856 9.216 2.442 1.00 74.74 ? 22 SER A O 1 ATOM 124 C CB . SER A 1 22 ? 3.605 8.174 -0.149 1.00 73.89 ? 22 SER A CB 1 ATOM 125 O OG . SER A 1 22 ? 2.344 7.980 -0.763 1.00 74.84 ? 22 SER A OG 1 ATOM 126 N N . TRP A 1 23 ? 1.956 7.199 2.867 1.00 73.82 ? 23 TRP A N 1 ATOM 127 C CA . TRP A 1 23 ? 1.099 7.682 3.956 1.00 73.89 ? 23 TRP A CA 1 ATOM 128 C C . TRP A 1 23 ? 1.416 6.799 5.143 1.00 74.39 ? 23 TRP A C 1 ATOM 129 O O . TRP A 1 23 ? 1.376 5.564 5.026 1.00 74.01 ? 23 TRP A O 1 ATOM 130 C CB . TRP A 1 23 ? -0.394 7.583 3.592 1.00 73.74 ? 23 TRP A CB 1 ATOM 131 C CG . TRP A 1 23 ? -1.450 8.173 4.589 1.00 73.30 ? 23 TRP A CG 1 ATOM 132 C CD1 . TRP A 1 23 ? -2.125 9.365 4.458 1.00 73.14 ? 23 TRP A CD1 1 ATOM 133 C CD2 . TRP A 1 23 ? -1.934 7.585 5.818 1.00 72.65 ? 23 TRP A CD2 1 ATOM 134 N NE1 . TRP A 1 23 ? -2.982 9.555 5.518 1.00 73.28 ? 23 TRP A NE1 1 ATOM 135 C CE2 . TRP A 1 23 ? -2.888 8.482 6.369 1.00 73.51 ? 23 TRP A CE2 1 ATOM 136 C CE3 . TRP A 1 23 ? -1.653 6.389 6.520 1.00 72.99 ? 23 TRP A CE3 1 ATOM 137 C CZ2 . TRP A 1 23 ? -3.564 8.221 7.581 1.00 73.57 ? 23 TRP A CZ2 1 ATOM 138 C CZ3 . TRP A 1 23 ? -2.322 6.130 7.723 1.00 71.98 ? 23 TRP A CZ3 1 ATOM 139 C CH2 . TRP A 1 23 ? -3.267 7.042 8.238 1.00 72.78 ? 23 TRP A CH2 1 ATOM 140 N N . SER A 1 24 ? 1.736 7.442 6.272 1.00 74.59 ? 24 SER A N 1 ATOM 141 C CA . SER A 1 24 ? 2.046 6.741 7.522 1.00 74.93 ? 24 SER A CA 1 ATOM 142 C C . SER A 1 24 ? 1.919 7.582 8.790 1.00 75.04 ? 24 SER A C 1 ATOM 143 O O . SER A 1 24 ? 2.290 8.772 8.814 1.00 75.21 ? 24 SER A O 1 ATOM 144 C CB . SER A 1 24 ? 3.446 6.170 7.476 1.00 74.76 ? 24 SER A CB 1 ATOM 145 O OG . SER A 1 24 ? 3.499 5.118 8.398 1.00 77.14 ? 24 SER A OG 1 ATOM 146 N N . ARG A 1 25 ? 1.390 6.961 9.838 1.00 74.87 ? 25 ARG A N 1 ATOM 147 C CA . ARG A 1 25 ? 1.330 7.605 11.137 1.00 74.96 ? 25 ARG A CA 1 ATOM 148 C C . ARG A 1 25 ? 1.792 6.660 12.237 1.00 75.30 ? 25 ARG A C 1 ATOM 149 O O . ARG A 1 25 ? 1.612 5.418 12.149 1.00 74.79 ? 25 ARG A O 1 ATOM 150 C CB . ARG A 1 25 ? -0.061 8.199 11.457 1.00 74.58 ? 25 ARG A CB 1 ATOM 151 C CG . ARG A 1 25 ? -1.108 7.247 12.022 1.00 75.12 ? 25 ARG A CG 1 ATOM 152 C CD . ARG A 1 25 ? -2.383 7.927 12.594 1.00 75.51 ? 25 ARG A CD 1 ATOM 153 N NE . ARG A 1 25 ? -2.092 9.098 13.440 1.00 76.34 ? 25 ARG A NE 1 ATOM 154 C CZ . ARG A 1 25 ? -2.619 10.298 13.258 1.00 79.80 ? 25 ARG A CZ 1 ATOM 155 N NH1 . ARG A 1 25 ? -3.479 10.503 12.264 1.00 80.07 ? 25 ARG A NH1 1 ATOM 156 N NH2 . ARG A 1 25 ? -2.297 11.303 14.069 1.00 81.08 ? 25 ARG A NH2 1 ATOM 157 N N . THR A 1 26 ? 2.400 7.262 13.255 1.00 74.93 ? 26 THR A N 1 ATOM 158 C CA . THR A 1 26 ? 2.753 6.568 14.486 1.00 75.57 ? 26 THR A CA 1 ATOM 159 C C . THR A 1 26 ? 2.413 7.356 15.741 1.00 75.26 ? 26 THR A C 1 ATOM 160 O O . THR A 1 26 ? 2.622 8.598 15.823 1.00 74.08 ? 26 THR A O 1 ATOM 161 C CB . THR A 1 26 ? 4.186 5.797 14.462 1.00 76.75 ? 26 THR A CB 1 ATOM 162 O OG1 . THR A 1 26 ? 4.826 5.827 15.753 1.00 78.03 ? 26 THR A OG1 1 ATOM 163 C CG2 . THR A 1 26 ? 5.214 6.395 13.524 1.00 77.40 ? 26 THR A CG2 1 ATOM 164 N N . ASP A 1 27 ? 1.857 6.640 16.707 1.00 74.57 ? 27 ASP A N 1 ATOM 165 C CA . ASP A 1 27 ? 1.384 7.230 17.957 1.00 75.80 ? 27 ASP A CA 1 ATOM 166 C C . ASP A 1 27 ? 1.809 6.349 19.126 1.00 75.74 ? 27 ASP A C 1 ATOM 167 O O . ASP A 1 27 ? 1.814 5.124 19.003 1.00 75.03 ? 27 ASP A O 1 ATOM 168 C CB . ASP A 1 27 ? -0.147 7.335 17.936 1.00 76.17 ? 27 ASP A CB 1 ATOM 169 C CG . ASP A 1 27 ? -0.662 8.228 16.806 1.00 79.21 ? 27 ASP A CG 1 ATOM 170 O OD1 . ASP A 1 27 ? -1.176 7.663 15.798 1.00 82.69 ? 27 ASP A OD1 1 ATOM 171 O OD2 . ASP A 1 27 ? -0.591 9.483 16.827 1.00 78.37 ? 27 ASP A OD2 1 ATOM 172 N N . SER A 1 28 ? 2.147 6.993 20.235 1.00 74.40 ? 28 SER A N 1 ATOM 173 C CA . SER A 1 28 ? 2.585 6.353 21.476 1.00 74.83 ? 28 SER A CA 1 ATOM 174 C C . SER A 1 28 ? 1.803 6.850 22.683 1.00 74.19 ? 28 SER A C 1 ATOM 175 O O . SER A 1 28 ? 1.428 8.064 22.824 1.00 75.10 ? 28 SER A O 1 ATOM 176 C CB . SER A 1 28 ? 4.053 6.680 21.835 1.00 74.12 ? 28 SER A CB 1 ATOM 177 O OG . SER A 1 28 ? 4.956 6.633 20.744 1.00 78.87 ? 28 SER A OG 1 ATOM 178 N N . VAL A 1 29 ? 1.595 5.901 23.567 1.00 73.41 ? 29 VAL A N 1 ATOM 179 C CA . VAL A 1 29 ? 0.985 6.138 24.846 1.00 73.03 ? 29 VAL A CA 1 ATOM 180 C C . VAL A 1 29 ? 1.862 5.374 25.862 1.00 73.37 ? 29 VAL A C 1 ATOM 181 O O . VAL A 1 29 ? 2.302 4.222 25.593 1.00 72.18 ? 29 VAL A O 1 ATOM 182 C CB . VAL A 1 29 ? -0.487 5.686 24.788 1.00 73.72 ? 29 VAL A CB 1 ATOM 183 C CG1 . VAL A 1 29 ? -0.631 4.183 25.102 1.00 73.48 ? 29 VAL A CG1 1 ATOM 184 C CG2 . VAL A 1 29 ? -1.296 6.472 25.654 1.00 71.25 ? 29 VAL A CG2 1 ATOM 185 N N . VAL A 1 30 ? 2.135 6.014 27.004 1.00 72.10 ? 30 VAL A N 1 ATOM 186 C CA . VAL A 1 30 ? 2.893 5.373 28.083 1.00 71.91 ? 30 VAL A CA 1 ATOM 187 C C . VAL A 1 30 ? 2.100 5.223 29.400 1.00 71.79 ? 30 VAL A C 1 ATOM 188 O O . VAL A 1 30 ? 1.389 6.147 29.809 1.00 72.77 ? 30 VAL A O 1 ATOM 189 C CB . VAL A 1 30 ? 4.377 5.926 28.224 1.00 72.64 ? 30 VAL A CB 1 ATOM 190 C CG1 . VAL A 1 30 ? 4.565 7.243 27.538 1.00 73.34 ? 30 VAL A CG1 1 ATOM 191 C CG2 . VAL A 1 30 ? 4.832 5.956 29.630 1.00 70.53 ? 30 VAL A CG2 1 ATOM 192 N N . TRP A 1 31 ? 2.237 4.050 30.034 1.00 70.87 ? 31 TRP A N 1 ATOM 193 C CA . TRP A 1 31 ? 1.533 3.655 31.260 1.00 69.69 ? 31 TRP A CA 1 ATOM 194 C C . TRP A 1 31 ? 2.454 3.222 32.395 1.00 69.28 ? 31 TRP A C 1 ATOM 195 O O . TRP A 1 31 ? 3.471 2.576 32.160 1.00 69.64 ? 31 TRP A O 1 ATOM 196 C CB . TRP A 1 31 ? 0.639 2.440 30.993 1.00 69.32 ? 31 TRP A CB 1 ATOM 197 C CG . TRP A 1 31 ? -0.424 2.649 29.987 1.00 69.63 ? 31 TRP A CG 1 ATOM 198 C CD1 . TRP A 1 31 ? -0.364 2.368 28.638 1.00 71.29 ? 31 TRP A CD1 1 ATOM 199 C CD2 . TRP A 1 31 ? -1.719 3.179 30.217 1.00 69.54 ? 31 TRP A CD2 1 ATOM 200 N NE1 . TRP A 1 31 ? -1.551 2.700 28.033 1.00 70.67 ? 31 TRP A NE1 1 ATOM 201 C CE2 . TRP A 1 31 ? -2.398 3.203 28.986 1.00 70.74 ? 31 TRP A CE2 1 ATOM 202 C CE3 . TRP A 1 31 ? -2.391 3.639 31.346 1.00 70.71 ? 31 TRP A CE3 1 ATOM 203 C CZ2 . TRP A 1 31 ? -3.712 3.670 28.869 1.00 70.80 ? 31 TRP A CZ2 1 ATOM 204 C CZ3 . TRP A 1 31 ? -3.679 4.096 31.216 1.00 70.19 ? 31 TRP A CZ3 1 ATOM 205 C CH2 . TRP A 1 31 ? -4.328 4.107 29.995 1.00 67.96 ? 31 TRP A CH2 1 ATOM 206 N N . LEU A 1 32 ? 2.089 3.580 33.623 1.00 68.64 ? 32 LEU A N 1 ATOM 207 C CA . LEU A 1 32 ? 2.756 3.064 34.811 1.00 68.12 ? 32 LEU A CA 1 ATOM 208 C C . LEU A 1 32 ? 1.618 2.390 35.557 1.00 68.80 ? 32 LEU A C 1 ATOM 209 O O . LEU A 1 32 ? 0.655 3.044 35.904 1.00 68.08 ? 32 LEU A O 1 ATOM 210 C CB . LEU A 1 32 ? 3.381 4.167 35.671 1.00 67.66 ? 32 LEU A CB 1 ATOM 211 C CG . LEU A 1 32 ? 4.205 3.711 36.890 1.00 66.98 ? 32 LEU A CG 1 ATOM 212 C CD1 . LEU A 1 32 ? 5.347 2.760 36.534 1.00 64.24 ? 32 LEU A CD1 1 ATOM 213 C CD2 . LEU A 1 32 ? 4.751 4.909 37.666 1.00 66.42 ? 32 LEU A CD2 1 ATOM 214 N N . GLY A 1 33 ? 1.723 1.088 35.800 1.00 69.34 ? 33 GLY A N 1 ATOM 215 C CA . GLY A 1 33 ? 0.598 0.365 36.348 1.00 69.98 ? 33 GLY A CA 1 ATOM 216 C C . GLY A 1 33 ? -0.512 0.797 35.427 1.00 70.35 ? 33 GLY A C 1 ATOM 217 O O . GLY A 1 33 ? -0.347 0.822 34.225 1.00 69.92 ? 33 GLY A O 1 ATOM 218 N N . ASP A 1 34 ? -1.642 1.173 35.984 1.00 70.90 ? 34 ASP A N 1 ATOM 219 C CA . ASP A 1 34 ? -2.764 1.475 35.138 1.00 71.49 ? 34 ASP A CA 1 ATOM 220 C C . ASP A 1 34 ? -3.022 2.968 35.001 1.00 71.51 ? 34 ASP A C 1 ATOM 221 O O . ASP A 1 34 ? -4.138 3.375 34.670 1.00 71.07 ? 34 ASP A O 1 ATOM 222 C CB . ASP A 1 34 ? -3.998 0.701 35.623 1.00 71.81 ? 34 ASP A CB 1 ATOM 223 C CG . ASP A 1 34 ? -4.308 0.943 37.102 1.00 73.80 ? 34 ASP A CG 1 ATOM 224 O OD1 . ASP A 1 34 ? -4.054 2.065 37.595 1.00 76.67 ? 34 ASP A OD1 1 ATOM 225 O OD2 . ASP A 1 34 ? -4.809 0.071 37.855 1.00 74.62 ? 34 ASP A OD2 1 ATOM 226 N N . LEU A 1 35 ? -1.999 3.787 35.256 1.00 70.96 ? 35 LEU A N 1 ATOM 227 C CA . LEU A 1 35 ? -2.117 5.229 35.062 1.00 71.41 ? 35 LEU A CA 1 ATOM 228 C C . LEU A 1 35 ? -1.315 5.726 33.841 1.00 72.35 ? 35 LEU A C 1 ATOM 229 O O . LEU A 1 35 ? -0.079 5.534 33.795 1.00 72.57 ? 35 LEU A O 1 ATOM 230 C CB . LEU A 1 35 ? -1.629 5.992 36.306 1.00 71.07 ? 35 LEU A CB 1 ATOM 231 C CG . LEU A 1 35 ? -2.259 5.762 37.674 1.00 71.73 ? 35 LEU A CG 1 ATOM 232 C CD1 . LEU A 1 35 ? -1.880 6.917 38.547 1.00 70.47 ? 35 LEU A CD1 1 ATOM 233 C CD2 . LEU A 1 35 ? -3.803 5.642 37.620 1.00 70.63 ? 35 LEU A CD2 1 ATOM 234 N N . GLN A 1 36 ? -1.994 6.364 32.874 1.00 72.49 ? 36 GLN A N 1 ATOM 235 C CA . GLN A 1 36 ? -1.295 6.973 31.717 1.00 73.19 ? 36 GLN A CA 1 ATOM 236 C C . GLN A 1 36 ? -0.446 8.149 32.090 1.00 73.02 ? 36 GLN A C 1 ATOM 237 O O . GLN A 1 36 ? -0.921 9.085 32.708 1.00 73.20 ? 36 GLN A O 1 ATOM 238 C CB . GLN A 1 36 ? -2.249 7.415 30.625 1.00 74.41 ? 36 GLN A CB 1 ATOM 239 C CG . GLN A 1 36 ? -1.608 7.424 29.224 1.00 74.07 ? 36 GLN A CG 1 ATOM 240 C CD . GLN A 1 36 ? -2.469 8.150 28.228 1.00 73.98 ? 36 GLN A CD 1 ATOM 241 O OE1 . GLN A 1 36 ? -3.684 8.210 28.398 1.00 72.84 ? 36 GLN A OE1 1 ATOM 242 N NE2 . GLN A 1 36 ? -1.852 8.712 27.184 1.00 71.85 ? 36 GLN A NE2 1 ATOM 243 N N . THR A 1 37 ? 0.822 8.104 31.709 1.00 73.19 ? 37 THR A N 1 ATOM 244 C CA . THR A 1 37 ? 1.742 9.165 32.058 1.00 72.84 ? 37 THR A CA 1 ATOM 245 C C . THR A 1 37 ? 2.111 10.089 30.909 1.00 72.37 ? 37 THR A C 1 ATOM 246 O O . THR A 1 37 ? 2.360 11.289 31.118 1.00 73.25 ? 37 THR A O 1 ATOM 247 C CB . THR A 1 37 ? 3.009 8.549 32.660 1.00 73.34 ? 37 THR A CB 1 ATOM 248 O OG1 . THR A 1 37 ? 3.416 7.463 31.816 1.00 74.73 ? 37 THR A OG1 1 ATOM 249 C CG2 . THR A 1 37 ? 2.678 7.890 33.990 1.00 71.34 ? 37 THR A CG2 1 ATOM 250 N N . HIS A 1 38 ? 2.165 9.545 29.705 1.00 71.70 ? 38 HIS A N 1 ATOM 251 C CA . HIS A 1 38 ? 2.489 10.355 28.538 1.00 71.24 ? 38 HIS A CA 1 ATOM 252 C C . HIS A 1 38 ? 1.730 9.924 27.287 1.00 71.85 ? 38 HIS A C 1 ATOM 253 O O . HIS A 1 38 ? 1.139 8.826 27.182 1.00 70.08 ? 38 HIS A O 1 ATOM 254 C CB . HIS A 1 38 ? 3.990 10.409 28.166 1.00 71.57 ? 38 HIS A CB 1 ATOM 255 C CG . HIS A 1 38 ? 4.967 10.378 29.312 1.00 69.03 ? 38 HIS A CG 1 ATOM 256 N ND1 . HIS A 1 38 ? 5.255 9.229 30.017 1.00 68.33 ? 38 HIS A ND1 1 ATOM 257 C CD2 . HIS A 1 38 ? 5.749 11.345 29.849 1.00 70.78 ? 38 HIS A CD2 1 ATOM 258 C CE1 . HIS A 1 38 ? 6.153 9.491 30.947 1.00 69.60 ? 38 HIS A CE1 1 ATOM 259 N NE2 . HIS A 1 38 ? 6.471 10.769 30.868 1.00 68.06 ? 38 HIS A NE2 1 ATOM 260 N N . ARG A 1 39 ? 1.776 10.836 26.327 1.00 72.29 ? 39 ARG A N 1 ATOM 261 C CA . ARG A 1 39 ? 1.139 10.672 25.030 1.00 73.07 ? 39 ARG A CA 1 ATOM 262 C C . ARG A 1 39 ? 2.025 11.414 24.024 1.00 72.25 ? 39 ARG A C 1 ATOM 263 O O . ARG A 1 39 ? 2.587 12.510 24.328 1.00 72.26 ? 39 ARG A O 1 ATOM 264 C CB . ARG A 1 39 ? -0.226 11.352 25.067 1.00 74.01 ? 39 ARG A CB 1 ATOM 265 C CG . ARG A 1 39 ? -1.004 11.242 23.821 1.00 78.54 ? 39 ARG A CG 1 ATOM 266 C CD . ARG A 1 39 ? -1.750 12.504 23.450 1.00 86.04 ? 39 ARG A CD 1 ATOM 267 N NE . ARG A 1 39 ? -2.661 12.956 24.497 1.00 89.95 ? 39 ARG A NE 1 ATOM 268 C CZ . ARG A 1 39 ? -2.640 14.162 25.055 1.00 90.03 ? 39 ARG A CZ 1 ATOM 269 N NH1 . ARG A 1 39 ? -1.748 15.077 24.672 1.00 91.62 ? 39 ARG A NH1 1 ATOM 270 N NH2 . ARG A 1 39 ? -3.528 14.450 26.005 1.00 88.96 ? 39 ARG A NH2 1 ATOM 271 N N . TRP A 1 40 ? 2.145 10.819 22.842 1.00 70.99 ? 40 TRP A N 1 ATOM 272 C CA . TRP A 1 40 ? 2.825 11.428 21.697 1.00 69.88 ? 40 TRP A CA 1 ATOM 273 C C . TRP A 1 40 ? 2.005 11.158 20.431 1.00 69.66 ? 40 TRP A C 1 ATOM 274 O O . TRP A 1 40 ? 1.992 10.027 19.936 1.00 68.98 ? 40 TRP A O 1 ATOM 275 C CB . TRP A 1 40 ? 4.238 10.863 21.583 1.00 69.63 ? 40 TRP A CB 1 ATOM 276 C CG . TRP A 1 40 ? 5.194 11.673 20.813 1.00 70.00 ? 40 TRP A CG 1 ATOM 277 C CD1 . TRP A 1 40 ? 5.040 12.983 20.390 1.00 72.29 ? 40 TRP A CD1 1 ATOM 278 C CD2 . TRP A 1 40 ? 6.497 11.271 20.387 1.00 68.73 ? 40 TRP A CD2 1 ATOM 279 N NE1 . TRP A 1 40 ? 6.166 13.397 19.720 1.00 71.34 ? 40 TRP A NE1 1 ATOM 280 C CE2 . TRP A 1 40 ? 7.075 12.368 19.698 1.00 71.97 ? 40 TRP A CE2 1 ATOM 281 C CE3 . TRP A 1 40 ? 7.243 10.091 20.511 1.00 68.35 ? 40 TRP A CE3 1 ATOM 282 C CZ2 . TRP A 1 40 ? 8.370 12.311 19.132 1.00 72.50 ? 40 TRP A CZ2 1 ATOM 283 C CZ3 . TRP A 1 40 ? 8.523 10.035 19.947 1.00 69.81 ? 40 TRP A CZ3 1 ATOM 284 C CH2 . TRP A 1 40 ? 9.067 11.128 19.270 1.00 71.76 ? 40 TRP A CH2 1 ATOM 285 N N . SER A 1 41 ? 1.309 12.175 19.908 1.00 69.45 ? 41 SER A N 1 ATOM 286 C CA . SER A 1 41 ? 0.578 11.965 18.637 1.00 69.49 ? 41 SER A CA 1 ATOM 287 C C . SER A 1 41 ? 1.463 12.248 17.410 1.00 68.88 ? 41 SER A C 1 ATOM 288 O O . SER A 1 41 ? 2.423 13.021 17.497 1.00 70.02 ? 41 SER A O 1 ATOM 289 C CB . SER A 1 41 ? -0.758 12.723 18.581 1.00 69.44 ? 41 SER A CB 1 ATOM 290 O OG . SER A 1 41 ? -0.589 14.119 18.739 1.00 70.44 ? 41 SER A OG 1 ATOM 291 N N . ASN A 1 42 ? 1.148 11.631 16.280 1.00 68.07 ? 42 ASN A N 1 ATOM 292 C CA . ASN A 1 42 ? 1.887 11.884 15.049 1.00 68.49 ? 42 ASN A CA 1 ATOM 293 C C . ASN A 1 42 ? 2.037 13.373 14.725 1.00 68.62 ? 42 ASN A C 1 ATOM 294 O O . ASN A 1 42 ? 3.085 13.807 14.271 1.00 68.80 ? 42 ASN A O 1 ATOM 295 C CB . ASN A 1 42 ? 1.242 11.166 13.864 1.00 67.87 ? 42 ASN A CB 1 ATOM 296 C CG . ASN A 1 42 ? 2.158 11.121 12.650 1.00 68.97 ? 42 ASN A CG 1 ATOM 297 O OD1 . ASN A 1 42 ? 2.884 10.165 12.471 1.00 65.15 ? 42 ASN A OD1 1 ATOM 298 N ND2 . ASN A 1 42 ? 2.127 12.176 11.811 1.00 70.23 ? 42 ASN A ND2 1 ATOM 299 N N . ASP A 1 43 ? 0.981 14.138 14.963 1.00 69.08 ? 43 ASP A N 1 ATOM 300 C CA . ASP A 1 43 ? 0.967 15.565 14.596 1.00 70.61 ? 43 ASP A CA 1 ATOM 301 C C . ASP A 1 43 ? 1.733 16.484 15.549 1.00 70.55 ? 43 ASP A C 1 ATOM 302 O O . ASP A 1 43 ? 1.916 17.673 15.253 1.00 70.40 ? 43 ASP A O 1 ATOM 303 C CB . ASP A 1 43 ? -0.473 16.073 14.327 1.00 70.53 ? 43 ASP A CB 1 ATOM 304 C CG . ASP A 1 43 ? -1.528 15.343 15.163 1.00 74.27 ? 43 ASP A CG 1 ATOM 305 O OD1 . ASP A 1 43 ? -1.804 14.119 14.900 1.00 75.05 ? 43 ASP A OD1 1 ATOM 306 O OD2 . ASP A 1 43 ? -2.136 15.922 16.106 1.00 76.64 ? 43 ASP A OD2 1 ATOM 307 N N . SER A 1 44 ? 2.182 15.935 16.678 1.00 71.01 ? 44 SER A N 1 ATOM 308 C CA . SER A 1 44 ? 2.985 16.696 17.641 1.00 70.77 ? 44 SER A CA 1 ATOM 309 C C . SER A 1 44 ? 4.476 16.337 17.588 1.00 70.78 ? 44 SER A C 1 ATOM 310 O O . SER A 1 44 ? 4.867 15.160 17.554 1.00 69.81 ? 44 SER A O 1 ATOM 311 C CB . SER A 1 44 ? 2.478 16.493 19.062 1.00 71.17 ? 44 SER A CB 1 ATOM 312 O OG . SER A 1 44 ? 3.356 17.177 19.956 1.00 73.40 ? 44 SER A OG 1 ATOM 313 N N . ALA A 1 45 ? 5.288 17.377 17.586 1.00 70.69 ? 45 ALA A N 1 ATOM 314 C CA . ALA A 1 45 ? 6.745 17.295 17.540 1.00 71.37 ? 45 ALA A CA 1 ATOM 315 C C . ALA A 1 45 ? 7.324 16.821 18.869 1.00 71.51 ? 45 ALA A C 1 ATOM 316 O O . ALA A 1 45 ? 8.455 16.323 18.928 1.00 71.26 ? 45 ALA A O 1 ATOM 317 C CB . ALA A 1 45 ? 7.333 18.733 17.200 1.00 70.76 ? 45 ALA A CB 1 ATOM 318 N N . THR A 1 46 ? 6.526 17.001 19.926 1.00 72.04 ? 46 THR A N 1 ATOM 319 C CA . THR A 1 46 ? 6.925 16.769 21.321 1.00 71.85 ? 46 THR A CA 1 ATOM 320 C C . THR A 1 46 ? 5.990 15.825 22.031 1.00 70.89 ? 46 THR A C 1 ATOM 321 O O . THR A 1 46 ? 4.782 15.859 21.771 1.00 70.50 ? 46 THR A O 1 ATOM 322 C CB . THR A 1 46 ? 6.768 18.054 22.112 1.00 71.89 ? 46 THR A CB 1 ATOM 323 O OG1 . THR A 1 46 ? 5.419 18.524 21.944 1.00 72.88 ? 46 THR A OG1 1 ATOM 324 C CG2 . THR A 1 46 ? 7.654 19.171 21.586 1.00 73.78 ? 46 THR A CG2 1 ATOM 325 N N . ILE A 1 47 ? 6.554 15.010 22.929 1.00 70.01 ? 47 ILE A N 1 ATOM 326 C CA . ILE A 1 47 ? 5.809 14.162 23.854 1.00 69.02 ? 47 ILE A CA 1 ATOM 327 C C . ILE A 1 47 ? 5.028 15.064 24.818 1.00 69.37 ? 47 ILE A C 1 ATOM 328 O O . ILE A 1 47 ? 5.555 16.094 25.284 1.00 68.59 ? 47 ILE A O 1 ATOM 329 C CB . ILE A 1 47 ? 6.799 13.349 24.692 1.00 68.67 ? 47 ILE A CB 1 ATOM 330 C CG1 . ILE A 1 47 ? 7.737 12.531 23.801 1.00 70.55 ? 47 ILE A CG1 1 ATOM 331 C CG2 . ILE A 1 47 ? 6.068 12.499 25.697 1.00 68.22 ? 47 ILE A CG2 1 ATOM 332 C CD1 . ILE A 1 47 ? 9.076 12.165 24.455 1.00 70.47 ? 47 ILE A CD1 1 ATOM 333 N N . SER A 1 48 ? 3.784 14.692 25.108 1.00 68.89 ? 48 SER A N 1 ATOM 334 C CA . SER A 1 48 ? 2.986 15.366 26.143 1.00 69.12 ? 48 SER A CA 1 ATOM 335 C C . SER A 1 48 ? 2.947 14.552 27.447 1.00 68.26 ? 48 SER A C 1 ATOM 336 O O . SER A 1 48 ? 2.756 13.329 27.412 1.00 66.86 ? 48 SER A O 1 ATOM 337 C CB . SER A 1 48 ? 1.529 15.583 25.706 1.00 69.16 ? 48 SER A CB 1 ATOM 338 O OG . SER A 1 48 ? 1.415 16.150 24.422 1.00 71.04 ? 48 SER A OG 1 ATOM 339 N N . PHE A 1 49 ? 3.127 15.252 28.575 1.00 67.03 ? 49 PHE A N 1 ATOM 340 C CA . PHE A 1 49 ? 2.938 14.658 29.907 1.00 66.91 ? 49 PHE A CA 1 ATOM 341 C C . PHE A 1 49 ? 1.460 14.636 30.184 1.00 66.25 ? 49 PHE A C 1 ATOM 342 O O . PHE A 1 49 ? 0.794 15.663 29.949 1.00 67.29 ? 49 PHE A O 1 ATOM 343 C CB . PHE A 1 49 ? 3.520 15.529 31.038 1.00 66.87 ? 49 PHE A CB 1 ATOM 344 C CG . PHE A 1 49 ? 4.949 15.914 30.872 1.00 67.14 ? 49 PHE A CG 1 ATOM 345 C CD1 . PHE A 1 49 ? 5.865 15.052 30.285 1.00 65.77 ? 49 PHE A CD1 1 ATOM 346 C CD2 . PHE A 1 49 ? 5.387 17.172 31.346 1.00 66.24 ? 49 PHE A CD2 1 ATOM 347 C CE1 . PHE A 1 49 ? 7.190 15.414 30.142 1.00 65.64 ? 49 PHE A CE1 1 ATOM 348 C CE2 . PHE A 1 49 ? 6.728 17.563 31.217 1.00 65.96 ? 49 PHE A CE2 1 ATOM 349 C CZ . PHE A 1 49 ? 7.635 16.692 30.617 1.00 67.54 ? 49 PHE A CZ 1 ATOM 350 N N . THR A 1 50 ? 0.933 13.509 30.690 1.00 65.79 ? 50 THR A N 1 ATOM 351 C CA . THR A 1 50 ? -0.471 13.455 31.100 1.00 64.35 ? 50 THR A CA 1 ATOM 352 C C . THR A 1 50 ? -0.588 13.317 32.583 1.00 65.00 ? 50 THR A C 1 ATOM 353 O O . THR A 1 50 ? -1.567 12.776 33.042 1.00 66.43 ? 50 THR A O 1 ATOM 354 C CB . THR A 1 50 ? -1.301 12.284 30.424 1.00 65.53 ? 50 THR A CB 1 ATOM 355 O OG1 . THR A 1 50 ? -0.701 11.017 30.717 1.00 63.34 ? 50 THR A OG1 1 ATOM 356 C CG2 . THR A 1 50 ? -1.286 12.395 28.929 1.00 65.59 ? 50 THR A CG2 1 ATOM 357 N N . LYS A 1 51 ? 0.397 13.815 33.349 1.00 64.55 ? 51 LYS A N 1 ATOM 358 C CA . LYS A 1 51 ? 0.374 13.702 34.762 1.00 62.79 ? 51 LYS A CA 1 ATOM 359 C C . LYS A 1 51 ? 1.305 14.819 35.284 1.00 62.24 ? 51 LYS A C 1 ATOM 360 O O . LYS A 1 51 ? 2.342 15.120 34.720 1.00 63.32 ? 51 LYS A O 1 ATOM 361 C CB . LYS A 1 51 ? 0.819 12.318 35.271 1.00 62.04 ? 51 LYS A CB 1 ATOM 362 C CG . LYS A 1 51 ? -0.163 11.107 35.063 1.00 63.13 ? 51 LYS A CG 1 ATOM 363 C CD . LYS A 1 51 ? -1.501 11.303 35.790 1.00 62.76 ? 51 LYS A CD 1 ATOM 364 C CE . LYS A 1 51 ? -2.185 10.030 36.109 1.00 62.29 ? 51 LYS A CE 1 ATOM 365 N NZ . LYS A 1 51 ? -2.752 9.289 34.837 1.00 62.54 ? 51 LYS A NZ 1 ATOM 366 N N . PRO A 1 52 ? 0.924 15.444 36.359 1.00 61.04 ? 52 PRO A N 1 ATOM 367 C CA . PRO A 1 52 ? 1.816 16.470 36.988 1.00 61.04 ? 52 PRO A CA 1 ATOM 368 C C . PRO A 1 52 ? 3.270 15.956 37.031 1.00 61.51 ? 52 PRO A C 1 ATOM 369 O O . PRO A 1 52 ? 4.181 16.658 36.644 1.00 63.13 ? 52 PRO A O 1 ATOM 370 C CB . PRO A 1 52 ? 1.221 16.596 38.363 1.00 59.41 ? 52 PRO A CB 1 ATOM 371 C CG . PRO A 1 52 ? -0.156 16.498 38.139 1.00 59.18 ? 52 PRO A CG 1 ATOM 372 C CD . PRO A 1 52 ? -0.348 15.289 37.100 1.00 60.91 ? 52 PRO A CD 1 ATOM 373 N N . TRP A 1 53 ? 3.451 14.700 37.470 1.00 63.36 ? 53 TRP A N 1 ATOM 374 C CA . TRP A 1 53 ? 4.748 14.069 37.699 1.00 63.59 ? 53 TRP A CA 1 ATOM 375 C C . TRP A 1 53 ? 5.352 13.225 36.552 1.00 65.06 ? 53 TRP A C 1 ATOM 376 O O . TRP A 1 53 ? 6.317 12.484 36.792 1.00 65.88 ? 53 TRP A O 1 ATOM 377 C CB . TRP A 1 53 ? 4.637 13.198 38.966 1.00 63.17 ? 53 TRP A CB 1 ATOM 378 C CG . TRP A 1 53 ? 3.367 12.343 39.017 1.00 63.24 ? 53 TRP A CG 1 ATOM 379 C CD1 . TRP A 1 53 ? 2.167 12.696 39.589 1.00 61.96 ? 53 TRP A CD1 1 ATOM 380 C CD2 . TRP A 1 53 ? 3.183 11.023 38.490 1.00 60.23 ? 53 TRP A CD2 1 ATOM 381 N NE1 . TRP A 1 53 ? 1.259 11.682 39.447 1.00 62.90 ? 53 TRP A NE1 1 ATOM 382 C CE2 . TRP A 1 53 ? 1.843 10.641 38.776 1.00 63.71 ? 53 TRP A CE2 1 ATOM 383 C CE3 . TRP A 1 53 ? 4.010 10.112 37.805 1.00 60.89 ? 53 TRP A CE3 1 ATOM 384 C CZ2 . TRP A 1 53 ? 1.304 9.390 38.398 1.00 62.04 ? 53 TRP A CZ2 1 ATOM 385 C CZ3 . TRP A 1 53 ? 3.460 8.848 37.418 1.00 61.44 ? 53 TRP A CZ3 1 ATOM 386 C CH2 . TRP A 1 53 ? 2.127 8.515 37.728 1.00 61.96 ? 53 TRP A CH2 1 ATOM 387 N N . SER A 1 54 ? 4.811 13.326 35.328 1.00 65.14 ? 54 SER A N 1 ATOM 388 C CA . SER A 1 54 ? 5.316 12.554 34.174 1.00 65.03 ? 54 SER A CA 1 ATOM 389 C C . SER A 1 54 ? 6.817 12.735 33.832 1.00 65.07 ? 54 SER A C 1 ATOM 390 O O . SER A 1 54 ? 7.410 11.846 33.237 1.00 64.17 ? 54 SER A O 1 ATOM 391 C CB . SER A 1 54 ? 4.508 12.870 32.922 1.00 64.88 ? 54 SER A CB 1 ATOM 392 O OG . SER A 1 54 ? 3.149 12.535 33.070 1.00 67.45 ? 54 SER A OG 1 ATOM 393 N N . GLN A 1 55 ? 7.422 13.874 34.192 1.00 63.69 ? 55 GLN A N 1 ATOM 394 C CA . GLN A 1 55 ? 8.878 14.098 33.942 1.00 63.96 ? 55 GLN A CA 1 ATOM 395 C C . GLN A 1 55 ? 9.726 13.326 34.954 1.00 64.20 ? 55 GLN A C 1 ATOM 396 O O . GLN A 1 55 ? 10.962 13.285 34.828 1.00 64.62 ? 55 GLN A O 1 ATOM 397 C CB . GLN A 1 55 ? 9.268 15.615 33.944 1.00 63.34 ? 55 GLN A CB 1 ATOM 398 C CG . GLN A 1 55 ? 10.736 15.931 33.527 1.00 62.99 ? 55 GLN A CG 1 ATOM 399 C CD . GLN A 1 55 ? 11.025 17.423 33.333 1.00 64.76 ? 55 GLN A CD 1 ATOM 400 O OE1 . GLN A 1 55 ? 10.329 18.092 32.559 1.00 67.01 ? 55 GLN A OE1 1 ATOM 401 N NE2 . GLN A 1 55 ? 12.047 17.947 34.031 1.00 57.68 ? 55 GLN A NE2 1 ATOM 402 N N . GLY A 1 56 ? 9.067 12.713 35.945 1.00 64.55 ? 56 GLY A N 1 ATOM 403 C CA . GLY A 1 56 ? 9.751 12.011 37.038 1.00 66.11 ? 56 GLY A CA 1 ATOM 404 C C . GLY A 1 56 ? 10.690 12.930 37.821 1.00 67.81 ? 56 GLY A C 1 ATOM 405 O O . GLY A 1 56 ? 10.386 14.107 38.034 1.00 68.13 ? 56 GLY A O 1 ATOM 406 N N . LYS A 1 57 ? 11.831 12.395 38.258 1.00 68.85 ? 57 LYS A N 1 ATOM 407 C CA . LYS A 1 57 ? 12.826 13.201 38.951 1.00 69.90 ? 57 LYS A CA 1 ATOM 408 C C . LYS A 1 57 ? 13.888 13.644 37.946 1.00 70.88 ? 57 LYS A C 1 ATOM 409 O O . LYS A 1 57 ? 15.049 13.864 38.319 1.00 70.59 ? 57 LYS A O 1 ATOM 410 C CB . LYS A 1 57 ? 13.466 12.431 40.126 1.00 70.02 ? 57 LYS A CB 1 ATOM 411 C CG . LYS A 1 57 ? 12.535 12.118 41.336 1.00 70.61 ? 57 LYS A CG 1 ATOM 412 C CD . LYS A 1 57 ? 12.300 13.287 42.353 1.00 73.88 ? 57 LYS A CD 1 ATOM 413 C CE . LYS A 1 57 ? 11.237 14.291 41.868 1.00 72.83 ? 57 LYS A CE 1 ATOM 414 N NZ . LYS A 1 57 ? 10.377 14.939 42.975 1.00 72.17 ? 57 LYS A NZ 1 ATOM 415 N N . LEU A 1 58 ? 13.501 13.782 36.670 1.00 71.23 ? 58 LEU A N 1 ATOM 416 C CA . LEU A 1 58 ? 14.459 14.226 35.654 1.00 72.06 ? 58 LEU A CA 1 ATOM 417 C C . LEU A 1 58 ? 14.529 15.740 35.427 1.00 72.85 ? 58 LEU A C 1 ATOM 418 O O . LEU A 1 58 ? 13.505 16.440 35.417 1.00 73.14 ? 58 LEU A O 1 ATOM 419 C CB . LEU A 1 58 ? 14.281 13.484 34.323 1.00 72.54 ? 58 LEU A CB 1 ATOM 420 C CG . LEU A 1 58 ? 14.587 11.980 34.213 1.00 72.58 ? 58 LEU A CG 1 ATOM 421 C CD1 . LEU A 1 58 ? 14.785 11.723 32.760 1.00 72.57 ? 58 LEU A CD1 1 ATOM 422 C CD2 . LEU A 1 58 ? 15.847 11.531 35.008 1.00 72.10 ? 58 LEU A CD2 1 ATOM 423 N N . SER A 1 59 ? 15.759 16.226 35.242 1.00 72.74 ? 59 SER A N 1 ATOM 424 C CA . SER A 1 59 ? 16.001 17.625 34.972 1.00 73.46 ? 59 SER A CA 1 ATOM 425 C C . SER A 1 59 ? 15.376 18.032 33.661 1.00 73.44 ? 59 SER A C 1 ATOM 426 O O . SER A 1 59 ? 15.139 17.198 32.784 1.00 73.63 ? 59 SER A O 1 ATOM 427 C CB . SER A 1 59 ? 17.506 17.884 34.888 1.00 74.03 ? 59 SER A CB 1 ATOM 428 O OG . SER A 1 59 ? 18.072 17.077 33.859 1.00 74.68 ? 59 SER A OG 1 ATOM 429 N N . ASN A 1 60 ? 15.107 19.321 33.523 1.00 73.69 ? 60 ASN A N 1 ATOM 430 C CA . ASN A 1 60 ? 14.644 19.823 32.249 1.00 74.20 ? 60 ASN A CA 1 ATOM 431 C C . ASN A 1 60 ? 15.608 19.419 31.130 1.00 74.13 ? 60 ASN A C 1 ATOM 432 O O . ASN A 1 60 ? 15.160 19.110 30.033 1.00 74.44 ? 60 ASN A O 1 ATOM 433 C CB . ASN A 1 60 ? 14.382 21.336 32.285 1.00 74.98 ? 60 ASN A CB 1 ATOM 434 C CG . ASN A 1 60 ? 12.971 21.677 32.769 1.00 76.14 ? 60 ASN A CG 1 ATOM 435 O OD1 . ASN A 1 60 ? 12.246 20.810 33.250 1.00 81.08 ? 60 ASN A OD1 1 ATOM 436 N ND2 . ASN A 1 60 ? 12.580 22.931 32.635 1.00 74.69 ? 60 ASN A ND2 1 ATOM 437 N N . GLN A 1 61 ? 16.918 19.405 31.392 1.00 73.66 ? 61 GLN A N 1 ATOM 438 C CA . GLN A 1 61 ? 17.864 18.964 30.357 1.00 73.15 ? 61 GLN A CA 1 ATOM 439 C C . GLN A 1 61 ? 17.873 17.446 30.187 1.00 72.43 ? 61 GLN A C 1 ATOM 440 O O . GLN A 1 61 ? 18.103 16.937 29.091 1.00 71.59 ? 61 GLN A O 1 ATOM 441 C CB . GLN A 1 61 ? 19.277 19.473 30.615 1.00 73.14 ? 61 GLN A CB 1 ATOM 442 C CG . GLN A 1 61 ? 19.383 21.024 30.664 1.00 74.33 ? 61 GLN A CG 1 ATOM 443 C CD . GLN A 1 61 ? 20.837 21.520 30.793 1.00 74.19 ? 61 GLN A CD 1 ATOM 444 O OE1 . GLN A 1 61 ? 21.796 20.784 30.493 1.00 74.26 ? 61 GLN A OE1 1 ATOM 445 N NE2 . GLN A 1 61 ? 20.999 22.772 31.240 1.00 75.48 ? 61 GLN A NE2 1 ATOM 446 N N . GLN A 1 62 ? 17.626 16.728 31.279 1.00 72.09 ? 62 GLN A N 1 ATOM 447 C CA . GLN A 1 62 ? 17.583 15.280 31.240 1.00 71.10 ? 62 GLN A CA 1 ATOM 448 C C . GLN A 1 62 ? 16.380 14.941 30.361 1.00 71.34 ? 62 GLN A C 1 ATOM 449 O O . GLN A 1 62 ? 16.425 13.999 29.585 1.00 70.89 ? 62 GLN A O 1 ATOM 450 C CB . GLN A 1 62 ? 18.028 14.608 32.136 0.00 40.00 ? 62 GLN A CB 1 ATOM 451 C CG . GLN A 1 62 ? 19.509 14.373 32.433 0.00 40.00 ? 62 GLN A CG 1 ATOM 452 C CD . GLN A 1 62 ? 20.391 14.640 31.220 0.00 40.00 ? 62 GLN A CD 1 ATOM 453 O OE1 . GLN A 1 62 ? 20.531 15.795 30.765 0.00 40.00 ? 62 GLN A OE1 1 ATOM 454 N NE2 . GLN A 1 62 ? 20.987 13.563 30.688 0.00 40.00 ? 62 GLN A NE2 1 ATOM 455 N N . TRP A 1 63 ? 15.310 15.725 30.492 1.00 70.92 ? 63 TRP A N 1 ATOM 456 C CA . TRP A 1 63 ? 14.139 15.519 29.646 1.00 70.63 ? 63 TRP A CA 1 ATOM 457 C C . TRP A 1 63 ? 14.409 15.958 28.194 1.00 71.10 ? 63 TRP A C 1 ATOM 458 O O . TRP A 1 63 ? 14.066 15.220 27.288 1.00 69.86 ? 63 TRP A O 1 ATOM 459 C CB . TRP A 1 63 ? 12.814 16.084 30.237 1.00 70.12 ? 63 TRP A CB 1 ATOM 460 C CG . TRP A 1 63 ? 11.658 15.650 29.412 1.00 67.90 ? 63 TRP A CG 1 ATOM 461 C CD1 . TRP A 1 63 ? 10.924 16.409 28.553 1.00 67.98 ? 63 TRP A CD1 1 ATOM 462 C CD2 . TRP A 1 63 ? 11.120 14.329 29.341 1.00 67.21 ? 63 TRP A CD2 1 ATOM 463 N NE1 . TRP A 1 63 ? 9.945 15.644 27.949 1.00 68.96 ? 63 TRP A NE1 1 ATOM 464 C CE2 . TRP A 1 63 ? 10.044 14.358 28.420 1.00 67.37 ? 63 TRP A CE2 1 ATOM 465 C CE3 . TRP A 1 63 ? 11.428 13.121 29.971 1.00 67.47 ? 63 TRP A CE3 1 ATOM 466 C CZ2 . TRP A 1 63 ? 9.278 13.218 28.114 1.00 70.20 ? 63 TRP A CZ2 1 ATOM 467 C CZ3 . TRP A 1 63 ? 10.669 11.981 29.659 1.00 69.72 ? 63 TRP A CZ3 1 ATOM 468 C CH2 . TRP A 1 63 ? 9.606 12.044 28.739 1.00 68.54 ? 63 TRP A CH2 1 ATOM 469 N N . GLU A 1 64 ? 15.022 17.137 27.982 1.00 71.40 ? 64 GLU A N 1 ATOM 470 C CA . GLU A 1 64 ? 15.404 17.600 26.629 1.00 72.44 ? 64 GLU A CA 1 ATOM 471 C C . GLU A 1 64 ? 16.129 16.480 25.880 1.00 72.82 ? 64 GLU A C 1 ATOM 472 O O . GLU A 1 64 ? 15.607 15.978 24.892 1.00 72.40 ? 64 GLU A O 1 ATOM 473 C CB . GLU A 1 64 ? 16.245 18.906 26.643 1.00 72.81 ? 64 GLU A CB 1 ATOM 474 C CG . GLU A 1 64 ? 15.481 20.183 27.026 1.00 72.85 ? 64 GLU A CG 1 ATOM 475 C CD . GLU A 1 64 ? 16.351 21.437 27.188 1.00 74.34 ? 64 GLU A CD 1 ATOM 476 O OE1 . GLU A 1 64 ? 17.245 21.673 26.337 1.00 74.65 ? 64 GLU A OE1 1 ATOM 477 O OE2 . GLU A 1 64 ? 16.138 22.206 28.180 1.00 76.90 ? 64 GLU A OE2 1 ATOM 478 N N . LYS A 1 65 ? 17.307 16.085 26.361 1.00 73.57 ? 65 LYS A N 1 ATOM 479 C CA . LYS A 1 65 ? 18.128 15.023 25.732 1.00 74.51 ? 65 LYS A CA 1 ATOM 480 C C . LYS A 1 65 ? 17.383 13.793 25.324 1.00 74.53 ? 65 LYS A C 1 ATOM 481 O O . LYS A 1 65 ? 17.540 13.276 24.202 1.00 75.69 ? 65 LYS A O 1 ATOM 482 C CB . LYS A 1 65 ? 19.229 14.517 26.670 1.00 74.88 ? 65 LYS A CB 1 ATOM 483 C CG . LYS A 1 65 ? 20.403 15.461 26.916 1.00 74.96 ? 65 LYS A CG 1 ATOM 484 C CD . LYS A 1 65 ? 21.447 14.814 27.828 1.00 75.58 ? 65 LYS A CD 1 ATOM 485 C CE . LYS A 1 65 ? 22.613 14.206 27.053 1.00 77.57 ? 65 LYS A CE 1 ATOM 486 N NZ . LYS A 1 65 ? 22.193 13.139 26.091 1.00 76.64 ? 65 LYS A NZ 1 ATOM 487 N N . LEU A 1 66 ? 16.572 13.304 26.253 1.00 74.24 ? 66 LEU A N 1 ATOM 488 C CA . LEU A 1 66 ? 15.897 12.031 26.077 1.00 72.76 ? 66 LEU A CA 1 ATOM 489 C C . LEU A 1 66 ? 14.777 12.170 25.064 1.00 72.62 ? 66 LEU A C 1 ATOM 490 O O . LEU A 1 66 ? 14.505 11.272 24.277 1.00 71.54 ? 66 LEU A O 1 ATOM 491 C CB . LEU A 1 66 ? 15.321 11.635 27.412 1.00 73.50 ? 66 LEU A CB 1 ATOM 492 C CG . LEU A 1 66 ? 14.642 10.292 27.508 1.00 71.95 ? 66 LEU A CG 1 ATOM 493 C CD1 . LEU A 1 66 ? 15.733 9.256 27.471 1.00 74.56 ? 66 LEU A CD1 1 ATOM 494 C CD2 . LEU A 1 66 ? 13.865 10.250 28.790 1.00 69.77 ? 66 LEU A CD2 1 ATOM 495 N N . GLN A 1 67 ? 14.119 13.312 25.094 1.00 72.55 ? 67 GLN A N 1 ATOM 496 C CA . GLN A 1 67 ? 13.062 13.575 24.164 1.00 73.86 ? 67 GLN A CA 1 ATOM 497 C C . GLN A 1 67 ? 13.634 13.483 22.756 1.00 74.34 ? 67 GLN A C 1 ATOM 498 O O . GLN A 1 67 ? 13.020 12.852 21.882 1.00 73.28 ? 67 GLN A O 1 ATOM 499 C CB . GLN A 1 67 ? 12.467 14.953 24.399 1.00 72.73 ? 67 GLN A CB 1 ATOM 500 C CG . GLN A 1 67 ? 11.159 15.128 23.695 1.00 75.11 ? 67 GLN A CG 1 ATOM 501 C CD . GLN A 1 67 ? 10.725 16.560 23.591 1.00 77.81 ? 67 GLN A CD 1 ATOM 502 O OE1 . GLN A 1 67 ? 9.547 16.822 23.361 1.00 79.41 ? 67 GLN A OE1 1 ATOM 503 N NE2 . GLN A 1 67 ? 11.661 17.495 23.756 1.00 77.38 ? 67 GLN A NE2 1 ATOM 504 N N . HIS A 1 68 ? 14.807 14.119 22.571 1.00 74.51 ? 68 HIS A N 1 ATOM 505 C CA . HIS A 1 68 ? 15.520 14.220 21.287 1.00 75.07 ? 68 HIS A CA 1 ATOM 506 C C . HIS A 1 68 ? 15.876 12.862 20.721 1.00 75.39 ? 68 HIS A C 1 ATOM 507 O O . HIS A 1 68 ? 15.700 12.611 19.536 1.00 75.27 ? 68 HIS A O 1 ATOM 508 C CB . HIS A 1 68 ? 16.765 15.081 21.435 1.00 76.15 ? 68 HIS A CB 1 ATOM 509 C CG . HIS A 1 68 ? 17.467 15.340 20.144 1.00 77.70 ? 68 HIS A CG 1 ATOM 510 N ND1 . HIS A 1 68 ? 18.461 14.518 19.663 1.00 79.84 ? 68 HIS A ND1 1 ATOM 511 C CD2 . HIS A 1 68 ? 17.315 16.325 19.233 1.00 78.16 ? 68 HIS A CD2 1 ATOM 512 C CE1 . HIS A 1 68 ? 18.895 14.990 18.509 1.00 79.94 ? 68 HIS A CE1 1 ATOM 513 N NE2 . HIS A 1 68 ? 18.215 16.085 18.227 1.00 80.12 ? 68 HIS A NE2 1 ATOM 514 N N . MET A 1 69 ? 16.367 11.983 21.580 1.00 75.28 ? 69 MET A N 1 ATOM 515 C CA . MET A 1 69 ? 16.622 10.620 21.216 1.00 75.45 ? 69 MET A CA 1 ATOM 516 C C . MET A 1 69 ? 15.379 9.978 20.570 1.00 74.58 ? 69 MET A C 1 ATOM 517 O O . MET A 1 69 ? 15.491 9.238 19.575 1.00 74.78 ? 69 MET A O 1 ATOM 518 C CB . MET A 1 69 ? 16.946 9.815 22.465 1.00 75.45 ? 69 MET A CB 1 ATOM 519 C CG . MET A 1 69 ? 18.266 10.079 23.192 1.00 77.13 ? 69 MET A CG 1 ATOM 520 S SD . MET A 1 69 ? 18.440 8.666 24.324 1.00 79.98 ? 69 MET A SD 1 ATOM 521 C CE . MET A 1 69 ? 17.711 7.367 23.301 1.00 75.10 ? 69 MET A CE 1 ATOM 522 N N . PHE A 1 70 ? 14.207 10.261 21.145 1.00 72.83 ? 70 PHE A N 1 ATOM 523 C CA . PHE A 1 70 ? 12.949 9.724 20.670 1.00 71.10 ? 70 PHE A CA 1 ATOM 524 C C . PHE A 1 70 ? 12.446 10.381 19.403 1.00 69.77 ? 70 PHE A C 1 ATOM 525 O O . PHE A 1 70 ? 11.884 9.715 18.534 1.00 68.52 ? 70 PHE A O 1 ATOM 526 C CB . PHE A 1 70 ? 11.910 9.753 21.789 1.00 71.36 ? 70 PHE A CB 1 ATOM 527 C CG . PHE A 1 70 ? 12.060 8.618 22.753 1.00 74.65 ? 70 PHE A CG 1 ATOM 528 C CD1 . PHE A 1 70 ? 11.732 7.329 22.362 1.00 72.31 ? 70 PHE A CD1 1 ATOM 529 C CD2 . PHE A 1 70 ? 12.529 8.829 24.047 1.00 74.98 ? 70 PHE A CD2 1 ATOM 530 C CE1 . PHE A 1 70 ? 11.860 6.237 23.245 1.00 75.89 ? 70 PHE A CE1 1 ATOM 531 C CE2 . PHE A 1 70 ? 12.673 7.754 24.947 1.00 74.96 ? 70 PHE A CE2 1 ATOM 532 C CZ . PHE A 1 70 ? 12.337 6.451 24.544 1.00 75.09 ? 70 PHE A CZ 1 ATOM 533 N N . GLN A 1 71 ? 12.642 11.697 19.301 1.00 69.10 ? 71 GLN A N 1 ATOM 534 C CA . GLN A 1 71 ? 12.306 12.446 18.081 1.00 68.24 ? 71 GLN A CA 1 ATOM 535 C C . GLN A 1 71 ? 13.097 11.902 16.890 1.00 69.11 ? 71 GLN A C 1 ATOM 536 O O . GLN A 1 71 ? 12.534 11.685 15.823 1.00 70.36 ? 71 GLN A O 1 ATOM 537 C CB . GLN A 1 71 ? 12.569 13.941 18.267 1.00 67.14 ? 71 GLN A CB 1 ATOM 538 C CG . GLN A 1 71 ? 11.599 14.638 19.173 1.00 63.98 ? 71 GLN A CG 1 ATOM 539 C CD . GLN A 1 71 ? 11.998 16.123 19.420 1.00 67.32 ? 71 GLN A CD 1 ATOM 540 O OE1 . GLN A 1 71 ? 13.112 16.548 19.080 1.00 64.16 ? 71 GLN A OE1 1 ATOM 541 N NE2 . GLN A 1 71 ? 11.086 16.890 20.001 1.00 63.40 ? 71 GLN A NE2 1 ATOM 542 N N . VAL A 1 72 ? 14.394 11.672 17.083 1.00 69.09 ? 72 VAL A N 1 ATOM 543 C CA . VAL A 1 72 ? 15.246 11.089 16.054 1.00 69.27 ? 72 VAL A CA 1 ATOM 544 C C . VAL A 1 72 ? 14.776 9.699 15.706 1.00 69.34 ? 72 VAL A C 1 ATOM 545 O O . VAL A 1 72 ? 14.635 9.365 14.533 1.00 69.00 ? 72 VAL A O 1 ATOM 546 C CB . VAL A 1 72 ? 16.736 11.008 16.488 1.00 69.26 ? 72 VAL A CB 1 ATOM 547 C CG1 . VAL A 1 72 ? 17.494 10.058 15.578 1.00 70.63 ? 72 VAL A CG1 1 ATOM 548 C CG2 . VAL A 1 72 ? 17.390 12.393 16.457 1.00 67.50 ? 72 VAL A CG2 1 ATOM 549 N N . TYR A 1 73 ? 14.541 8.899 16.740 1.00 69.71 ? 73 TYR A N 1 ATOM 550 C CA . TYR A 1 73 ? 14.078 7.515 16.588 1.00 70.28 ? 73 TYR A CA 1 ATOM 551 C C . TYR A 1 73 ? 12.776 7.407 15.790 1.00 70.49 ? 73 TYR A C 1 ATOM 552 O O . TYR A 1 73 ? 12.709 6.628 14.881 1.00 72.00 ? 73 TYR A O 1 ATOM 553 C CB . TYR A 1 73 ? 13.899 6.863 17.938 1.00 70.23 ? 73 TYR A CB 1 ATOM 554 C CG . TYR A 1 73 ? 12.918 5.715 17.882 1.00 70.61 ? 73 TYR A CG 1 ATOM 555 C CD1 . TYR A 1 73 ? 13.280 4.508 17.318 1.00 71.66 ? 73 TYR A CD1 1 ATOM 556 C CD2 . TYR A 1 73 ? 11.626 5.848 18.391 1.00 69.96 ? 73 TYR A CD2 1 ATOM 557 C CE1 . TYR A 1 73 ? 12.390 3.458 17.257 1.00 72.26 ? 73 TYR A CE1 1 ATOM 558 C CE2 . TYR A 1 73 ? 10.728 4.816 18.340 1.00 66.58 ? 73 TYR A CE2 1 ATOM 559 C CZ . TYR A 1 73 ? 11.114 3.613 17.768 1.00 72.39 ? 73 TYR A CZ 1 ATOM 560 O OH . TYR A 1 73 ? 10.244 2.539 17.696 1.00 69.17 ? 73 TYR A OH 1 ATOM 561 N N . ARG A 1 74 ? 11.755 8.194 16.136 1.00 71.30 ? 74 ARG A N 1 ATOM 562 C CA . ARG A 1 74 ? 10.471 8.212 15.439 1.00 71.22 ? 74 ARG A CA 1 ATOM 563 C C . ARG A 1 74 ? 10.620 8.384 13.909 1.00 70.95 ? 74 ARG A C 1 ATOM 564 O O . ARG A 1 74 ? 9.973 7.686 13.128 1.00 71.28 ? 74 ARG A O 1 ATOM 565 C CB . ARG A 1 74 ? 9.529 9.273 16.053 1.00 71.69 ? 74 ARG A CB 1 ATOM 566 C CG . ARG A 1 74 ? 8.063 9.134 15.554 1.00 72.90 ? 74 ARG A CG 1 ATOM 567 C CD . ARG A 1 74 ? 7.031 10.110 16.117 1.00 71.50 ? 74 ARG A CD 1 ATOM 568 N NE . ARG A 1 74 ? 7.512 11.494 16.066 1.00 75.46 ? 74 ARG A NE 1 ATOM 569 C CZ . ARG A 1 74 ? 6.729 12.576 16.041 1.00 77.79 ? 74 ARG A CZ 1 ATOM 570 N NH1 . ARG A 1 74 ? 5.401 12.451 16.058 1.00 76.71 ? 74 ARG A NH1 1 ATOM 571 N NH2 . ARG A 1 74 ? 7.284 13.800 15.996 1.00 78.72 ? 74 ARG A NH2 1 ATOM 572 N N . VAL A 1 75 ? 11.472 9.313 13.491 1.00 71.37 ? 75 VAL A N 1 ATOM 573 C CA . VAL A 1 75 ? 11.796 9.500 12.067 1.00 70.74 ? 75 VAL A CA 1 ATOM 574 C C . VAL A 1 75 ? 12.543 8.287 11.480 1.00 70.76 ? 75 VAL A C 1 ATOM 575 O O . VAL A 1 75 ? 12.217 7.844 10.382 1.00 70.49 ? 75 VAL A O 1 ATOM 576 C CB . VAL A 1 75 ? 12.609 10.801 11.772 1.00 70.82 ? 75 VAL A CB 1 ATOM 577 C CG1 . VAL A 1 75 ? 12.642 11.079 10.273 1.00 69.81 ? 75 VAL A CG1 1 ATOM 578 C CG2 . VAL A 1 75 ? 11.991 11.999 12.439 1.00 70.42 ? 75 VAL A CG2 1 ATOM 579 N N . SER A 1 76 ? 13.524 7.756 12.214 1.00 70.25 ? 76 SER A N 1 ATOM 580 C CA . SER A 1 76 ? 14.355 6.666 11.720 1.00 70.10 ? 76 SER A CA 1 ATOM 581 C C . SER A 1 76 ? 13.576 5.344 11.593 1.00 70.55 ? 76 SER A C 1 ATOM 582 O O . SER A 1 76 ? 13.911 4.525 10.732 1.00 70.75 ? 76 SER A O 1 ATOM 583 C CB . SER A 1 76 ? 15.576 6.469 12.612 1.00 69.64 ? 76 SER A CB 1 ATOM 584 O OG . SER A 1 76 ? 16.389 7.624 12.632 1.00 71.14 ? 76 SER A OG 1 ATOM 585 N N . PHE A 1 77 ? 12.560 5.152 12.453 1.00 70.70 ? 77 PHE A N 1 ATOM 586 C CA . PHE A 1 77 ? 11.705 3.962 12.464 1.00 70.11 ? 77 PHE A CA 1 ATOM 587 C C . PHE A 1 77 ? 10.834 4.031 11.245 1.00 70.72 ? 77 PHE A C 1 ATOM 588 O O . PHE A 1 77 ? 10.780 3.056 10.518 1.00 71.68 ? 77 PHE A O 1 ATOM 589 C CB . PHE A 1 77 ? 10.851 3.889 13.742 1.00 69.93 ? 77 PHE A CB 1 ATOM 590 C CG . PHE A 1 77 ? 9.838 2.759 13.762 1.00 70.95 ? 77 PHE A CG 1 ATOM 591 C CD1 . PHE A 1 77 ? 8.537 2.962 13.316 1.00 72.50 ? 77 PHE A CD1 1 ATOM 592 C CD2 . PHE A 1 77 ? 10.183 1.498 14.230 1.00 69.17 ? 77 PHE A CD2 1 ATOM 593 C CE1 . PHE A 1 77 ? 7.595 1.907 13.331 1.00 71.91 ? 77 PHE A CE1 1 ATOM 594 C CE2 . PHE A 1 77 ? 9.263 0.466 14.251 1.00 72.99 ? 77 PHE A CE2 1 ATOM 595 C CZ . PHE A 1 77 ? 7.963 0.657 13.799 1.00 70.12 ? 77 PHE A CZ 1 ATOM 596 N N . THR A 1 78 ? 10.160 5.167 11.017 1.00 70.84 ? 78 THR A N 1 ATOM 597 C CA . THR A 1 78 ? 9.293 5.359 9.822 1.00 71.47 ? 78 THR A CA 1 ATOM 598 C C . THR A 1 78 ? 10.019 4.974 8.531 1.00 72.74 ? 78 THR A C 1 ATOM 599 O O . THR A 1 78 ? 9.479 4.237 7.705 1.00 73.89 ? 78 THR A O 1 ATOM 600 C CB . THR A 1 78 ? 8.757 6.849 9.706 1.00 70.98 ? 78 THR A CB 1 ATOM 601 O OG1 . THR A 1 78 ? 7.981 7.192 10.860 1.00 72.32 ? 78 THR A OG1 1 ATOM 602 C CG2 . THR A 1 78 ? 7.749 7.008 8.585 1.00 68.96 ? 78 THR A CG2 1 ATOM 603 N N . ARG A 1 79 ? 11.239 5.464 8.347 1.00 73.86 ? 79 ARG A N 1 ATOM 604 C CA . ARG A 1 79 ? 11.942 5.226 7.099 1.00 75.78 ? 79 ARG A CA 1 ATOM 605 C C . ARG A 1 79 ? 12.513 3.812 6.963 1.00 75.87 ? 79 ARG A C 1 ATOM 606 O O . ARG A 1 79 ? 12.495 3.254 5.866 1.00 76.18 ? 79 ARG A O 1 ATOM 607 C CB . ARG A 1 79 ? 12.987 6.322 6.833 1.00 76.78 ? 79 ARG A CB 1 ATOM 608 C CG . ARG A 1 79 ? 14.178 6.301 7.750 1.00 80.19 ? 79 ARG A CG 1 ATOM 609 C CD . ARG A 1 79 ? 15.509 5.829 7.120 1.00 84.84 ? 79 ARG A CD 1 ATOM 610 N NE . ARG A 1 79 ? 16.491 5.587 8.188 1.00 88.32 ? 79 ARG A NE 1 ATOM 611 C CZ . ARG A 1 79 ? 17.195 6.529 8.826 1.00 89.09 ? 79 ARG A CZ 1 ATOM 612 N NH1 . ARG A 1 79 ? 17.055 7.827 8.521 1.00 88.36 ? 79 ARG A NH1 1 ATOM 613 N NH2 . ARG A 1 79 ? 18.048 6.163 9.779 1.00 89.71 ? 79 ARG A NH2 1 ATOM 614 N N . ASP A 1 80 ? 13.001 3.239 8.060 1.00 76.03 ? 80 ASP A N 1 ATOM 615 C CA . ASP A 1 80 ? 13.567 1.893 8.022 1.00 76.92 ? 80 ASP A CA 1 ATOM 616 C C . ASP A 1 80 ? 12.510 0.831 7.700 1.00 76.83 ? 80 ASP A C 1 ATOM 617 O O . ASP A 1 80 ? 12.788 -0.081 6.929 1.00 77.54 ? 80 ASP A O 1 ATOM 618 C CB . ASP A 1 80 ? 14.302 1.530 9.329 1.00 77.34 ? 80 ASP A CB 1 ATOM 619 C CG . ASP A 1 80 ? 15.638 2.291 9.525 1.00 80.38 ? 80 ASP A CG 1 ATOM 620 O OD1 . ASP A 1 80 ? 15.917 3.306 8.833 1.00 83.33 ? 80 ASP A OD1 1 ATOM 621 O OD2 . ASP A 1 80 ? 16.489 1.938 10.376 1.00 81.76 ? 80 ASP A OD2 1 ATOM 622 N N . ILE A 1 81 ? 11.313 0.941 8.285 1.00 76.41 ? 81 ILE A N 1 ATOM 623 C CA . ILE A 1 81 ? 10.202 0.009 8.010 1.00 75.49 ? 81 ILE A CA 1 ATOM 624 C C . ILE A 1 81 ? 9.807 0.048 6.541 1.00 75.32 ? 81 ILE A C 1 ATOM 625 O O . ILE A 1 81 ? 9.554 -0.995 5.923 1.00 75.19 ? 81 ILE A O 1 ATOM 626 C CB . ILE A 1 81 ? 8.961 0.344 8.906 1.00 75.61 ? 81 ILE A CB 1 ATOM 627 C CG1 . ILE A 1 81 ? 9.253 0.078 10.388 1.00 75.73 ? 81 ILE A CG1 1 ATOM 628 C CG2 . ILE A 1 81 ? 7.720 -0.419 8.431 1.00 75.45 ? 81 ILE A CG2 1 ATOM 629 C CD1 . ILE A 1 81 ? 9.495 -1.414 10.739 1.00 78.04 ? 81 ILE A CD1 1 ATOM 630 N N . GLN A 1 82 ? 9.759 1.257 5.990 1.00 75.45 ? 82 GLN A N 1 ATOM 631 C CA . GLN A 1 82 ? 9.422 1.444 4.597 1.00 76.39 ? 82 GLN A CA 1 ATOM 632 C C . GLN A 1 82 ? 10.409 0.673 3.723 1.00 76.35 ? 82 GLN A C 1 ATOM 633 O O . GLN A 1 82 ? 9.999 -0.035 2.805 1.00 76.43 ? 82 GLN A O 1 ATOM 634 C CB . GLN A 1 82 ? 9.325 2.933 4.252 1.00 75.97 ? 82 GLN A CB 1 ATOM 635 C CG . GLN A 1 82 ? 8.082 3.571 4.856 1.00 76.85 ? 82 GLN A CG 1 ATOM 636 C CD . GLN A 1 82 ? 7.975 5.075 4.636 1.00 78.45 ? 82 GLN A CD 1 ATOM 637 O OE1 . GLN A 1 82 ? 8.986 5.789 4.604 1.00 81.61 ? 82 GLN A OE1 1 ATOM 638 N NE2 . GLN A 1 82 ? 6.740 5.566 4.494 1.00 80.27 ? 82 GLN A NE2 1 ATOM 639 N N . GLU A 1 83 ? 11.696 0.807 4.027 1.00 76.73 ? 83 GLU A N 1 ATOM 640 C CA . GLU A 1 83 ? 12.748 0.030 3.372 1.00 77.36 ? 83 GLU A CA 1 ATOM 641 C C . GLU A 1 83 ? 12.577 -1.472 3.579 1.00 76.68 ? 83 GLU A C 1 ATOM 642 O O . GLU A 1 83 ? 12.518 -2.214 2.623 1.00 76.93 ? 83 GLU A O 1 ATOM 643 C CB . GLU A 1 83 ? 14.108 0.395 3.944 1.00 78.44 ? 83 GLU A CB 1 ATOM 644 C CG . GLU A 1 83 ? 14.773 1.644 3.412 1.00 82.05 ? 83 GLU A CG 1 ATOM 645 C CD . GLU A 1 83 ? 16.210 1.735 3.905 1.00 87.77 ? 83 GLU A CD 1 ATOM 646 O OE1 . GLU A 1 83 ? 17.142 1.480 3.092 1.00 89.06 ? 83 GLU A OE1 1 ATOM 647 O OE2 . GLU A 1 83 ? 16.401 2.049 5.112 1.00 90.41 ? 83 GLU A OE2 1 ATOM 648 N N . LEU A 1 84 ? 12.496 -1.907 4.832 1.00 76.07 ? 84 LEU A N 1 ATOM 649 C CA . LEU A 1 84 ? 12.400 -3.331 5.173 1.00 76.05 ? 84 LEU A CA 1 ATOM 650 C C . LEU A 1 84 ? 11.107 -4.019 4.720 1.00 76.01 ? 84 LEU A C 1 ATOM 651 O O . LEU A 1 84 ? 11.077 -5.219 4.527 1.00 76.45 ? 84 LEU A O 1 ATOM 652 C CB . LEU A 1 84 ? 12.599 -3.537 6.660 1.00 75.48 ? 84 LEU A CB 1 ATOM 653 C CG . LEU A 1 84 ? 13.877 -3.029 7.339 1.00 75.40 ? 84 LEU A CG 1 ATOM 654 C CD1 . LEU A 1 84 ? 13.696 -3.061 8.842 1.00 72.74 ? 84 LEU A CD1 1 ATOM 655 C CD2 . LEU A 1 84 ? 15.118 -3.849 6.948 1.00 76.33 ? 84 LEU A CD2 1 ATOM 656 N N . VAL A 1 85 ? 10.044 -3.250 4.554 1.00 76.00 ? 85 VAL A N 1 ATOM 657 C CA . VAL A 1 85 ? 8.800 -3.781 4.021 1.00 75.53 ? 85 VAL A CA 1 ATOM 658 C C . VAL A 1 85 ? 8.918 -4.298 2.569 1.00 75.05 ? 85 VAL A C 1 ATOM 659 O O . VAL A 1 85 ? 8.203 -5.206 2.199 1.00 74.64 ? 85 VAL A O 1 ATOM 660 C CB . VAL A 1 85 ? 7.642 -2.779 4.243 1.00 75.57 ? 85 VAL A CB 1 ATOM 661 C CG1 . VAL A 1 85 ? 6.631 -2.812 3.110 1.00 76.12 ? 85 VAL A CG1 1 ATOM 662 C CG2 . VAL A 1 85 ? 6.983 -3.069 5.572 1.00 75.73 ? 85 VAL A CG2 1 ATOM 663 N N . LYS A 1 86 ? 9.818 -3.730 1.764 1.00 74.99 ? 86 LYS A N 1 ATOM 664 C CA . LYS A 1 86 ? 10.059 -4.198 0.376 1.00 75.47 ? 86 LYS A CA 1 ATOM 665 C C . LYS A 1 86 ? 10.477 -5.669 0.309 1.00 76.09 ? 86 LYS A C 1 ATOM 666 O O . LYS A 1 86 ? 10.219 -6.359 -0.679 1.00 76.11 ? 86 LYS A O 1 ATOM 667 C CB . LYS A 1 86 ? 11.119 -3.358 -0.321 1.00 74.86 ? 86 LYS A CB 1 ATOM 668 C CG . LYS A 1 86 ? 10.838 -1.873 -0.328 1.00 76.16 ? 86 LYS A CG 1 ATOM 669 C CD . LYS A 1 86 ? 11.885 -1.146 -1.114 1.00 74.97 ? 86 LYS A CD 1 ATOM 670 C CE . LYS A 1 86 ? 11.743 0.343 -1.003 1.00 74.33 ? 86 LYS A CE 1 ATOM 671 N NZ . LYS A 1 86 ? 12.578 0.956 -2.079 1.00 75.04 ? 86 LYS A NZ 1 ATOM 672 N N . MET A 1 87 ? 11.119 -6.135 1.376 1.00 77.34 ? 87 MET A N 1 ATOM 673 C CA . MET A 1 87 ? 11.588 -7.510 1.504 1.00 78.50 ? 87 MET A CA 1 ATOM 674 C C . MET A 1 87 ? 10.479 -8.473 1.921 1.00 79.01 ? 87 MET A C 1 ATOM 675 O O . MET A 1 87 ? 10.740 -9.642 2.180 1.00 79.18 ? 87 MET A O 1 ATOM 676 C CB . MET A 1 87 ? 12.680 -7.574 2.560 1.00 77.77 ? 87 MET A CB 1 ATOM 677 C CG . MET A 1 87 ? 13.689 -6.466 2.502 1.00 78.39 ? 87 MET A CG 1 ATOM 678 S SD . MET A 1 87 ? 15.031 -6.956 3.569 1.00 80.06 ? 87 MET A SD 1 ATOM 679 C CE . MET A 1 87 ? 15.999 -5.457 3.838 1.00 76.11 ? 87 MET A CE 1 ATOM 680 N N . MET A 1 88 ? 9.251 -7.977 1.989 1.00 80.04 ? 88 MET A N 1 ATOM 681 C CA . MET A 1 88 ? 8.111 -8.768 2.439 1.00 81.86 ? 88 MET A CA 1 ATOM 682 C C . MET A 1 88 ? 7.805 -9.914 1.469 1.00 83.02 ? 88 MET A C 1 ATOM 683 O O . MET A 1 88 ? 7.943 -9.743 0.254 1.00 83.28 ? 88 MET A O 1 ATOM 684 C CB . MET A 1 88 ? 6.902 -7.861 2.590 1.00 81.22 ? 88 MET A CB 1 ATOM 685 C CG . MET A 1 88 ? 5.773 -8.404 3.411 1.00 81.52 ? 88 MET A CG 1 ATOM 686 S SD . MET A 1 88 ? 4.565 -7.082 3.564 1.00 82.25 ? 88 MET A SD 1 ATOM 687 C CE . MET A 1 88 ? 5.338 -6.057 4.791 1.00 80.12 ? 88 MET A CE 1 ATOM 688 N N . SER A 1 89 ? 7.400 -11.064 2.019 1.00 84.74 ? 89 SER A N 1 ATOM 689 C CA . SER A 1 89 ? 7.046 -12.266 1.223 1.00 86.82 ? 89 SER A CA 1 ATOM 690 C C . SER A 1 89 ? 5.928 -12.054 0.168 1.00 88.23 ? 89 SER A C 1 ATOM 691 O O . SER A 1 89 ? 5.499 -10.919 -0.035 1.00 88.92 ? 89 SER A O 1 ATOM 692 C CB . SER A 1 89 ? 6.841 -13.493 2.113 1.00 86.56 ? 89 SER A CB 1 ATOM 693 O OG . SER A 1 89 ? 8.059 -14.229 2.170 1.00 87.11 ? 89 SER A OG 1 ATOM 694 N N . PRO A 1 90 ? 5.416 -13.103 -0.482 1.00 89.34 ? 90 PRO A N 1 ATOM 695 C CA . PRO A 1 90 ? 4.865 -12.936 -1.810 1.00 90.03 ? 90 PRO A CA 1 ATOM 696 C C . PRO A 1 90 ? 5.024 -11.517 -2.370 1.00 90.38 ? 90 PRO A C 1 ATOM 697 O O . PRO A 1 90 ? 5.975 -11.281 -3.129 1.00 90.85 ? 90 PRO A O 1 ATOM 698 C CB . PRO A 1 90 ? 3.453 -13.475 -1.637 1.00 89.98 ? 90 PRO A CB 1 ATOM 699 C CG . PRO A 1 90 ? 3.789 -14.764 -0.761 1.00 90.25 ? 90 PRO A CG 1 ATOM 700 C CD . PRO A 1 90 ? 5.207 -14.498 -0.055 1.00 89.82 ? 90 PRO A CD 1 ATOM 701 N N . LYS A 1 91 ? 4.147 -10.584 -2.017 1.00 90.44 ? 91 LYS A N 1 ATOM 702 C CA . LYS A 1 91 ? 4.327 -9.216 -2.485 1.00 90.59 ? 91 LYS A CA 1 ATOM 703 C C . LYS A 1 91 ? 4.193 -8.265 -1.305 1.00 90.43 ? 91 LYS A C 1 ATOM 704 O O . LYS A 1 91 ? 3.514 -8.584 -0.329 1.00 90.52 ? 91 LYS A O 1 ATOM 705 C CB . LYS A 1 91 ? 3.378 -8.877 -3.669 1.00 90.78 ? 91 LYS A CB 1 ATOM 706 C CG . LYS A 1 91 ? 1.974 -8.351 -3.327 1.00 91.26 ? 91 LYS A CG 1 ATOM 707 C CD . LYS A 1 91 ? 1.091 -9.372 -2.630 1.00 91.90 ? 91 LYS A CD 1 ATOM 708 C CE . LYS A 1 91 ? 0.036 -8.673 -1.797 1.00 92.40 ? 91 LYS A CE 1 ATOM 709 N NZ . LYS A 1 91 ? -0.725 -9.635 -0.956 1.00 92.84 ? 91 LYS A NZ 1 ATOM 710 N N . GLU A 1 92 ? 4.855 -7.113 -1.411 1.00 90.37 ? 92 GLU A N 1 ATOM 711 C CA . GLU A 1 92 ? 4.815 -6.022 -0.426 1.00 90.24 ? 92 GLU A CA 1 ATOM 712 C C . GLU A 1 92 ? 3.345 -5.670 -0.070 1.00 90.38 ? 92 GLU A C 1 ATOM 713 O O . GLU A 1 92 ? 2.794 -4.672 -0.558 1.00 90.47 ? 92 GLU A O 1 ATOM 714 C CB . GLU A 1 92 ? 5.579 -4.821 -1.029 1.00 90.27 ? 92 GLU A CB 1 ATOM 715 C CG . GLU A 1 92 ? 5.820 -3.604 -0.142 1.00 89.89 ? 92 GLU A CG 1 ATOM 716 C CD . GLU A 1 92 ? 6.589 -2.482 -0.851 1.00 89.83 ? 92 GLU A CD 1 ATOM 717 O OE1 . GLU A 1 92 ? 7.080 -2.690 -1.968 1.00 88.43 ? 92 GLU A OE1 1 ATOM 718 O OE2 . GLU A 1 92 ? 6.713 -1.372 -0.294 1.00 90.89 ? 92 GLU A OE2 1 ATOM 719 N N . ASP A 1 93 ? 2.725 -6.499 0.783 1.00 90.13 ? 93 ASP A N 1 ATOM 720 C CA . ASP A 1 93 ? 1.276 -6.424 1.082 1.00 89.64 ? 93 ASP A CA 1 ATOM 721 C C . ASP A 1 93 ? 0.844 -5.153 1.820 1.00 88.43 ? 93 ASP A C 1 ATOM 722 O O . ASP A 1 93 ? 1.523 -4.684 2.728 1.00 88.04 ? 93 ASP A O 1 ATOM 723 C CB . ASP A 1 93 ? 0.775 -7.706 1.807 1.00 90.27 ? 93 ASP A CB 1 ATOM 724 C CG . ASP A 1 93 ? 1.277 -7.828 3.282 1.00 92.38 ? 93 ASP A CG 1 ATOM 725 O OD1 . ASP A 1 93 ? 0.957 -6.966 4.153 1.00 91.28 ? 93 ASP A OD1 1 ATOM 726 O OD2 . ASP A 1 93 ? 1.998 -8.786 3.657 1.00 94.78 ? 93 ASP A OD2 1 ATOM 727 N N . TYR A 1 94 ? -0.286 -4.576 1.442 1.00 87.28 ? 94 TYR A N 1 ATOM 728 C CA . TYR A 1 94 ? -0.646 -3.409 2.199 1.00 85.81 ? 94 TYR A CA 1 ATOM 729 C C . TYR A 1 94 ? -1.498 -3.476 3.446 1.00 85.14 ? 94 TYR A C 1 ATOM 730 O O . TYR A 1 94 ? -1.454 -4.517 4.112 1.00 86.13 ? 94 TYR A O 1 ATOM 731 C CB . TYR A 1 94 ? -0.533 -2.062 1.490 1.00 85.63 ? 94 TYR A CB 1 ATOM 732 C CG . TYR A 1 94 ? 0.875 -1.505 1.616 1.00 84.73 ? 94 TYR A CG 1 ATOM 733 C CD1 . TYR A 1 94 ? 1.829 -1.742 0.630 1.00 85.61 ? 94 TYR A CD1 1 ATOM 734 C CD2 . TYR A 1 94 ? 1.250 -0.754 2.715 1.00 84.26 ? 94 TYR A CD2 1 ATOM 735 C CE1 . TYR A 1 94 ? 3.120 -1.243 0.732 1.00 85.04 ? 94 TYR A CE1 1 ATOM 736 C CE2 . TYR A 1 94 ? 2.541 -0.249 2.830 1.00 85.15 ? 94 TYR A CE2 1 ATOM 737 C CZ . TYR A 1 94 ? 3.471 -0.500 1.827 1.00 85.30 ? 94 TYR A CZ 1 ATOM 738 O OH . TYR A 1 94 ? 4.752 -0.014 1.914 1.00 84.57 ? 94 TYR A OH 1 ATOM 739 N N . PRO A 1 95 ? -2.298 -2.467 3.774 1.00 83.49 ? 95 PRO A N 1 ATOM 740 C CA . PRO A 1 95 ? -2.278 -1.952 5.142 1.00 81.37 ? 95 PRO A CA 1 ATOM 741 C C . PRO A 1 95 ? -1.277 -2.716 6.021 1.00 79.18 ? 95 PRO A C 1 ATOM 742 O O . PRO A 1 95 ? -1.389 -3.927 6.209 1.00 78.77 ? 95 PRO A O 1 ATOM 743 C CB . PRO A 1 95 ? -3.746 -2.037 5.548 1.00 81.36 ? 95 PRO A CB 1 ATOM 744 C CG . PRO A 1 95 ? -4.438 -1.676 4.194 1.00 82.78 ? 95 PRO A CG 1 ATOM 745 C CD . PRO A 1 95 ? -3.359 -1.804 2.998 1.00 83.55 ? 95 PRO A CD 1 ATOM 746 N N . ILE A 1 96 ? -0.280 -2.024 6.540 1.00 76.96 ? 96 ILE A N 1 ATOM 747 C CA . ILE A 1 96 ? 0.626 -2.683 7.464 1.00 75.11 ? 96 ILE A CA 1 ATOM 748 C C . ILE A 1 96 ? 0.473 -2.043 8.818 1.00 74.97 ? 96 ILE A C 1 ATOM 749 O O . ILE A 1 96 ? 0.493 -0.801 8.951 1.00 74.23 ? 96 ILE A O 1 ATOM 750 C CB . ILE A 1 96 ? 2.077 -2.690 6.972 1.00 74.95 ? 96 ILE A CB 1 ATOM 751 C CG1 . ILE A 1 96 ? 2.225 -3.700 5.852 1.00 74.99 ? 96 ILE A CG1 1 ATOM 752 C CG2 . ILE A 1 96 ? 3.035 -3.115 8.087 1.00 73.78 ? 96 ILE A CG2 1 ATOM 753 C CD1 . ILE A 1 96 ? 3.433 -3.468 5.042 1.00 77.98 ? 96 ILE A CD1 1 ATOM 754 N N . GLU A 1 97 ? 0.315 -2.912 9.815 1.00 74.35 ? 97 GLU A N 1 ATOM 755 C CA . GLU A 1 97 ? 0.150 -2.495 11.203 1.00 74.49 ? 97 GLU A CA 1 ATOM 756 C C . GLU A 1 97 ? 1.293 -3.052 12.027 1.00 73.72 ? 97 GLU A C 1 ATOM 757 O O . GLU A 1 97 ? 1.536 -4.278 12.023 1.00 73.43 ? 97 GLU A O 1 ATOM 758 C CB . GLU A 1 97 ? -1.168 -3.021 11.750 1.00 74.29 ? 97 GLU A CB 1 ATOM 759 C CG . GLU A 1 97 ? -1.924 -1.896 12.379 1.00 76.53 ? 97 GLU A CG 1 ATOM 760 C CD . GLU A 1 97 ? -2.535 -1.015 11.301 1.00 77.16 ? 97 GLU A CD 1 ATOM 761 O OE1 . GLU A 1 97 ? -2.668 0.212 11.557 1.00 72.42 ? 97 GLU A OE1 1 ATOM 762 O OE2 . GLU A 1 97 ? -2.869 -1.571 10.201 1.00 75.22 ? 97 GLU A OE2 1 ATOM 763 N N . ILE A 1 98 ? 1.990 -2.164 12.706 1.00 72.67 ? 98 ILE A N 1 ATOM 764 C CA . ILE A 1 98 ? 3.144 -2.508 13.581 1.00 72.74 ? 98 ILE A CA 1 ATOM 765 C C . ILE A 1 98 ? 2.920 -1.975 14.978 1.00 72.34 ? 98 ILE A C 1 ATOM 766 O O . ILE A 1 98 ? 2.451 -0.868 15.135 1.00 71.22 ? 98 ILE A O 1 ATOM 767 C CB . ILE A 1 98 ? 4.481 -1.952 13.034 1.00 73.21 ? 98 ILE A CB 1 ATOM 768 C CG1 . ILE A 1 98 ? 4.819 -2.670 11.732 1.00 72.37 ? 98 ILE A CG1 1 ATOM 769 C CG2 . ILE A 1 98 ? 5.624 -2.160 14.065 1.00 71.28 ? 98 ILE A CG2 1 ATOM 770 C CD1 . ILE A 1 98 ? 5.909 -2.049 10.965 1.00 75.30 ? 98 ILE A CD1 1 ATOM 771 N N . GLN A 1 99 ? 3.247 -2.798 15.973 1.00 73.00 ? 99 GLN A N 1 ATOM 772 C CA . GLN A 1 99 ? 3.029 -2.471 17.381 1.00 73.72 ? 99 GLN A CA 1 ATOM 773 C C . GLN A 1 99 ? 4.246 -2.842 18.224 1.00 73.74 ? 99 GLN A C 1 ATOM 774 O O . GLN A 1 99 ? 4.777 -3.965 18.123 1.00 74.10 ? 99 GLN A O 1 ATOM 775 C CB . GLN A 1 99 ? 1.832 -3.253 17.928 1.00 73.18 ? 99 GLN A CB 1 ATOM 776 C CG . GLN A 1 99 ? 0.464 -2.648 17.819 1.00 71.06 ? 99 GLN A CG 1 ATOM 777 C CD . GLN A 1 99 ? -0.610 -3.710 18.096 1.00 74.42 ? 99 GLN A CD 1 ATOM 778 O OE1 . GLN A 1 99 ? -0.833 -4.569 17.288 1.00 71.26 ? 99 GLN A OE1 1 ATOM 779 N NE2 . GLN A 1 99 ? -1.261 -3.632 19.242 1.00 78.21 ? 99 GLN A NE2 1 ATOM 780 N N . LEU A 1 100 ? 4.660 -1.903 19.048 1.00 72.81 ? 100 LEU A N 1 ATOM 781 C CA . LEU A 1 100 ? 5.730 -2.102 20.017 1.00 73.59 ? 100 LEU A CA 1 ATOM 782 C C . LEU A 1 100 ? 5.328 -1.816 21.445 1.00 73.70 ? 100 LEU A C 1 ATOM 783 O O . LEU A 1 100 ? 4.706 -0.776 21.754 1.00 73.45 ? 100 LEU A O 1 ATOM 784 C CB . LEU A 1 100 ? 6.926 -1.198 19.743 1.00 73.74 ? 100 LEU A CB 1 ATOM 785 C CG . LEU A 1 100 ? 7.852 -1.481 18.595 1.00 74.78 ? 100 LEU A CG 1 ATOM 786 C CD1 . LEU A 1 100 ? 7.342 -0.782 17.390 1.00 79.73 ? 100 LEU A CD1 1 ATOM 787 C CD2 . LEU A 1 100 ? 9.186 -0.934 18.972 1.00 76.62 ? 100 LEU A CD2 1 ATOM 788 N N . SER A 1 101 ? 5.713 -2.764 22.292 1.00 72.98 ? 101 SER A N 1 ATOM 789 C CA . SER A 1 101 ? 5.535 -2.725 23.711 1.00 73.30 ? 101 SER A CA 1 ATOM 790 C C . SER A 1 101 ? 6.938 -2.795 24.359 1.00 73.19 ? 101 SER A C 1 ATOM 791 O O . SER A 1 101 ? 7.603 -3.812 24.354 1.00 72.55 ? 101 SER A O 1 ATOM 792 C CB . SER A 1 101 ? 4.646 -3.891 24.141 1.00 73.43 ? 101 SER A CB 1 ATOM 793 O OG . SER A 1 101 ? 4.408 -3.840 25.516 1.00 74.62 ? 101 SER A OG 1 ATOM 794 N N . ALA A 1 102 ? 7.381 -1.681 24.921 1.00 74.39 ? 102 ALA A N 1 ATOM 795 C CA . ALA A 1 102 ? 8.713 -1.613 25.537 1.00 74.77 ? 102 ALA A CA 1 ATOM 796 C C . ALA A 1 102 ? 8.614 -1.022 26.944 1.00 75.26 ? 102 ALA A C 1 ATOM 797 O O . ALA A 1 102 ? 7.703 -0.256 27.217 1.00 75.14 ? 102 ALA A O 1 ATOM 798 C CB . ALA A 1 102 ? 9.646 -0.822 24.654 1.00 74.55 ? 102 ALA A CB 1 ATOM 799 N N . GLY A 1 103 ? 9.531 -1.391 27.835 1.00 76.43 ? 103 GLY A N 1 ATOM 800 C CA . GLY A 1 103 ? 9.500 -0.912 29.225 1.00 77.59 ? 103 GLY A CA 1 ATOM 801 C C . GLY A 1 103 ? 10.172 -1.844 30.226 1.00 78.63 ? 103 GLY A C 1 ATOM 802 O O . GLY A 1 103 ? 11.036 -2.619 29.871 1.00 79.60 ? 103 GLY A O 1 ATOM 803 N N . CYS A 1 104 ? 9.772 -1.757 31.482 1.00 79.68 ? 104 CYS A N 1 ATOM 804 C CA . CYS A 1 104 ? 10.337 -2.574 32.552 1.00 80.91 ? 104 CYS A CA 1 ATOM 805 C C . CYS A 1 104 ? 9.294 -2.990 33.586 1.00 81.03 ? 104 CYS A C 1 ATOM 806 O O . CYS A 1 104 ? 8.369 -2.240 33.872 1.00 80.80 ? 104 CYS A O 1 ATOM 807 C CB . CYS A 1 104 ? 11.581 -1.918 33.211 1.00 80.45 ? 104 CYS A CB 1 ATOM 808 S SG . CYS A 1 104 ? 11.681 -0.100 33.294 1.00 83.72 ? 104 CYS A SG 1 ATOM 809 N N . GLU A 1 105 ? 9.462 -4.197 34.120 1.00 81.84 ? 105 GLU A N 1 ATOM 810 C CA . GLU A 1 105 ? 8.610 -4.765 35.170 1.00 83.42 ? 105 GLU A CA 1 ATOM 811 C C . GLU A 1 105 ? 9.380 -4.552 36.473 1.00 84.74 ? 105 GLU A C 1 ATOM 812 O O . GLU A 1 105 ? 10.335 -5.272 36.754 1.00 84.69 ? 105 GLU A O 1 ATOM 813 C CB . GLU A 1 105 ? 8.268 -6.039 35.175 0.00 40.00 ? 105 GLU A CB 1 ATOM 814 C CG . GLU A 1 105 ? 7.493 -6.382 33.915 0.00 40.00 ? 105 GLU A CG 1 ATOM 815 C CD . GLU A 1 105 ? 7.435 -7.886 33.650 0.00 40.00 ? 105 GLU A CD 1 ATOM 816 O OE1 . GLU A 1 105 ? 7.007 -8.666 34.555 0.00 40.00 ? 105 GLU A OE1 1 ATOM 817 O OE2 . GLU A 1 105 ? 7.818 -8.284 32.520 0.00 40.00 ? 105 GLU A OE2 1 ATOM 818 N N . MET A 1 106 ? 8.951 -3.559 37.254 1.00 85.97 ? 106 MET A N 1 ATOM 819 C CA . MET A 1 106 ? 9.653 -3.096 38.462 1.00 86.99 ? 106 MET A CA 1 ATOM 820 C C . MET A 1 106 ? 9.338 -3.873 39.739 1.00 87.36 ? 106 MET A C 1 ATOM 821 O O . MET A 1 106 ? 8.237 -3.771 40.282 1.00 87.44 ? 106 MET A O 1 ATOM 822 C CB . MET A 1 106 ? 9.329 -1.619 38.686 1.00 87.43 ? 106 MET A CB 1 ATOM 823 C CG . MET A 1 106 ? 9.731 -0.710 37.537 1.00 89.22 ? 106 MET A CG 1 ATOM 824 S SD . MET A 1 106 ? 11.520 -0.472 37.415 1.00 94.37 ? 106 MET A SD 1 ATOM 825 C CE . MET A 1 106 ? 11.883 0.459 38.912 1.00 91.79 ? 106 MET A CE 1 ATOM 826 N N . TYR A 1 107 ? 10.308 -4.640 40.221 1.00 87.85 ? 107 TYR A N 1 ATOM 827 C CA . TYR A 1 107 ? 10.122 -5.435 41.428 1.00 88.51 ? 107 TYR A CA 1 ATOM 828 C C . TYR A 1 107 ? 10.775 -4.749 42.641 1.00 88.81 ? 107 TYR A C 1 ATOM 829 O O . TYR A 1 107 ? 11.651 -3.899 42.454 1.00 89.15 ? 107 TYR A O 1 ATOM 830 C CB . TYR A 1 107 ? 10.707 -6.839 41.231 1.00 88.68 ? 107 TYR A CB 1 ATOM 831 C CG . TYR A 1 107 ? 10.343 -7.510 39.921 1.00 88.92 ? 107 TYR A CG 1 ATOM 832 C CD1 . TYR A 1 107 ? 9.024 -7.839 39.621 1.00 89.43 ? 107 TYR A CD1 1 ATOM 833 C CD2 . TYR A 1 107 ? 11.327 -7.823 38.986 1.00 88.74 ? 107 TYR A CD2 1 ATOM 834 C CE1 . TYR A 1 107 ? 8.697 -8.455 38.418 1.00 89.62 ? 107 TYR A CE1 1 ATOM 835 C CE2 . TYR A 1 107 ? 11.007 -8.439 37.785 1.00 89.05 ? 107 TYR A CE2 1 ATOM 836 C CZ . TYR A 1 107 ? 9.693 -8.751 37.508 1.00 88.98 ? 107 TYR A CZ 1 ATOM 837 O OH . TYR A 1 107 ? 9.375 -9.361 36.318 1.00 89.41 ? 107 TYR A OH 1 ATOM 838 N N . PRO A 1 108 ? 10.351 -5.096 43.867 1.00 88.99 ? 108 PRO A N 1 ATOM 839 C CA . PRO A 1 108 ? 11.014 -4.618 45.095 1.00 88.87 ? 108 PRO A CA 1 ATOM 840 C C . PRO A 1 108 ? 12.534 -4.787 45.067 1.00 88.72 ? 108 PRO A C 1 ATOM 841 O O . PRO A 1 108 ? 13.245 -4.025 45.721 1.00 88.42 ? 108 PRO A O 1 ATOM 842 C CB . PRO A 1 108 ? 10.430 -5.527 46.183 1.00 88.99 ? 108 PRO A CB 1 ATOM 843 C CG . PRO A 1 108 ? 9.084 -5.923 45.680 1.00 89.20 ? 108 PRO A CG 1 ATOM 844 C CD . PRO A 1 108 ? 9.189 -5.958 44.173 1.00 88.96 ? 108 PRO A CD 1 ATOM 845 N N . SER A 1 112 ? 13.965 -5.308 38.737 1.00 75.58 ? 112 SER A N 1 ATOM 846 C CA . SER A 1 112 ? 13.363 -5.101 37.414 1.00 75.74 ? 112 SER A CA 1 ATOM 847 C C . SER A 1 112 ? 13.889 -5.992 36.281 1.00 75.53 ? 112 SER A C 1 ATOM 848 O O . SER A 1 112 ? 15.038 -6.428 36.291 1.00 75.49 ? 112 SER A O 1 ATOM 849 C CB . SER A 1 112 ? 13.400 -3.621 37.000 1.00 75.92 ? 112 SER A CB 1 ATOM 850 O OG . SER A 1 112 ? 14.708 -3.096 37.044 1.00 75.37 ? 112 SER A OG 1 ATOM 851 N N . GLU A 1 113 ? 13.008 -6.245 35.313 1.00 75.27 ? 113 GLU A N 1 ATOM 852 C CA . GLU A 1 113 ? 13.296 -7.017 34.116 1.00 74.63 ? 113 GLU A CA 1 ATOM 853 C C . GLU A 1 113 ? 12.719 -6.173 32.986 1.00 74.76 ? 113 GLU A C 1 ATOM 854 O O . GLU A 1 113 ? 11.615 -5.653 33.100 1.00 75.36 ? 113 GLU A O 1 ATOM 855 C CB . GLU A 1 113 ? 12.671 -8.509 34.285 0.00 40.00 ? 113 GLU A CB 1 ATOM 856 C CG . GLU A 1 113 ? 13.583 -9.510 35.006 0.00 40.00 ? 113 GLU A CG 1 ATOM 857 C CD . GLU A 1 113 ? 12.876 -10.435 36.016 0.00 40.00 ? 113 GLU A CD 1 ATOM 858 O OE1 . GLU A 1 113 ? 11.614 -10.464 36.097 0.00 40.00 ? 113 GLU A OE1 1 ATOM 859 O OE2 . GLU A 1 113 ? 13.601 -11.148 36.756 0.00 40.00 ? 113 GLU A OE2 1 ATOM 860 N N . SER A 1 114 ? 13.451 -6.025 31.894 1.00 74.03 ? 114 SER A N 1 ATOM 861 C CA . SER A 1 114 ? 12.959 -5.222 30.791 1.00 73.58 ? 114 SER A CA 1 ATOM 862 C C . SER A 1 114 ? 12.465 -6.032 29.620 1.00 73.15 ? 114 SER A C 1 ATOM 863 O O . SER A 1 114 ? 12.721 -7.237 29.520 1.00 73.14 ? 114 SER A O 1 ATOM 864 C CB . SER A 1 114 ? 14.010 -4.221 30.335 1.00 73.55 ? 114 SER A CB 1 ATOM 865 O OG . SER A 1 114 ? 13.977 -3.122 31.200 1.00 74.66 ? 114 SER A OG 1 ATOM 866 N N . PHE A 1 115 ? 11.748 -5.363 28.726 1.00 72.40 ? 115 PHE A N 1 ATOM 867 C CA . PHE A 1 115 ? 11.133 -6.045 27.593 1.00 72.66 ? 115 PHE A CA 1 ATOM 868 C C . PHE A 1 115 ? 11.011 -5.081 26.432 1.00 72.65 ? 115 PHE A C 1 ATOM 869 O O . PHE A 1 115 ? 10.954 -3.874 26.633 1.00 72.30 ? 115 PHE A O 1 ATOM 870 C CB . PHE A 1 115 ? 9.753 -6.648 27.982 1.00 72.27 ? 115 PHE A CB 1 ATOM 871 C CG . PHE A 1 115 ? 8.765 -5.623 28.468 1.00 73.38 ? 115 PHE A CG 1 ATOM 872 C CD1 . PHE A 1 115 ? 8.757 -5.217 29.817 1.00 73.31 ? 115 PHE A CD1 1 ATOM 873 C CD2 . PHE A 1 115 ? 7.836 -5.048 27.593 1.00 74.41 ? 115 PHE A CD2 1 ATOM 874 C CE1 . PHE A 1 115 ? 7.853 -4.264 30.280 1.00 70.37 ? 115 PHE A CE1 1 ATOM 875 C CE2 . PHE A 1 115 ? 6.919 -4.070 28.076 1.00 71.88 ? 115 PHE A CE2 1 ATOM 876 C CZ . PHE A 1 115 ? 6.947 -3.698 29.424 1.00 70.04 ? 115 PHE A CZ 1 ATOM 877 N N . LEU A 1 116 ? 10.980 -5.633 25.217 1.00 73.21 ? 116 LEU A N 1 ATOM 878 C CA . LEU A 1 116 ? 10.762 -4.867 23.995 1.00 73.23 ? 116 LEU A CA 1 ATOM 879 C C . LEU A 1 116 ? 10.198 -5.862 22.985 1.00 73.42 ? 116 LEU A C 1 ATOM 880 O O . LEU A 1 116 ? 10.947 -6.641 22.383 1.00 73.69 ? 116 LEU A O 1 ATOM 881 C CB . LEU A 1 116 ? 12.059 -4.174 23.498 1.00 73.01 ? 116 LEU A CB 1 ATOM 882 C CG . LEU A 1 116 ? 11.885 -3.032 22.495 1.00 73.30 ? 116 LEU A CG 1 ATOM 883 C CD1 . LEU A 1 116 ? 13.160 -2.242 22.264 1.00 71.65 ? 116 LEU A CD1 1 ATOM 884 C CD2 . LEU A 1 116 ? 11.367 -3.571 21.183 1.00 72.01 ? 116 LEU A CD2 1 ATOM 885 N N . HIS A 1 117 ? 8.873 -5.846 22.818 1.00 73.42 ? 117 HIS A N 1 ATOM 886 C CA . HIS A 1 117 ? 8.199 -6.795 21.916 1.00 73.69 ? 117 HIS A CA 1 ATOM 887 C C . HIS A 1 117 ? 7.604 -6.063 20.744 1.00 73.02 ? 117 HIS A C 1 ATOM 888 O O . HIS A 1 117 ? 7.190 -4.894 20.866 1.00 73.22 ? 117 HIS A O 1 ATOM 889 C CB . HIS A 1 117 ? 7.100 -7.574 22.620 1.00 73.76 ? 117 HIS A CB 1 ATOM 890 C CG . HIS A 1 117 ? 7.588 -8.410 23.755 1.00 75.76 ? 117 HIS A CG 1 ATOM 891 N ND1 . HIS A 1 117 ? 8.900 -8.799 23.878 1.00 77.78 ? 117 HIS A ND1 1 ATOM 892 C CD2 . HIS A 1 117 ? 6.936 -8.947 24.811 1.00 78.29 ? 117 HIS A CD2 1 ATOM 893 C CE1 . HIS A 1 117 ? 9.041 -9.536 24.965 1.00 78.43 ? 117 HIS A CE1 1 ATOM 894 N NE2 . HIS A 1 117 ? 7.863 -9.642 25.549 1.00 78.18 ? 117 HIS A NE2 1 ATOM 895 N N . VAL A 1 118 ? 7.574 -6.765 19.608 1.00 72.18 ? 118 VAL A N 1 ATOM 896 C CA . VAL A 1 118 ? 7.092 -6.215 18.348 1.00 70.17 ? 118 VAL A CA 1 ATOM 897 C C . VAL A 1 118 ? 6.073 -7.122 17.703 1.00 70.84 ? 118 VAL A C 1 ATOM 898 O O . VAL A 1 118 ? 6.304 -8.333 17.518 1.00 68.20 ? 118 VAL A O 1 ATOM 899 C CB . VAL A 1 118 ? 8.254 -5.940 17.337 1.00 70.23 ? 118 VAL A CB 1 ATOM 900 C CG1 . VAL A 1 118 ? 7.725 -5.214 16.080 1.00 68.81 ? 118 VAL A CG1 1 ATOM 901 C CG2 . VAL A 1 118 ? 9.377 -5.117 17.979 1.00 69.14 ? 118 VAL A CG2 1 ATOM 902 N N . ALA A 1 119 ? 4.939 -6.515 17.357 1.00 70.87 ? 119 ALA A N 1 ATOM 903 C CA . ALA A 1 119 ? 3.909 -7.207 16.597 1.00 70.93 ? 119 ALA A CA 1 ATOM 904 C C . ALA A 1 119 ? 3.779 -6.608 15.218 1.00 71.11 ? 119 ALA A C 1 ATOM 905 O O . ALA A 1 119 ? 3.923 -5.394 15.023 1.00 70.59 ? 119 ALA A O 1 ATOM 906 C CB . ALA A 1 119 ? 2.563 -7.162 17.307 1.00 71.81 ? 119 ALA A CB 1 ATOM 907 N N . PHE A 1 120 ? 3.503 -7.500 14.266 1.00 71.61 ? 120 PHE A N 1 ATOM 908 C CA . PHE A 1 120 ? 3.271 -7.179 12.871 1.00 71.61 ? 120 PHE A CA 1 ATOM 909 C C . PHE A 1 120 ? 1.953 -7.840 12.416 1.00 70.55 ? 120 PHE A C 1 ATOM 910 O O . PHE A 1 120 ? 1.794 -9.064 12.510 1.00 70.75 ? 120 PHE A O 1 ATOM 911 C CB . PHE A 1 120 ? 4.488 -7.656 12.046 1.00 73.45 ? 120 PHE A CB 1 ATOM 912 C CG . PHE A 1 120 ? 4.315 -7.540 10.551 1.00 74.32 ? 120 PHE A CG 1 ATOM 913 C CD1 . PHE A 1 120 ? 4.503 -6.327 9.903 1.00 76.91 ? 120 PHE A CD1 1 ATOM 914 C CD2 . PHE A 1 120 ? 3.979 -8.632 9.808 1.00 74.74 ? 120 PHE A CD2 1 ATOM 915 C CE1 . PHE A 1 120 ? 4.348 -6.221 8.539 1.00 75.20 ? 120 PHE A CE1 1 ATOM 916 C CE2 . PHE A 1 120 ? 3.826 -8.528 8.436 1.00 75.74 ? 120 PHE A CE2 1 ATOM 917 C CZ . PHE A 1 120 ? 4.009 -7.321 7.810 1.00 75.13 ? 120 PHE A CZ 1 ATOM 918 N N . GLN A 1 121 ? 1.022 -7.026 11.923 1.00 68.92 ? 121 GLN A N 1 ATOM 919 C CA . GLN A 1 121 ? -0.313 -7.487 11.525 1.00 68.81 ? 121 GLN A CA 1 ATOM 920 C C . GLN A 1 121 ? -1.050 -8.123 12.726 1.00 69.53 ? 121 GLN A C 1 ATOM 921 O O . GLN A 1 121 ? -1.802 -9.114 12.578 1.00 67.50 ? 121 GLN A O 1 ATOM 922 C CB . GLN A 1 121 ? -0.264 -8.469 10.334 1.00 67.43 ? 121 GLN A CB 1 ATOM 923 C CG . GLN A 1 121 ? 0.262 -7.888 9.031 1.00 65.62 ? 121 GLN A CG 1 ATOM 924 C CD . GLN A 1 121 ? -0.431 -6.571 8.652 1.00 68.71 ? 121 GLN A CD 1 ATOM 925 O OE1 . GLN A 1 121 ? -0.416 -5.599 9.423 1.00 65.47 ? 121 GLN A OE1 1 ATOM 926 N NE2 . GLN A 1 121 ? -1.025 -6.536 7.470 1.00 67.56 ? 121 GLN A NE2 1 ATOM 927 N N . GLY A 1 122 ? -0.810 -7.542 13.902 1.00 68.75 ? 122 GLY A N 1 ATOM 928 C CA . GLY A 1 122 ? -1.435 -7.965 15.141 1.00 69.92 ? 122 GLY A CA 1 ATOM 929 C C . GLY A 1 122 ? -0.880 -9.183 15.860 1.00 70.54 ? 122 GLY A C 1 ATOM 930 O O . GLY A 1 122 ? -1.484 -9.630 16.827 1.00 70.34 ? 122 GLY A O 1 ATOM 931 N N . LYS A 1 123 ? 0.256 -9.701 15.394 1.00 71.48 ? 123 LYS A N 1 ATOM 932 C CA . LYS A 1 123 ? 0.881 -10.930 15.930 1.00 72.65 ? 123 LYS A CA 1 ATOM 933 C C . LYS A 1 123 ? 2.350 -10.696 16.354 1.00 72.75 ? 123 LYS A C 1 ATOM 934 O O . LYS A 1 123 ? 3.095 -9.970 15.681 1.00 73.67 ? 123 LYS A O 1 ATOM 935 C CB . LYS A 1 123 ? 0.804 -12.019 14.879 1.00 71.61 ? 123 LYS A CB 1 ATOM 936 C CG . LYS A 1 123 ? 0.914 -13.394 15.437 1.00 74.50 ? 123 LYS A CG 1 ATOM 937 C CD . LYS A 1 123 ? -0.011 -14.337 14.675 1.00 74.52 ? 123 LYS A CD 1 ATOM 938 C CE . LYS A 1 123 ? 0.557 -15.741 14.653 1.00 74.77 ? 123 LYS A CE 1 ATOM 939 N NZ . LYS A 1 123 ? -0.237 -16.614 13.738 1.00 78.33 ? 123 LYS A NZ 1 ATOM 940 N N . TYR A 1 124 ? 2.747 -11.309 17.465 1.00 71.89 ? 124 TYR A N 1 ATOM 941 C CA . TYR A 1 124 ? 4.057 -11.080 18.071 1.00 70.68 ? 124 TYR A CA 1 ATOM 942 C C . TYR A 1 124 ? 5.079 -11.829 17.253 1.00 70.81 ? 124 TYR A C 1 ATOM 943 O O . TYR A 1 124 ? 5.042 -13.087 17.157 1.00 70.16 ? 124 TYR A O 1 ATOM 944 C CB . TYR A 1 124 ? 4.011 -11.552 19.519 1.00 71.21 ? 124 TYR A CB 1 ATOM 945 C CG . TYR A 1 124 ? 5.309 -11.629 20.284 1.00 71.42 ? 124 TYR A CG 1 ATOM 946 C CD1 . TYR A 1 124 ? 6.217 -10.564 20.289 1.00 70.05 ? 124 TYR A CD1 1 ATOM 947 C CD2 . TYR A 1 124 ? 5.621 -12.767 21.030 1.00 69.93 ? 124 TYR A CD2 1 ATOM 948 C CE1 . TYR A 1 124 ? 7.402 -10.637 20.999 1.00 70.17 ? 124 TYR A CE1 1 ATOM 949 C CE2 . TYR A 1 124 ? 6.816 -12.845 21.749 1.00 71.04 ? 124 TYR A CE2 1 ATOM 950 C CZ . TYR A 1 124 ? 7.694 -11.779 21.721 1.00 71.38 ? 124 TYR A CZ 1 ATOM 951 O OH . TYR A 1 124 ? 8.867 -11.829 22.415 1.00 73.60 ? 124 TYR A OH 1 ATOM 952 N N . VAL A 1 125 ? 5.994 -11.069 16.643 1.00 69.95 ? 125 VAL A N 1 ATOM 953 C CA . VAL A 1 125 ? 6.983 -11.673 15.729 1.00 69.60 ? 125 VAL A CA 1 ATOM 954 C C . VAL A 1 125 ? 8.433 -11.462 16.135 1.00 70.07 ? 125 VAL A C 1 ATOM 955 O O . VAL A 1 125 ? 9.279 -12.318 15.902 1.00 68.88 ? 125 VAL A O 1 ATOM 956 C CB . VAL A 1 125 ? 6.781 -11.217 14.267 1.00 69.55 ? 125 VAL A CB 1 ATOM 957 C CG1 . VAL A 1 125 ? 5.570 -11.888 13.627 1.00 68.19 ? 125 VAL A CG1 1 ATOM 958 C CG2 . VAL A 1 125 ? 6.674 -9.756 14.170 1.00 65.18 ? 125 VAL A CG2 1 ATOM 959 N N . VAL A 1 126 ? 8.699 -10.318 16.748 1.00 70.45 ? 126 VAL A N 1 ATOM 960 C CA . VAL A 1 126 ? 10.067 -9.886 17.068 1.00 71.77 ? 126 VAL A CA 1 ATOM 961 C C . VAL A 1 126 ? 10.185 -9.411 18.510 1.00 72.05 ? 126 VAL A C 1 ATOM 962 O O . VAL A 1 126 ? 9.243 -8.800 19.050 1.00 72.83 ? 126 VAL A O 1 ATOM 963 C CB . VAL A 1 126 ? 10.511 -8.703 16.118 1.00 71.84 ? 126 VAL A CB 1 ATOM 964 C CG1 . VAL A 1 126 ? 11.904 -8.187 16.441 1.00 72.11 ? 126 VAL A CG1 1 ATOM 965 C CG2 . VAL A 1 126 ? 10.450 -9.110 14.652 1.00 73.30 ? 126 VAL A CG2 1 ATOM 966 N N . ARG A 1 127 ? 11.343 -9.692 19.112 1.00 72.08 ? 127 ARG A N 1 ATOM 967 C CA . ARG A 1 127 ? 11.751 -9.189 20.448 1.00 71.80 ? 127 ARG A CA 1 ATOM 968 C C . ARG A 1 127 ? 13.226 -8.673 20.357 1.00 71.55 ? 127 ARG A C 1 ATOM 969 O O . ARG A 1 127 ? 13.971 -9.124 19.492 1.00 72.33 ? 127 ARG A O 1 ATOM 970 C CB . ARG A 1 127 ? 11.718 -10.348 21.472 1.00 71.79 ? 127 ARG A CB 1 ATOM 971 C CG . ARG A 1 127 ? 13.037 -11.107 21.492 1.00 72.49 ? 127 ARG A CG 1 ATOM 972 C CD . ARG A 1 127 ? 13.027 -12.603 21.877 1.00 72.13 ? 127 ARG A CD 1 ATOM 973 N NE . ARG A 1 127 ? 12.743 -12.869 23.274 1.00 71.50 ? 127 ARG A NE 1 ATOM 974 C CZ . ARG A 1 127 ? 13.132 -13.973 23.934 1.00 73.62 ? 127 ARG A CZ 1 ATOM 975 N NH1 . ARG A 1 127 ? 13.848 -14.934 23.340 1.00 69.90 ? 127 ARG A NH1 1 ATOM 976 N NH2 . ARG A 1 127 ? 12.804 -14.105 25.212 1.00 73.16 ? 127 ARG A NH2 1 ATOM 977 N N . PHE A 1 128 ? 13.639 -7.741 21.221 1.00 70.78 ? 128 PHE A N 1 ATOM 978 C CA . PHE A 1 128 ? 15.048 -7.477 21.427 1.00 70.37 ? 128 PHE A CA 1 ATOM 979 C C . PHE A 1 128 ? 15.361 -8.348 22.630 1.00 71.60 ? 128 PHE A C 1 ATOM 980 O O . PHE A 1 128 ? 14.590 -8.391 23.579 1.00 71.92 ? 128 PHE A O 1 ATOM 981 C CB . PHE A 1 128 ? 15.316 -6.023 21.773 1.00 70.46 ? 128 PHE A CB 1 ATOM 982 C CG . PHE A 1 128 ? 16.768 -5.687 21.839 1.00 68.25 ? 128 PHE A CG 1 ATOM 983 C CD1 . PHE A 1 128 ? 17.460 -5.372 20.699 1.00 67.05 ? 128 PHE A CD1 1 ATOM 984 C CD2 . PHE A 1 128 ? 17.443 -5.690 23.046 1.00 68.09 ? 128 PHE A CD2 1 ATOM 985 C CE1 . PHE A 1 128 ? 18.807 -5.057 20.762 1.00 69.96 ? 128 PHE A CE1 1 ATOM 986 C CE2 . PHE A 1 128 ? 18.785 -5.383 23.110 1.00 67.51 ? 128 PHE A CE2 1 ATOM 987 C CZ . PHE A 1 128 ? 19.470 -5.062 21.977 1.00 67.12 ? 128 PHE A CZ 1 ATOM 988 N N . TRP A 1 129 ? 16.477 -9.054 22.616 1.00 71.73 ? 129 TRP A N 1 ATOM 989 C CA . TRP A 1 129 ? 16.757 -9.973 23.707 1.00 71.39 ? 129 TRP A CA 1 ATOM 990 C C . TRP A 1 129 ? 18.246 -9.964 23.964 1.00 71.46 ? 129 TRP A C 1 ATOM 991 O O . TRP A 1 129 ? 19.022 -10.463 23.143 1.00 71.60 ? 129 TRP A O 1 ATOM 992 C CB . TRP A 1 129 ? 16.291 -11.380 23.312 1.00 72.12 ? 129 TRP A CB 1 ATOM 993 C CG . TRP A 1 129 ? 16.500 -12.474 24.347 1.00 72.50 ? 129 TRP A CG 1 ATOM 994 C CD1 . TRP A 1 129 ? 17.294 -13.594 24.223 1.00 72.18 ? 129 TRP A CD1 1 ATOM 995 C CD2 . TRP A 1 129 ? 15.912 -12.551 25.647 1.00 72.51 ? 129 TRP A CD2 1 ATOM 996 N NE1 . TRP A 1 129 ? 17.227 -14.347 25.366 1.00 71.25 ? 129 TRP A NE1 1 ATOM 997 C CE2 . TRP A 1 129 ? 16.387 -13.735 26.256 1.00 71.84 ? 129 TRP A CE2 1 ATOM 998 C CE3 . TRP A 1 129 ? 15.024 -11.738 26.368 1.00 73.78 ? 129 TRP A CE3 1 ATOM 999 C CZ2 . TRP A 1 129 ? 16.007 -14.124 27.542 1.00 72.80 ? 129 TRP A CZ2 1 ATOM 1000 C CZ3 . TRP A 1 129 ? 14.646 -12.131 27.656 1.00 73.50 ? 129 TRP A CZ3 1 ATOM 1001 C CH2 . TRP A 1 129 ? 15.137 -13.313 28.224 1.00 73.15 ? 129 TRP A CH2 1 ATOM 1002 N N . GLY A 1 130 ? 18.649 -9.393 25.097 1.00 70.84 ? 130 GLY A N 1 ATOM 1003 C CA . GLY A 1 130 ? 20.065 -9.334 25.434 1.00 70.28 ? 130 GLY A CA 1 ATOM 1004 C C . GLY A 1 130 ? 20.845 -8.256 24.696 1.00 69.95 ? 130 GLY A C 1 ATOM 1005 O O . GLY A 1 130 ? 20.973 -7.123 25.179 1.00 69.85 ? 130 GLY A O 1 ATOM 1006 N N . THR A 1 131 ? 21.376 -8.604 23.525 1.00 69.46 ? 131 THR A N 1 ATOM 1007 C CA . THR A 1 131 ? 22.221 -7.678 22.778 1.00 69.16 ? 131 THR A CA 1 ATOM 1008 C C . THR A 1 131 ? 21.841 -7.539 21.324 1.00 68.68 ? 131 THR A C 1 ATOM 1009 O O . THR A 1 131 ? 22.545 -6.874 20.574 1.00 67.79 ? 131 THR A O 1 ATOM 1010 C CB . THR A 1 131 ? 23.723 -8.071 22.863 1.00 69.04 ? 131 THR A CB 1 ATOM 1011 O OG1 . THR A 1 131 ? 23.921 -9.318 22.199 1.00 69.85 ? 131 THR A OG1 1 ATOM 1012 C CG2 . THR A 1 131 ? 24.179 -8.325 24.316 1.00 68.97 ? 131 THR A CG2 1 ATOM 1013 N N . SER A 1 132 ? 20.731 -8.167 20.937 1.00 69.22 ? 132 SER A N 1 ATOM 1014 C CA . SER A 1 132 ? 20.271 -8.197 19.554 1.00 69.33 ? 132 SER A CA 1 ATOM 1015 C C . SER A 1 132 ? 18.773 -8.469 19.358 1.00 69.65 ? 132 SER A C 1 ATOM 1016 O O . SER A 1 132 ? 18.077 -8.954 20.257 1.00 70.52 ? 132 SER A O 1 ATOM 1017 C CB . SER A 1 132 ? 21.094 -9.238 18.770 1.00 70.33 ? 132 SER A CB 1 ATOM 1018 O OG . SER A 1 132 ? 20.787 -10.571 19.180 1.00 69.52 ? 132 SER A OG 1 ATOM 1019 N N . TRP A 1 133 ? 18.296 -8.145 18.164 1.00 69.28 ? 133 TRP A N 1 ATOM 1020 C CA . TRP A 1 133 ? 16.949 -8.475 17.724 1.00 69.66 ? 133 TRP A CA 1 ATOM 1021 C C . TRP A 1 133 ? 16.892 -9.929 17.390 1.00 69.19 ? 133 TRP A C 1 ATOM 1022 O O . TRP A 1 133 ? 17.817 -10.470 16.817 1.00 69.10 ? 133 TRP A O 1 ATOM 1023 C CB . TRP A 1 133 ? 16.622 -7.682 16.450 1.00 69.35 ? 133 TRP A CB 1 ATOM 1024 C CG . TRP A 1 133 ? 16.691 -6.241 16.739 1.00 71.04 ? 133 TRP A CG 1 ATOM 1025 C CD1 . TRP A 1 133 ? 17.729 -5.395 16.476 1.00 70.03 ? 133 TRP A CD1 1 ATOM 1026 C CD2 . TRP A 1 133 ? 15.678 -5.462 17.383 1.00 71.30 ? 133 TRP A CD2 1 ATOM 1027 N NE1 . TRP A 1 133 ? 17.415 -4.130 16.907 1.00 74.06 ? 133 TRP A NE1 1 ATOM 1028 C CE2 . TRP A 1 133 ? 16.165 -4.138 17.471 1.00 71.06 ? 133 TRP A CE2 1 ATOM 1029 C CE3 . TRP A 1 133 ? 14.397 -5.748 17.892 1.00 72.34 ? 133 TRP A CE3 1 ATOM 1030 C CZ2 . TRP A 1 133 ? 15.432 -3.103 18.036 1.00 69.74 ? 133 TRP A CZ2 1 ATOM 1031 C CZ3 . TRP A 1 133 ? 13.659 -4.710 18.467 1.00 71.52 ? 133 TRP A CZ3 1 ATOM 1032 C CH2 . TRP A 1 133 ? 14.191 -3.403 18.532 1.00 70.92 ? 133 TRP A CH2 1 ATOM 1033 N N . GLN A 1 134 ? 15.801 -10.578 17.745 1.00 70.64 ? 134 GLN A N 1 ATOM 1034 C CA . GLN A 1 134 ? 15.616 -11.961 17.322 1.00 71.08 ? 134 GLN A CA 1 ATOM 1035 C C . GLN A 1 134 ? 14.183 -12.215 16.930 1.00 71.02 ? 134 GLN A C 1 ATOM 1036 O O . GLN A 1 134 ? 13.270 -11.613 17.484 1.00 71.51 ? 134 GLN A O 1 ATOM 1037 C CB . GLN A 1 134 ? 16.142 -12.969 18.341 1.00 71.24 ? 134 GLN A CB 1 ATOM 1038 C CG . GLN A 1 134 ? 15.473 -13.063 19.682 1.00 71.57 ? 134 GLN A CG 1 ATOM 1039 C CD . GLN A 1 134 ? 15.884 -14.355 20.445 1.00 72.57 ? 134 GLN A CD 1 ATOM 1040 O OE1 . GLN A 1 134 ? 15.063 -14.950 21.170 1.00 74.28 ? 134 GLN A OE1 1 ATOM 1041 N NE2 . GLN A 1 134 ? 17.138 -14.782 20.278 1.00 69.98 ? 134 GLN A NE2 1 ATOM 1042 N N . THR A 1 135 ? 13.974 -13.095 15.953 1.00 71.08 ? 135 THR A N 1 ATOM 1043 C CA . THR A 1 135 ? 12.587 -13.464 15.653 1.00 70.22 ? 135 THR A CA 1 ATOM 1044 C C . THR A 1 135 ? 12.090 -14.509 16.657 1.00 70.27 ? 135 THR A C 1 ATOM 1045 O O . THR A 1 135 ? 12.855 -15.273 17.262 1.00 69.46 ? 135 THR A O 1 ATOM 1046 C CB . THR A 1 135 ? 12.355 -13.955 14.204 1.00 70.45 ? 135 THR A CB 1 ATOM 1047 O OG1 . THR A 1 135 ? 13.178 -15.114 13.931 1.00 69.07 ? 135 THR A OG1 1 ATOM 1048 C CG2 . THR A 1 135 ? 12.722 -12.888 13.177 1.00 69.03 ? 135 THR A CG2 1 ATOM 1049 N N . VAL A 1 136 ? 10.781 -14.510 16.805 1.00 69.49 ? 136 VAL A N 1 ATOM 1050 C CA . VAL A 1 136 ? 10.088 -15.362 17.727 1.00 69.73 ? 136 VAL A CA 1 ATOM 1051 C C . VAL A 1 136 ? 9.699 -16.666 16.974 1.00 69.61 ? 136 VAL A C 1 ATOM 1052 O O . VAL A 1 136 ? 9.528 -16.654 15.754 1.00 69.25 ? 136 VAL A O 1 ATOM 1053 C CB . VAL A 1 136 ? 8.970 -14.482 18.349 1.00 69.55 ? 136 VAL A CB 1 ATOM 1054 C CG1 . VAL A 1 136 ? 7.830 -15.242 18.897 1.00 69.92 ? 136 VAL A CG1 1 ATOM 1055 C CG2 . VAL A 1 136 ? 9.614 -13.511 19.374 1.00 67.63 ? 136 VAL A CG2 1 ATOM 1056 N N . PRO A 1 137 ? 9.582 -17.790 17.669 1.00 69.72 ? 137 PRO A N 1 ATOM 1057 C CA . PRO A 1 137 ? 9.261 -19.047 16.982 1.00 69.64 ? 137 PRO A CA 1 ATOM 1058 C C . PRO A 1 137 ? 7.927 -18.969 16.204 1.00 69.80 ? 137 PRO A C 1 ATOM 1059 O O . PRO A 1 137 ? 6.905 -18.459 16.718 1.00 68.85 ? 137 PRO A O 1 ATOM 1060 C CB . PRO A 1 137 ? 9.204 -20.064 18.125 1.00 70.15 ? 137 PRO A CB 1 ATOM 1061 C CG . PRO A 1 137 ? 10.022 -19.443 19.204 1.00 69.43 ? 137 PRO A CG 1 ATOM 1062 C CD . PRO A 1 137 ? 9.741 -17.977 19.121 1.00 70.20 ? 137 PRO A CD 1 ATOM 1063 N N . GLY A 1 138 ? 7.955 -19.465 14.968 1.00 69.91 ? 138 GLY A N 1 ATOM 1064 C CA . GLY A 1 138 ? 6.784 -19.434 14.108 1.00 70.52 ? 138 GLY A CA 1 ATOM 1065 C C . GLY A 1 138 ? 6.464 -18.068 13.503 1.00 71.57 ? 138 GLY A C 1 ATOM 1066 O O . GLY A 1 138 ? 5.398 -17.909 12.913 1.00 72.30 ? 138 GLY A O 1 ATOM 1067 N N . ALA A 1 139 ? 7.356 -17.085 13.647 1.00 70.32 ? 139 ALA A N 1 ATOM 1068 C CA . ALA A 1 139 ? 7.225 -15.829 12.887 1.00 71.84 ? 139 ALA A CA 1 ATOM 1069 C C . ALA A 1 139 ? 7.483 -16.092 11.385 1.00 72.10 ? 139 ALA A C 1 ATOM 1070 O O . ALA A 1 139 ? 8.169 -17.063 11.047 1.00 72.79 ? 139 ALA A O 1 ATOM 1071 C CB . ALA A 1 139 ? 8.186 -14.721 13.426 1.00 69.61 ? 139 ALA A CB 1 ATOM 1072 N N . PRO A 1 140 ? 6.956 -15.236 10.497 1.00 72.99 ? 140 PRO A N 1 ATOM 1073 C CA . PRO A 1 140 ? 7.132 -15.414 9.054 1.00 73.28 ? 140 PRO A CA 1 ATOM 1074 C C . PRO A 1 140 ? 8.621 -15.403 8.719 1.00 73.09 ? 140 PRO A C 1 ATOM 1075 O O . PRO A 1 140 ? 9.366 -14.543 9.195 1.00 74.18 ? 140 PRO A O 1 ATOM 1076 C CB . PRO A 1 140 ? 6.464 -14.162 8.470 1.00 73.48 ? 140 PRO A CB 1 ATOM 1077 C CG . PRO A 1 140 ? 5.472 -13.749 9.501 1.00 73.38 ? 140 PRO A CG 1 ATOM 1078 C CD . PRO A 1 140 ? 6.180 -14.013 10.798 1.00 73.35 ? 140 PRO A CD 1 ATOM 1079 N N . SER A 1 141 ? 9.051 -16.348 7.914 1.00 72.86 ? 141 SER A N 1 ATOM 1080 C CA . SER A 1 141 ? 10.462 -16.488 7.618 1.00 73.55 ? 141 SER A CA 1 ATOM 1081 C C . SER A 1 141 ? 11.048 -15.326 6.822 1.00 72.84 ? 141 SER A C 1 ATOM 1082 O O . SER A 1 141 ? 12.256 -15.100 6.846 1.00 72.88 ? 141 SER A O 1 ATOM 1083 C CB . SER A 1 141 ? 10.693 -17.769 6.856 1.00 73.34 ? 141 SER A CB 1 ATOM 1084 O OG . SER A 1 141 ? 10.024 -17.659 5.622 1.00 76.04 ? 141 SER A OG 1 ATOM 1085 N N . TRP A 1 142 ? 10.195 -14.593 6.116 1.00 72.71 ? 142 TRP A N 1 ATOM 1086 C CA . TRP A 1 142 ? 10.656 -13.435 5.375 1.00 72.72 ? 142 TRP A CA 1 ATOM 1087 C C . TRP A 1 142 ? 11.273 -12.399 6.305 1.00 72.44 ? 142 TRP A C 1 ATOM 1088 O O . TRP A 1 142 ? 11.902 -11.465 5.831 1.00 73.72 ? 142 TRP A O 1 ATOM 1089 C CB . TRP A 1 142 ? 9.530 -12.804 4.546 1.00 72.72 ? 142 TRP A CB 1 ATOM 1090 C CG . TRP A 1 142 ? 8.496 -12.033 5.309 1.00 73.61 ? 142 TRP A CG 1 ATOM 1091 C CD1 . TRP A 1 142 ? 7.305 -12.507 5.794 1.00 73.23 ? 142 TRP A CD1 1 ATOM 1092 C CD2 . TRP A 1 142 ? 8.547 -10.635 5.674 1.00 73.24 ? 142 TRP A CD2 1 ATOM 1093 N NE1 . TRP A 1 142 ? 6.626 -11.494 6.440 1.00 75.86 ? 142 TRP A NE1 1 ATOM 1094 C CE2 . TRP A 1 142 ? 7.357 -10.338 6.379 1.00 73.33 ? 142 TRP A CE2 1 ATOM 1095 C CE3 . TRP A 1 142 ? 9.479 -9.605 5.476 1.00 74.55 ? 142 TRP A CE3 1 ATOM 1096 C CZ2 . TRP A 1 142 ? 7.077 -9.063 6.890 1.00 75.37 ? 142 TRP A CZ2 1 ATOM 1097 C CZ3 . TRP A 1 142 ? 9.198 -8.320 5.986 1.00 73.94 ? 142 TRP A CZ3 1 ATOM 1098 C CH2 . TRP A 1 142 ? 8.007 -8.069 6.680 1.00 73.45 ? 142 TRP A CH2 1 ATOM 1099 N N . LEU A 1 143 ? 11.089 -12.574 7.616 1.00 71.78 ? 143 LEU A N 1 ATOM 1100 C CA . LEU A 1 143 ? 11.539 -11.610 8.640 1.00 70.54 ? 143 LEU A CA 1 ATOM 1101 C C . LEU A 1 143 ? 12.987 -11.816 9.010 1.00 70.54 ? 143 LEU A C 1 ATOM 1102 O O . LEU A 1 143 ? 13.637 -10.871 9.475 1.00 69.58 ? 143 LEU A O 1 ATOM 1103 C CB . LEU A 1 143 ? 10.683 -11.705 9.896 1.00 69.83 ? 143 LEU A CB 1 ATOM 1104 C CG . LEU A 1 143 ? 9.486 -10.768 9.955 1.00 70.45 ? 143 LEU A CG 1 ATOM 1105 C CD1 . LEU A 1 143 ? 8.497 -11.197 11.005 1.00 66.97 ? 143 LEU A CD1 1 ATOM 1106 C CD2 . LEU A 1 143 ? 9.970 -9.362 10.246 1.00 69.21 ? 143 LEU A CD2 1 ATOM 1107 N N . ASP A 1 144 ? 13.489 -13.040 8.802 1.00 69.51 ? 144 ASP A N 1 ATOM 1108 C CA . ASP A 1 144 ? 14.874 -13.358 9.119 1.00 70.54 ? 144 ASP A CA 1 ATOM 1109 C C . ASP A 1 144 ? 15.922 -12.385 8.527 1.00 70.31 ? 144 ASP A C 1 ATOM 1110 O O . ASP A 1 144 ? 16.784 -11.906 9.256 1.00 70.14 ? 144 ASP A O 1 ATOM 1111 C CB . ASP A 1 144 ? 15.203 -14.787 8.707 1.00 71.90 ? 144 ASP A CB 1 ATOM 1112 C CG . ASP A 1 144 ? 14.361 -15.790 9.434 1.00 75.56 ? 144 ASP A CG 1 ATOM 1113 O OD1 . ASP A 1 144 ? 14.146 -15.604 10.659 1.00 80.01 ? 144 ASP A OD1 1 ATOM 1114 O OD2 . ASP A 1 144 ? 13.866 -16.784 8.865 1.00 79.35 ? 144 ASP A OD2 1 ATOM 1115 N N . LEU A 1 145 ? 15.856 -12.101 7.228 1.00 69.45 ? 145 LEU A N 1 ATOM 1116 C CA . LEU A 1 145 ? 16.790 -11.153 6.606 1.00 69.64 ? 145 LEU A CA 1 ATOM 1117 C C . LEU A 1 145 ? 16.662 -9.700 7.125 1.00 70.03 ? 145 LEU A C 1 ATOM 1118 O O . LEU A 1 145 ? 17.685 -9.083 7.479 1.00 70.88 ? 145 LEU A O 1 ATOM 1119 C CB . LEU A 1 145 ? 16.658 -11.197 5.095 1.00 69.56 ? 145 LEU A CB 1 ATOM 1120 C CG . LEU A 1 145 ? 17.602 -10.339 4.264 1.00 69.99 ? 145 LEU A CG 1 ATOM 1121 C CD1 . LEU A 1 145 ? 19.083 -10.716 4.475 1.00 67.26 ? 145 LEU A CD1 1 ATOM 1122 C CD2 . LEU A 1 145 ? 17.220 -10.548 2.832 1.00 71.13 ? 145 LEU A CD2 1 ATOM 1123 N N . PRO A 1 146 ? 15.443 -9.135 7.180 1.00 69.69 ? 146 PRO A N 1 ATOM 1124 C CA . PRO A 1 146 ? 15.256 -7.812 7.766 1.00 69.31 ? 146 PRO A CA 1 ATOM 1125 C C . PRO A 1 146 ? 15.884 -7.747 9.146 1.00 69.12 ? 146 PRO A C 1 ATOM 1126 O O . PRO A 1 146 ? 16.494 -6.753 9.482 1.00 68.54 ? 146 PRO A O 1 ATOM 1127 C CB . PRO A 1 146 ? 13.737 -7.719 7.918 1.00 69.37 ? 146 PRO A CB 1 ATOM 1128 C CG . PRO A 1 146 ? 13.200 -8.585 6.902 1.00 69.91 ? 146 PRO A CG 1 ATOM 1129 C CD . PRO A 1 146 ? 14.165 -9.675 6.696 1.00 69.61 ? 146 PRO A CD 1 ATOM 1130 N N . ILE A 1 147 ? 15.738 -8.801 9.954 1.00 69.22 ? 147 ILE A N 1 ATOM 1131 C CA . ILE A 1 147 ? 16.372 -8.763 11.268 1.00 69.64 ? 147 ILE A CA 1 ATOM 1132 C C . ILE A 1 147 ? 17.904 -8.964 11.229 1.00 69.62 ? 147 ILE A C 1 ATOM 1133 O O . ILE A 1 147 ? 18.581 -8.515 12.141 1.00 69.95 ? 147 ILE A O 1 ATOM 1134 C CB . ILE A 1 147 ? 15.586 -9.535 12.408 1.00 69.83 ? 147 ILE A CB 1 ATOM 1135 C CG1 . ILE A 1 147 ? 15.896 -11.013 12.443 1.00 72.51 ? 147 ILE A CG1 1 ATOM 1136 C CG2 . ILE A 1 147 ? 14.064 -9.174 12.466 1.00 68.70 ? 147 ILE A CG2 1 ATOM 1137 C CD1 . ILE A 1 147 ? 16.947 -11.273 13.489 1.00 76.28 ? 147 ILE A CD1 1 ATOM 1138 N N . LYS A 1 148 ? 18.437 -9.607 10.183 1.00 68.85 ? 148 LYS A N 1 ATOM 1139 C CA . LYS A 1 148 ? 19.883 -9.647 9.946 1.00 69.65 ? 148 LYS A CA 1 ATOM 1140 C C . LYS A 1 148 ? 20.443 -8.218 9.685 1.00 70.02 ? 148 LYS A C 1 ATOM 1141 O O . LYS A 1 148 ? 21.431 -7.796 10.282 1.00 68.96 ? 148 LYS A O 1 ATOM 1142 C CB . LYS A 1 148 ? 20.201 -10.566 8.760 1.00 70.86 ? 148 LYS A CB 1 ATOM 1143 C CG . LYS A 1 148 ? 21.688 -10.753 8.449 1.00 73.22 ? 148 LYS A CG 1 ATOM 1144 C CD . LYS A 1 148 ? 21.973 -10.787 6.927 1.00 75.48 ? 148 LYS A CD 1 ATOM 1145 C CE . LYS A 1 148 ? 23.189 -9.863 6.620 1.00 78.50 ? 148 LYS A CE 1 ATOM 1146 N NZ . LYS A 1 148 ? 23.206 -9.126 5.281 1.00 76.18 ? 148 LYS A NZ 1 ATOM 1147 N N . VAL A 1 149 ? 19.801 -7.484 8.786 1.00 70.26 ? 149 VAL A N 1 ATOM 1148 C CA . VAL A 1 149 ? 20.211 -6.134 8.452 1.00 71.06 ? 149 VAL A CA 1 ATOM 1149 C C . VAL A 1 149 ? 20.278 -5.252 9.700 1.00 71.86 ? 149 VAL A C 1 ATOM 1150 O O . VAL A 1 149 ? 21.225 -4.494 9.901 1.00 72.67 ? 149 VAL A O 1 ATOM 1151 C CB . VAL A 1 149 ? 19.224 -5.489 7.459 1.00 71.04 ? 149 VAL A CB 1 ATOM 1152 C CG1 . VAL A 1 149 ? 19.629 -4.046 7.122 1.00 71.78 ? 149 VAL A CG1 1 ATOM 1153 C CG2 . VAL A 1 149 ? 19.104 -6.301 6.200 1.00 71.72 ? 149 VAL A CG2 1 ATOM 1154 N N . LEU A 1 150 ? 19.254 -5.372 10.535 1.00 72.32 ? 150 LEU A N 1 ATOM 1155 C CA . LEU A 1 150 ? 19.093 -4.593 11.747 1.00 71.67 ? 150 LEU A CA 1 ATOM 1156 C C . LEU A 1 150 ? 20.164 -4.934 12.802 1.00 71.72 ? 150 LEU A C 1 ATOM 1157 O O . LEU A 1 150 ? 20.655 -4.037 13.501 1.00 71.83 ? 150 LEU A O 1 ATOM 1158 C CB . LEU A 1 150 ? 17.683 -4.876 12.253 1.00 71.46 ? 150 LEU A CB 1 ATOM 1159 C CG . LEU A 1 150 ? 16.678 -3.912 12.856 1.00 72.90 ? 150 LEU A CG 1 ATOM 1160 C CD1 . LEU A 1 150 ? 16.671 -2.474 12.271 1.00 72.35 ? 150 LEU A CD1 1 ATOM 1161 C CD2 . LEU A 1 150 ? 15.323 -4.559 12.710 1.00 73.74 ? 150 LEU A CD2 1 ATOM 1162 N N . ASN A 1 151 ? 20.516 -6.215 12.902 1.00 71.05 ? 151 ASN A N 1 ATOM 1163 C CA . ASN A 1 151 ? 21.530 -6.703 13.830 1.00 71.37 ? 151 ASN A CA 1 ATOM 1164 C C . ASN A 1 151 ? 22.957 -6.355 13.428 1.00 72.06 ? 151 ASN A C 1 ATOM 1165 O O . ASN A 1 151 ? 23.893 -6.602 14.202 1.00 72.10 ? 151 ASN A O 1 ATOM 1166 C CB . ASN A 1 151 ? 21.414 -8.224 14.040 1.00 70.94 ? 151 ASN A CB 1 ATOM 1167 C CG . ASN A 1 151 ? 20.322 -8.594 15.043 1.00 71.93 ? 151 ASN A CG 1 ATOM 1168 O OD1 . ASN A 1 151 ? 19.882 -7.747 15.844 1.00 69.87 ? 151 ASN A OD1 1 ATOM 1169 N ND2 . ASN A 1 151 ? 19.874 -9.857 15.007 1.00 67.82 ? 151 ASN A ND2 1 ATOM 1170 N N . ALA A 1 152 ? 23.117 -5.793 12.228 1.00 71.48 ? 152 ALA A N 1 ATOM 1171 C CA . ALA A 1 152 ? 24.387 -5.293 11.772 1.00 71.50 ? 152 ALA A CA 1 ATOM 1172 C C . ALA A 1 152 ? 24.638 -3.872 12.337 1.00 71.75 ? 152 ALA A C 1 ATOM 1173 O O . ALA A 1 152 ? 25.754 -3.379 12.310 1.00 71.78 ? 152 ALA A O 1 ATOM 1174 C CB . ALA A 1 152 ? 24.393 -5.271 10.282 1.00 71.84 ? 152 ALA A CB 1 ATOM 1175 N N . ASP A 1 153 ? 23.599 -3.220 12.859 1.00 72.01 ? 153 ASP A N 1 ATOM 1176 C CA . ASP A 1 153 ? 23.723 -1.841 13.420 1.00 71.31 ? 153 ASP A CA 1 ATOM 1177 C C . ASP A 1 153 ? 24.130 -1.917 14.909 1.00 71.48 ? 153 ASP A C 1 ATOM 1178 O O . ASP A 1 153 ? 23.311 -2.074 15.821 1.00 70.93 ? 153 ASP A O 1 ATOM 1179 C CB . ASP A 1 153 ? 22.409 -1.090 13.216 1.00 71.11 ? 153 ASP A CB 1 ATOM 1180 C CG . ASP A 1 153 ? 22.503 0.399 13.510 1.00 72.36 ? 153 ASP A CG 1 ATOM 1181 O OD1 . ASP A 1 153 ? 23.450 0.883 14.161 1.00 70.77 ? 153 ASP A OD1 1 ATOM 1182 O OD2 . ASP A 1 153 ? 21.633 1.179 13.109 1.00 75.55 ? 153 ASP A OD2 1 ATOM 1183 N N . GLN A 1 154 ? 25.429 -1.798 15.130 1.00 71.75 ? 154 GLN A N 1 ATOM 1184 C CA . GLN A 1 154 ? 26.030 -1.933 16.438 1.00 71.50 ? 154 GLN A CA 1 ATOM 1185 C C . GLN A 1 154 ? 25.715 -0.752 17.344 1.00 71.13 ? 154 GLN A C 1 ATOM 1186 O O . GLN A 1 154 ? 25.657 -0.918 18.546 1.00 70.95 ? 154 GLN A O 1 ATOM 1187 C CB . GLN A 1 154 ? 27.526 -2.084 16.256 1.00 71.52 ? 154 GLN A CB 1 ATOM 1188 C CG . GLN A 1 154 ? 28.300 -2.492 17.481 1.00 72.36 ? 154 GLN A CG 1 ATOM 1189 C CD . GLN A 1 154 ? 29.814 -2.434 17.268 1.00 72.72 ? 154 GLN A CD 1 ATOM 1190 O OE1 . GLN A 1 154 ? 30.293 -2.198 16.147 1.00 74.68 ? 154 GLN A OE1 1 ATOM 1191 N NE2 . GLN A 1 154 ? 30.572 -2.647 18.348 1.00 73.98 ? 154 GLN A NE2 1 ATOM 1192 N N . GLY A 1 155 ? 25.507 0.428 16.768 1.00 70.67 ? 155 GLY A N 1 ATOM 1193 C CA . GLY A 1 155 ? 25.248 1.630 17.553 1.00 71.02 ? 155 GLY A CA 1 ATOM 1194 C C . GLY A 1 155 ? 23.864 1.574 18.175 1.00 71.43 ? 155 GLY A C 1 ATOM 1195 O O . GLY A 1 155 ? 23.686 1.860 19.357 1.00 71.83 ? 155 GLY A O 1 ATOM 1196 N N . THR A 1 156 ? 22.888 1.207 17.362 1.00 70.78 ? 156 THR A N 1 ATOM 1197 C CA . THR A 1 156 ? 21.512 1.090 17.784 1.00 71.46 ? 156 THR A CA 1 ATOM 1198 C C . THR A 1 156 ? 21.379 0.019 18.862 1.00 71.62 ? 156 THR A C 1 ATOM 1199 O O . THR A 1 156 ? 20.640 0.192 19.825 1.00 72.49 ? 156 THR A O 1 ATOM 1200 C CB . THR A 1 156 ? 20.620 0.758 16.559 1.00 71.41 ? 156 THR A CB 1 ATOM 1201 O OG1 . THR A 1 156 ? 20.294 1.974 15.879 1.00 72.74 ? 156 THR A OG1 1 ATOM 1202 C CG2 . THR A 1 156 ? 19.239 0.219 16.981 1.00 72.86 ? 156 THR A CG2 1 ATOM 1203 N N . SER A 1 157 ? 22.103 -1.080 18.687 1.00 71.19 ? 157 SER A N 1 ATOM 1204 C CA . SER A 1 157 ? 22.072 -2.185 19.614 1.00 70.60 ? 157 SER A CA 1 ATOM 1205 C C . SER A 1 157 ? 22.576 -1.758 20.985 1.00 70.96 ? 157 SER A C 1 ATOM 1206 O O . SER A 1 157 ? 22.015 -2.156 22.020 1.00 71.17 ? 157 SER A O 1 ATOM 1207 C CB . SER A 1 157 ? 22.853 -3.383 19.056 1.00 70.06 ? 157 SER A CB 1 ATOM 1208 O OG . SER A 1 157 ? 23.099 -4.320 20.069 1.00 67.15 ? 157 SER A OG 1 ATOM 1209 N N . ALA A 1 158 ? 23.624 -0.941 20.982 1.00 70.89 ? 158 ALA A N 1 ATOM 1210 C CA . ALA A 1 158 ? 24.169 -0.418 22.200 1.00 70.49 ? 158 ALA A CA 1 ATOM 1211 C C . ALA A 1 158 ? 23.192 0.573 22.836 1.00 70.70 ? 158 ALA A C 1 ATOM 1212 O O . ALA A 1 158 ? 23.048 0.627 24.051 1.00 70.41 ? 158 ALA A O 1 ATOM 1213 C CB . ALA A 1 158 ? 25.500 0.239 21.920 1.00 70.73 ? 158 ALA A CB 1 ATOM 1214 N N . THR A 1 159 ? 22.518 1.356 22.000 1.00 70.72 ? 159 THR A N 1 ATOM 1215 C CA . THR A 1 159 ? 21.619 2.367 22.486 1.00 70.05 ? 159 THR A CA 1 ATOM 1216 C C . THR A 1 159 ? 20.397 1.727 23.100 1.00 70.22 ? 159 THR A C 1 ATOM 1217 O O . THR A 1 159 ? 19.879 2.225 24.072 1.00 70.28 ? 159 THR A O 1 ATOM 1218 C CB . THR A 1 159 ? 21.204 3.271 21.361 1.00 70.40 ? 159 THR A CB 1 ATOM 1219 O OG1 . THR A 1 159 ? 22.350 3.940 20.863 1.00 70.87 ? 159 THR A OG1 1 ATOM 1220 C CG2 . THR A 1 159 ? 20.378 4.450 21.897 1.00 70.62 ? 159 THR A CG2 1 ATOM 1221 N N . VAL A 1 160 ? 19.951 0.624 22.517 1.00 69.66 ? 160 VAL A N 1 ATOM 1222 C CA . VAL A 1 160 ? 18.795 -0.104 22.997 1.00 69.95 ? 160 VAL A CA 1 ATOM 1223 C C . VAL A 1 160 ? 19.117 -0.817 24.309 1.00 69.78 ? 160 VAL A C 1 ATOM 1224 O O . VAL A 1 160 ? 18.262 -0.912 25.208 1.00 69.25 ? 160 VAL A O 1 ATOM 1225 C CB . VAL A 1 160 ? 18.215 -1.086 21.913 1.00 69.69 ? 160 VAL A CB 1 ATOM 1226 C CG1 . VAL A 1 160 ? 17.159 -1.969 22.488 1.00 70.11 ? 160 VAL A CG1 1 ATOM 1227 C CG2 . VAL A 1 160 ? 17.598 -0.320 20.767 1.00 68.97 ? 160 VAL A CG2 1 ATOM 1228 N N . GLN A 1 161 ? 20.347 -1.317 24.420 1.00 69.71 ? 161 GLN A N 1 ATOM 1229 C CA . GLN A 1 161 ? 20.789 -1.948 25.669 1.00 68.88 ? 161 GLN A CA 1 ATOM 1230 C C . GLN A 1 161 ? 20.818 -0.940 26.818 1.00 69.35 ? 161 GLN A C 1 ATOM 1231 O O . GLN A 1 161 ? 20.433 -1.264 27.931 1.00 69.54 ? 161 GLN A O 1 ATOM 1232 C CB . GLN A 1 161 ? 22.128 -2.629 25.489 1.00 68.35 ? 161 GLN A CB 1 ATOM 1233 C CG . GLN A 1 161 ? 22.073 -3.820 24.579 1.00 66.69 ? 161 GLN A CG 1 ATOM 1234 C CD . GLN A 1 161 ? 23.443 -4.378 24.272 1.00 66.07 ? 161 GLN A CD 1 ATOM 1235 O OE1 . GLN A 1 161 ? 24.161 -4.749 25.176 1.00 66.42 ? 161 GLN A OE1 1 ATOM 1236 N NE2 . GLN A 1 161 ? 23.807 -4.439 22.989 1.00 63.61 ? 161 GLN A NE2 1 ATOM 1237 N N . MET A 1 162 ? 21.263 0.281 26.538 1.00 69.89 ? 162 MET A N 1 ATOM 1238 C CA . MET A 1 162 ? 21.313 1.358 27.519 1.00 70.90 ? 162 MET A CA 1 ATOM 1239 C C . MET A 1 162 ? 19.889 1.778 27.938 1.00 70.76 ? 162 MET A C 1 ATOM 1240 O O . MET A 1 162 ? 19.637 2.044 29.080 1.00 71.35 ? 162 MET A O 1 ATOM 1241 C CB . MET A 1 162 ? 22.061 2.534 26.907 1.00 70.77 ? 162 MET A CB 1 ATOM 1242 C CG . MET A 1 162 ? 22.284 3.746 27.798 1.00 72.37 ? 162 MET A CG 1 ATOM 1243 S SD . MET A 1 162 ? 22.564 5.258 26.817 1.00 74.04 ? 162 MET A SD 1 ATOM 1244 C CE . MET A 1 162 ? 20.993 5.470 25.971 1.00 75.74 ? 162 MET A CE 1 ATOM 1245 N N . LEU A 1 163 ? 18.947 1.828 27.008 1.00 70.85 ? 163 LEU A N 1 ATOM 1246 C CA . LEU A 1 163 ? 17.590 2.221 27.331 1.00 70.64 ? 163 LEU A CA 1 ATOM 1247 C C . LEU A 1 163 ? 16.851 1.183 28.183 1.00 70.77 ? 163 LEU A C 1 ATOM 1248 O O . LEU A 1 163 ? 16.159 1.535 29.144 1.00 70.76 ? 163 LEU A O 1 ATOM 1249 C CB . LEU A 1 163 ? 16.809 2.532 26.054 1.00 70.57 ? 163 LEU A CB 1 ATOM 1250 C CG . LEU A 1 163 ? 17.200 3.794 25.268 1.00 71.75 ? 163 LEU A CG 1 ATOM 1251 C CD1 . LEU A 1 163 ? 16.412 3.828 23.970 1.00 71.82 ? 163 LEU A CD1 1 ATOM 1252 C CD2 . LEU A 1 163 ? 16.992 5.112 26.063 1.00 68.70 ? 163 LEU A CD2 1 ATOM 1253 N N . LEU A 1 164 ? 17.004 -0.087 27.819 1.00 69.84 ? 164 LEU A N 1 ATOM 1254 C CA . LEU A 1 164 ? 16.383 -1.192 28.530 1.00 69.45 ? 164 LEU A CA 1 ATOM 1255 C C . LEU A 1 164 ? 17.039 -1.469 29.880 1.00 69.94 ? 164 LEU A C 1 ATOM 1256 O O . LEU A 1 164 ? 16.382 -1.415 30.918 1.00 70.06 ? 164 LEU A O 1 ATOM 1257 C CB . LEU A 1 164 ? 16.447 -2.456 27.659 1.00 69.64 ? 164 LEU A CB 1 ATOM 1258 C CG . LEU A 1 164 ? 15.259 -2.850 26.771 1.00 69.65 ? 164 LEU A CG 1 ATOM 1259 C CD1 . LEU A 1 164 ? 14.501 -1.666 26.184 1.00 67.75 ? 164 LEU A CD1 1 ATOM 1260 C CD2 . LEU A 1 164 ? 15.666 -3.896 25.712 1.00 69.30 ? 164 LEU A CD2 1 ATOM 1261 N N . ASN A 1 165 ? 18.338 -1.766 29.857 1.00 69.57 ? 165 ASN A N 1 ATOM 1262 C CA . ASN A 1 165 ? 19.048 -2.119 31.072 1.00 69.59 ? 165 ASN A CA 1 ATOM 1263 C C . ASN A 1 165 ? 19.215 -0.971 32.047 1.00 70.02 ? 165 ASN A C 1 ATOM 1264 O O . ASN A 1 165 ? 19.242 -1.193 33.236 1.00 70.72 ? 165 ASN A O 1 ATOM 1265 C CB . ASN A 1 165 ? 20.445 -2.632 30.755 1.00 68.69 ? 165 ASN A CB 1 ATOM 1266 C CG . ASN A 1 165 ? 20.454 -3.882 29.907 1.00 68.80 ? 165 ASN A CG 1 ATOM 1267 O OD1 . ASN A 1 165 ? 19.462 -4.265 29.282 1.00 69.10 ? 165 ASN A OD1 1 ATOM 1268 N ND2 . ASN A 1 165 ? 21.610 -4.526 29.885 1.00 68.12 ? 165 ASN A ND2 1 ATOM 1269 N N . ASP A 1 166 ? 19.329 0.253 31.559 1.00 70.97 ? 166 ASP A N 1 ATOM 1270 C CA . ASP A 1 166 ? 19.733 1.373 32.427 1.00 72.18 ? 166 ASP A CA 1 ATOM 1271 C C . ASP A 1 166 ? 18.805 2.563 32.490 1.00 72.74 ? 166 ASP A C 1 ATOM 1272 O O . ASP A 1 166 ? 18.434 2.981 33.564 1.00 73.22 ? 166 ASP A O 1 ATOM 1273 C CB . ASP A 1 166 ? 21.108 1.879 32.009 1.00 72.45 ? 166 ASP A CB 1 ATOM 1274 C CG . ASP A 1 166 ? 22.228 0.879 32.295 1.00 74.58 ? 166 ASP A CG 1 ATOM 1275 O OD1 . ASP A 1 166 ? 21.969 -0.234 32.808 1.00 76.30 ? 166 ASP A OD1 1 ATOM 1276 O OD2 . ASP A 1 166 ? 23.428 1.129 32.040 1.00 78.75 ? 166 ASP A OD2 1 ATOM 1277 N N . THR A 1 167 ? 18.439 3.112 31.342 1.00 73.86 ? 167 THR A N 1 ATOM 1278 C CA . THR A 1 167 ? 17.592 4.312 31.275 1.00 75.07 ? 167 THR A CA 1 ATOM 1279 C C . THR A 1 167 ? 16.178 4.088 31.840 1.00 75.80 ? 167 THR A C 1 ATOM 1280 O O . THR A 1 167 ? 15.722 4.846 32.694 1.00 75.10 ? 167 THR A O 1 ATOM 1281 C CB . THR A 1 167 ? 17.513 4.852 29.806 1.00 74.55 ? 167 THR A CB 1 ATOM 1282 O OG1 . THR A 1 167 ? 18.807 4.831 29.193 1.00 74.84 ? 167 THR A OG1 1 ATOM 1283 C CG2 . THR A 1 167 ? 17.130 6.309 29.774 1.00 73.69 ? 167 THR A CG2 1 ATOM 1284 N N . CYS A 1 168 ? 15.504 3.046 31.343 1.00 77.62 ? 168 CYS A N 1 ATOM 1285 C CA . CYS A 1 168 ? 14.144 2.676 31.782 1.00 78.26 ? 168 CYS A CA 1 ATOM 1286 C C . CYS A 1 168 ? 14.023 2.505 33.307 1.00 77.75 ? 168 CYS A C 1 ATOM 1287 O O . CYS A 1 168 ? 13.267 3.246 33.928 1.00 77.93 ? 168 CYS A O 1 ATOM 1288 C CB . CYS A 1 168 ? 13.621 1.410 31.043 1.00 79.03 ? 168 CYS A CB 1 ATOM 1289 S SG . CYS A 1 168 ? 11.920 0.914 31.448 1.00 81.45 ? 168 CYS A SG 1 ATOM 1290 N N . PRO A 1 169 ? 14.752 1.558 33.914 1.00 77.08 ? 169 PRO A N 1 ATOM 1291 C CA . PRO A 1 169 ? 14.667 1.360 35.367 1.00 76.28 ? 169 PRO A CA 1 ATOM 1292 C C . PRO A 1 169 ? 14.929 2.634 36.180 1.00 75.99 ? 169 PRO A C 1 ATOM 1293 O O . PRO A 1 169 ? 14.206 2.901 37.147 1.00 75.94 ? 169 PRO A O 1 ATOM 1294 C CB . PRO A 1 169 ? 15.733 0.302 35.640 1.00 76.12 ? 169 PRO A CB 1 ATOM 1295 C CG . PRO A 1 169 ? 15.899 -0.423 34.327 1.00 76.05 ? 169 PRO A CG 1 ATOM 1296 C CD . PRO A 1 169 ? 15.699 0.610 33.287 1.00 76.85 ? 169 PRO A CD 1 ATOM 1297 N N . LEU A 1 170 ? 15.936 3.416 35.795 1.00 75.61 ? 170 LEU A N 1 ATOM 1298 C CA . LEU A 1 170 ? 16.268 4.656 36.508 1.00 75.62 ? 170 LEU A CA 1 ATOM 1299 C C . LEU A 1 170 ? 15.129 5.682 36.475 1.00 74.87 ? 170 LEU A C 1 ATOM 1300 O O . LEU A 1 170 ? 14.783 6.270 37.499 1.00 74.68 ? 170 LEU A O 1 ATOM 1301 C CB . LEU A 1 170 ? 17.529 5.302 35.929 1.00 76.00 ? 170 LEU A CB 1 ATOM 1302 C CG . LEU A 1 170 ? 17.897 6.615 36.632 1.00 78.10 ? 170 LEU A CG 1 ATOM 1303 C CD1 . LEU A 1 170 ? 19.193 6.465 37.455 1.00 79.80 ? 170 LEU A CD1 1 ATOM 1304 C CD2 . LEU A 1 170 ? 18.016 7.772 35.638 1.00 79.25 ? 170 LEU A CD2 1 ATOM 1305 N N . PHE A 1 171 ? 14.565 5.886 35.288 1.00 74.34 ? 171 PHE A N 1 ATOM 1306 C CA . PHE A 1 171 ? 13.507 6.852 35.081 1.00 73.85 ? 171 PHE A CA 1 ATOM 1307 C C . PHE A 1 171 ? 12.262 6.442 35.876 1.00 73.61 ? 171 PHE A C 1 ATOM 1308 O O . PHE A 1 171 ? 11.751 7.237 36.692 1.00 72.98 ? 171 PHE A O 1 ATOM 1309 C CB . PHE A 1 171 ? 13.201 7.006 33.574 1.00 74.36 ? 171 PHE A CB 1 ATOM 1310 C CG . PHE A 1 171 ? 12.055 7.963 33.266 1.00 75.25 ? 171 PHE A CG 1 ATOM 1311 C CD1 . PHE A 1 171 ? 12.152 9.333 33.573 1.00 75.57 ? 171 PHE A CD1 1 ATOM 1312 C CD2 . PHE A 1 171 ? 10.879 7.493 32.668 1.00 75.77 ? 171 PHE A CD2 1 ATOM 1313 C CE1 . PHE A 1 171 ? 11.087 10.224 33.292 1.00 74.84 ? 171 PHE A CE1 1 ATOM 1314 C CE2 . PHE A 1 171 ? 9.814 8.365 32.380 1.00 75.51 ? 171 PHE A CE2 1 ATOM 1315 C CZ . PHE A 1 171 ? 9.919 9.730 32.690 1.00 76.21 ? 171 PHE A CZ 1 ATOM 1316 N N . VAL A 1 172 ? 11.784 5.213 35.628 1.00 72.89 ? 172 VAL A N 1 ATOM 1317 C CA . VAL A 1 172 ? 10.634 4.648 36.334 1.00 72.40 ? 172 VAL A CA 1 ATOM 1318 C C . VAL A 1 172 ? 10.744 4.850 37.850 1.00 72.61 ? 172 VAL A C 1 ATOM 1319 O O . VAL A 1 172 ? 9.761 5.221 38.505 1.00 72.43 ? 172 VAL A O 1 ATOM 1320 C CB . VAL A 1 172 ? 10.448 3.152 36.028 1.00 72.12 ? 172 VAL A CB 1 ATOM 1321 C CG1 . VAL A 1 172 ? 9.219 2.612 36.757 1.00 72.80 ? 172 VAL A CG1 1 ATOM 1322 C CG2 . VAL A 1 172 ? 10.271 2.927 34.541 1.00 71.52 ? 172 VAL A CG2 1 ATOM 1323 N N . ARG A 1 173 ? 11.943 4.604 38.391 1.00 72.48 ? 173 ARG A N 1 ATOM 1324 C CA . ARG A 1 173 ? 12.232 4.800 39.806 1.00 72.67 ? 173 ARG A CA 1 ATOM 1325 C C . ARG A 1 173 ? 11.963 6.281 40.175 1.00 72.15 ? 173 ARG A C 1 ATOM 1326 O O . ARG A 1 173 ? 11.442 6.580 41.233 1.00 72.09 ? 173 ARG A O 1 ATOM 1327 C CB . ARG A 1 173 ? 13.678 4.360 40.086 1.00 73.08 ? 173 ARG A CB 1 ATOM 1328 C CG . ARG A 1 173 ? 14.002 3.893 41.521 1.00 75.97 ? 173 ARG A CG 1 ATOM 1329 C CD . ARG A 1 173 ? 13.181 2.666 42.037 1.00 80.17 ? 173 ARG A CD 1 ATOM 1330 N NE . ARG A 1 173 ? 11.825 3.009 42.519 1.00 81.59 ? 173 ARG A NE 1 ATOM 1331 C CZ . ARG A 1 173 ? 11.523 3.347 43.780 1.00 82.41 ? 173 ARG A CZ 1 ATOM 1332 N NH1 . ARG A 1 173 ? 12.471 3.393 44.710 1.00 84.23 ? 173 ARG A NH1 1 ATOM 1333 N NH2 . ARG A 1 173 ? 10.274 3.640 44.121 1.00 82.53 ? 173 ARG A NH2 1 ATOM 1334 N N . GLY A 1 174 ? 12.308 7.200 39.284 1.00 71.96 ? 174 GLY A N 1 ATOM 1335 C CA . GLY A 1 174 ? 12.011 8.610 39.480 1.00 72.54 ? 174 GLY A CA 1 ATOM 1336 C C . GLY A 1 174 ? 10.531 8.913 39.369 1.00 72.91 ? 174 GLY A C 1 ATOM 1337 O O . GLY A 1 174 ? 10.041 9.796 40.041 1.00 73.14 ? 174 GLY A O 1 ATOM 1338 N N . LEU A 1 175 ? 9.827 8.178 38.511 1.00 73.44 ? 175 LEU A N 1 ATOM 1339 C CA . LEU A 1 175 ? 8.371 8.298 38.371 1.00 73.65 ? 175 LEU A CA 1 ATOM 1340 C C . LEU A 1 175 ? 7.646 7.857 39.629 1.00 73.16 ? 175 LEU A C 1 ATOM 1341 O O . LEU A 1 175 ? 6.759 8.554 40.087 1.00 73.23 ? 175 LEU A O 1 ATOM 1342 C CB . LEU A 1 175 ? 7.840 7.460 37.199 1.00 74.06 ? 175 LEU A CB 1 ATOM 1343 C CG . LEU A 1 175 ? 7.680 7.938 35.759 1.00 74.29 ? 175 LEU A CG 1 ATOM 1344 C CD1 . LEU A 1 175 ? 6.965 6.854 35.025 1.00 75.51 ? 175 LEU A CD1 1 ATOM 1345 C CD2 . LEU A 1 175 ? 6.873 9.212 35.670 1.00 77.05 ? 175 LEU A CD2 1 ATOM 1346 N N . LEU A 1 176 ? 8.031 6.698 40.167 1.00 72.98 ? 176 LEU A N 1 ATOM 1347 C CA . LEU A 1 176 ? 7.450 6.135 41.394 1.00 73.23 ? 176 LEU A CA 1 ATOM 1348 C C . LEU A 1 176 ? 7.570 7.035 42.621 1.00 73.62 ? 176 LEU A C 1 ATOM 1349 O O . LEU A 1 176 ? 6.665 7.089 43.456 1.00 73.90 ? 176 LEU A O 1 ATOM 1350 C CB . LEU A 1 176 ? 8.086 4.785 41.718 1.00 72.83 ? 176 LEU A CB 1 ATOM 1351 C CG . LEU A 1 176 ? 7.750 3.609 40.813 1.00 72.93 ? 176 LEU A CG 1 ATOM 1352 C CD1 . LEU A 1 176 ? 8.637 2.425 41.134 1.00 71.73 ? 176 LEU A CD1 1 ATOM 1353 C CD2 . LEU A 1 176 ? 6.275 3.237 40.948 1.00 72.37 ? 176 LEU A CD2 1 ATOM 1354 N N . GLU A 1 177 ? 8.693 7.733 42.733 1.00 73.99 ? 177 GLU A N 1 ATOM 1355 C CA . GLU A 1 177 ? 8.897 8.644 43.831 1.00 74.40 ? 177 GLU A CA 1 ATOM 1356 C C . GLU A 1 177 ? 8.009 9.847 43.616 1.00 74.12 ? 177 GLU A C 1 ATOM 1357 O O . GLU A 1 177 ? 7.375 10.324 44.560 1.00 74.44 ? 177 GLU A O 1 ATOM 1358 C CB . GLU A 1 177 ? 10.353 9.109 43.928 1.00 74.43 ? 177 GLU A CB 1 ATOM 1359 C CG . GLU A 1 177 ? 11.395 8.007 44.025 1.00 75.01 ? 177 GLU A CG 1 ATOM 1360 C CD . GLU A 1 177 ? 12.814 8.561 44.043 1.00 75.90 ? 177 GLU A CD 1 ATOM 1361 O OE1 . GLU A 1 177 ? 13.677 8.080 43.261 1.00 77.94 ? 177 GLU A OE1 1 ATOM 1362 O OE2 . GLU A 1 177 ? 13.079 9.494 44.845 1.00 78.84 ? 177 GLU A OE2 1 ATOM 1363 N N . ALA A 1 178 ? 7.959 10.341 42.378 1.00 73.23 ? 178 ALA A N 1 ATOM 1364 C CA . ALA A 1 178 ? 7.230 11.573 42.123 1.00 73.30 ? 178 ALA A CA 1 ATOM 1365 C C . ALA A 1 178 ? 5.703 11.436 42.169 1.00 73.68 ? 178 ALA A C 1 ATOM 1366 O O . ALA A 1 178 ? 5.019 12.341 42.617 1.00 73.96 ? 178 ALA A O 1 ATOM 1367 C CB . ALA A 1 178 ? 7.714 12.248 40.841 1.00 72.90 ? 178 ALA A CB 1 ATOM 1368 N N . GLY A 1 179 ? 5.172 10.310 41.705 1.00 74.30 ? 179 GLY A N 1 ATOM 1369 C CA . GLY A 1 179 ? 3.734 10.086 41.750 1.00 74.19 ? 179 GLY A CA 1 ATOM 1370 C C . GLY A 1 179 ? 3.301 9.096 42.807 1.00 74.27 ? 179 GLY A C 1 ATOM 1371 O O . GLY A 1 179 ? 2.373 8.319 42.571 1.00 74.22 ? 179 GLY A O 1 ATOM 1372 N N . LYS A 1 180 ? 3.963 9.121 43.967 1.00 74.10 ? 180 LYS A N 1 ATOM 1373 C CA . LYS A 1 180 ? 3.635 8.211 45.071 1.00 74.57 ? 180 LYS A CA 1 ATOM 1374 C C . LYS A 1 180 ? 2.222 8.502 45.590 1.00 74.96 ? 180 LYS A C 1 ATOM 1375 O O . LYS A 1 180 ? 1.442 7.594 45.895 1.00 74.69 ? 180 LYS A O 1 ATOM 1376 C CB . LYS A 1 180 ? 4.552 8.572 46.147 0.00 40.00 ? 180 LYS A CB 1 ATOM 1377 C CG . LYS A 1 180 ? 4.656 7.451 47.182 0.00 40.00 ? 180 LYS A CG 1 ATOM 1378 C CD . LYS A 1 180 ? 5.085 8.034 48.561 0.00 40.00 ? 180 LYS A CD 1 ATOM 1379 C CE . LYS A 1 180 ? 6.559 7.806 48.921 0.00 40.00 ? 180 LYS A CE 1 ATOM 1380 N NZ . LYS A 1 180 ? 6.846 6.388 49.315 0.00 40.00 ? 180 LYS A NZ 1 ATOM 1381 N N . SER A 1 181 ? 1.905 9.784 45.679 1.00 75.55 ? 181 SER A N 1 ATOM 1382 C CA . SER A 1 181 ? 0.631 10.210 46.210 1.00 76.58 ? 181 SER A CA 1 ATOM 1383 C C . SER A 1 181 ? -0.514 9.923 45.251 1.00 76.56 ? 181 SER A C 1 ATOM 1384 O O . SER A 1 181 ? -1.672 9.838 45.662 1.00 77.71 ? 181 SER A O 1 ATOM 1385 C CB . SER A 1 181 ? 0.679 11.688 46.599 1.00 76.78 ? 181 SER A CB 1 ATOM 1386 O OG . SER A 1 181 ? 0.843 12.500 45.456 1.00 78.81 ? 181 SER A OG 1 ATOM 1387 N N . ASP A 1 182 ? -0.201 9.773 43.974 1.00 76.59 ? 182 ASP A N 1 ATOM 1388 C CA . ASP A 1 182 ? -1.206 9.379 42.993 1.00 75.74 ? 182 ASP A CA 1 ATOM 1389 C C . ASP A 1 182 ? -1.349 7.871 42.854 1.00 75.59 ? 182 ASP A C 1 ATOM 1390 O O . ASP A 1 182 ? -2.445 7.374 42.649 1.00 75.67 ? 182 ASP A O 1 ATOM 1391 C CB . ASP A 1 182 ? -0.878 9.940 41.614 1.00 76.27 ? 182 ASP A CB 1 ATOM 1392 C CG . ASP A 1 182 ? -1.763 11.077 41.224 1.00 75.67 ? 182 ASP A CG 1 ATOM 1393 O OD1 . ASP A 1 182 ? -1.949 11.995 42.045 1.00 74.80 ? 182 ASP A OD1 1 ATOM 1394 O OD2 . ASP A 1 182 ? -2.314 11.122 40.103 1.00 77.00 ? 182 ASP A OD2 1 ATOM 1395 N N . LEU A 1 183 ? -0.243 7.143 42.953 1.00 74.76 ? 183 LEU A N 1 ATOM 1396 C CA . LEU A 1 183 ? -0.286 5.692 42.816 1.00 73.72 ? 183 LEU A CA 1 ATOM 1397 C C . LEU A 1 183 ? -0.784 5.082 44.100 1.00 73.23 ? 183 LEU A C 1 ATOM 1398 O O . LEU A 1 183 ? -1.282 3.962 44.101 1.00 72.38 ? 183 LEU A O 1 ATOM 1399 C CB . LEU A 1 183 ? 1.094 5.149 42.488 1.00 73.55 ? 183 LEU A CB 1 ATOM 1400 C CG . LEU A 1 183 ? 1.583 5.590 41.120 1.00 73.95 ? 183 LEU A CG 1 ATOM 1401 C CD1 . LEU A 1 183 ? 3.100 5.652 41.084 1.00 75.95 ? 183 LEU A CD1 1 ATOM 1402 C CD2 . LEU A 1 183 ? 1.046 4.666 40.053 1.00 76.24 ? 183 LEU A CD2 1 ATOM 1403 N N . GLU A 1 184 ? -0.632 5.839 45.186 1.00 73.13 ? 184 GLU A N 1 ATOM 1404 C CA . GLU A 1 184 ? -1.102 5.444 46.508 1.00 73.21 ? 184 GLU A CA 1 ATOM 1405 C C . GLU A 1 184 ? -2.539 5.922 46.805 1.00 73.17 ? 184 GLU A C 1 ATOM 1406 O O . GLU A 1 184 ? -3.102 5.530 47.820 1.00 72.67 ? 184 GLU A O 1 ATOM 1407 C CB . GLU A 1 184 ? -0.199 5.196 47.161 0.00 40.00 ? 184 GLU A CB 1 ATOM 1408 C CG . GLU A 1 184 ? 0.737 3.987 47.052 0.00 40.00 ? 184 GLU A CG 1 ATOM 1409 C CD . GLU A 1 184 ? 1.639 3.803 48.285 0.00 40.00 ? 184 GLU A CD 1 ATOM 1410 O OE1 . GLU A 1 184 ? 1.712 4.726 49.142 0.00 40.00 ? 184 GLU A OE1 1 ATOM 1411 O OE2 . GLU A 1 184 ? 2.292 2.734 48.400 0.00 40.00 ? 184 GLU A OE2 1 ATOM 1412 N N . LYS A 1 185 ? -3.122 6.755 45.932 1.00 73.22 ? 185 LYS A N 1 ATOM 1413 C CA . LYS A 1 185 ? -4.478 7.292 46.159 1.00 73.67 ? 185 LYS A CA 1 ATOM 1414 C C . LYS A 1 185 ? -5.458 6.144 46.409 1.00 73.04 ? 185 LYS A C 1 ATOM 1415 O O . LYS A 1 185 ? -5.321 5.051 45.846 1.00 72.74 ? 185 LYS A O 1 ATOM 1416 C CB . LYS A 1 185 ? -4.965 8.241 45.027 1.00 73.88 ? 185 LYS A CB 1 ATOM 1417 C CG . LYS A 1 185 ? -4.848 7.650 43.589 1.00 76.13 ? 185 LYS A CG 1 ATOM 1418 C CD . LYS A 1 185 ? -5.570 8.430 42.437 1.00 75.00 ? 185 LYS A CD 1 ATOM 1419 C CE . LYS A 1 185 ? -5.045 7.999 41.053 1.00 75.07 ? 185 LYS A CE 1 ATOM 1420 N NZ . LYS A 1 185 ? -6.037 8.204 39.934 1.00 76.60 ? 185 LYS A NZ 1 ATOM 1421 N N . GLN A 1 186 ? -6.435 6.403 47.266 1.00 72.54 ? 186 GLN A N 1 ATOM 1422 C CA . GLN A 1 186 ? -7.393 5.398 47.678 1.00 72.55 ? 186 GLN A CA 1 ATOM 1423 C C . GLN A 1 186 ? -8.742 5.986 47.403 1.00 73.08 ? 186 GLN A C 1 ATOM 1424 O O . GLN A 1 186 ? -9.064 7.045 47.943 1.00 73.24 ? 186 GLN A O 1 ATOM 1425 C CB . GLN A 1 186 ? -7.254 5.105 49.170 1.00 72.69 ? 186 GLN A CB 1 ATOM 1426 C CG . GLN A 1 186 ? -6.060 4.231 49.539 1.00 71.73 ? 186 GLN A CG 1 ATOM 1427 C CD . GLN A 1 186 ? -6.257 2.786 49.138 1.00 72.79 ? 186 GLN A CD 1 ATOM 1428 O OE1 . GLN A 1 186 ? -7.422 2.294 49.139 1.00 76.23 ? 186 GLN A OE1 1 ATOM 1429 N NE2 . GLN A 1 186 ? -5.141 2.099 48.778 1.00 69.72 ? 186 GLN A NE2 1 ATOM 1430 N N . GLU A 1 187 ? -9.516 5.301 46.565 1.00 73.00 ? 187 GLU A N 1 ATOM 1431 C CA . GLU A 1 187 ? -10.820 5.778 46.138 1.00 73.94 ? 187 GLU A CA 1 ATOM 1432 C C . GLU A 1 187 ? -11.919 4.732 46.429 1.00 73.50 ? 187 GLU A C 1 ATOM 1433 O O . GLU A 1 187 ? -11.726 3.542 46.199 1.00 73.58 ? 187 GLU A O 1 ATOM 1434 C CB . GLU A 1 187 ? -10.773 6.107 44.659 1.00 74.20 ? 187 GLU A CB 1 ATOM 1435 C CG . GLU A 1 187 ? -11.394 7.445 44.333 1.00 77.39 ? 187 GLU A CG 1 ATOM 1436 C CD . GLU A 1 187 ? -10.356 8.537 44.179 1.00 80.19 ? 187 GLU A CD 1 ATOM 1437 O OE1 . GLU A 1 187 ? -9.752 8.578 43.096 1.00 83.34 ? 187 GLU A OE1 1 ATOM 1438 O OE2 . GLU A 1 187 ? -10.148 9.351 45.113 1.00 81.27 ? 187 GLU A OE2 1 ATOM 1439 N N . LYS A 1 188 ? -13.067 5.183 46.929 1.00 73.43 ? 188 LYS A N 1 ATOM 1440 C CA . LYS A 1 188 ? -14.082 4.273 47.495 1.00 73.44 ? 188 LYS A CA 1 ATOM 1441 C C . LYS A 1 188 ? -15.102 3.836 46.490 1.00 73.89 ? 188 LYS A C 1 ATOM 1442 O O . LYS A 1 188 ? -15.649 4.673 45.781 1.00 74.51 ? 188 LYS A O 1 ATOM 1443 C CB . LYS A 1 188 ? -14.812 4.923 48.696 1.00 73.60 ? 188 LYS A CB 1 ATOM 1444 C CG . LYS A 1 188 ? -13.865 5.456 49.801 1.00 72.66 ? 188 LYS A CG 1 ATOM 1445 C CD . LYS A 1 188 ? -14.640 6.061 50.950 1.00 73.08 ? 188 LYS A CD 1 ATOM 1446 C CE . LYS A 1 188 ? -13.698 6.446 52.102 1.00 71.81 ? 188 LYS A CE 1 ATOM 1447 N NZ . LYS A 1 188 ? -14.455 6.938 53.266 1.00 71.66 ? 188 LYS A NZ 1 ATOM 1448 N N . PRO A 1 189 ? -15.374 2.536 46.437 1.00 73.71 ? 189 PRO A N 1 ATOM 1449 C CA . PRO A 1 189 ? -16.351 2.009 45.524 1.00 73.74 ? 189 PRO A CA 1 ATOM 1450 C C . PRO A 1 189 ? -17.731 2.425 46.032 1.00 74.51 ? 189 PRO A C 1 ATOM 1451 O O . PRO A 1 189 ? -17.911 2.595 47.249 1.00 74.30 ? 189 PRO A O 1 ATOM 1452 C CB . PRO A 1 189 ? -16.190 0.495 45.675 1.00 73.53 ? 189 PRO A CB 1 ATOM 1453 C CG . PRO A 1 189 ? -15.712 0.309 47.019 1.00 73.73 ? 189 PRO A CG 1 ATOM 1454 C CD . PRO A 1 189 ? -14.783 1.482 47.275 1.00 74.05 ? 189 PRO A CD 1 ATOM 1455 N N . VAL A 1 190 ? -18.676 2.607 45.111 1.00 74.37 ? 190 VAL A N 1 ATOM 1456 C CA . VAL A 1 190 ? -20.089 2.825 45.431 1.00 74.41 ? 190 VAL A CA 1 ATOM 1457 C C . VAL A 1 190 ? -20.768 1.651 44.689 1.00 73.32 ? 190 VAL A C 1 ATOM 1458 O O . VAL A 1 190 ? -20.446 1.368 43.551 1.00 73.37 ? 190 VAL A O 1 ATOM 1459 C CB . VAL A 1 190 ? -20.600 4.217 44.949 1.00 74.72 ? 190 VAL A CB 1 ATOM 1460 C CG1 . VAL A 1 190 ? -22.158 4.288 44.926 1.00 75.87 ? 190 VAL A CG1 1 ATOM 1461 C CG2 . VAL A 1 190 ? -19.994 5.370 45.791 1.00 75.42 ? 190 VAL A CG2 1 ATOM 1462 N N . ALA A 1 191 ? -21.692 0.968 45.346 1.00 73.23 ? 191 ALA A N 1 ATOM 1463 C CA . ALA A 1 191 ? -22.341 -0.222 44.767 1.00 71.86 ? 191 ALA A CA 1 ATOM 1464 C C . ALA A 1 191 ? -23.819 -0.005 44.656 1.00 71.67 ? 191 ALA A C 1 ATOM 1465 O O . ALA A 1 191 ? -24.400 0.809 45.365 1.00 72.16 ? 191 ALA A O 1 ATOM 1466 C CB . ALA A 1 191 ? -22.061 -1.455 45.602 1.00 71.95 ? 191 ALA A CB 1 ATOM 1467 N N . TRP A 1 192 ? -24.435 -0.729 43.754 1.00 70.77 ? 192 TRP A N 1 ATOM 1468 C CA . TRP A 1 192 ? -25.841 -0.651 43.642 1.00 70.72 ? 192 TRP A CA 1 ATOM 1469 C C . TRP A 1 192 ? -26.277 -1.962 43.048 1.00 70.38 ? 192 TRP A C 1 ATOM 1470 O O . TRP A 1 192 ? -25.488 -2.618 42.405 1.00 70.93 ? 192 TRP A O 1 ATOM 1471 C CB . TRP A 1 192 ? -26.285 0.600 42.851 1.00 71.04 ? 192 TRP A CB 1 ATOM 1472 C CG . TRP A 1 192 ? -25.971 0.696 41.357 1.00 70.27 ? 192 TRP A CG 1 ATOM 1473 C CD1 . TRP A 1 192 ? -26.789 0.322 40.311 1.00 69.52 ? 192 TRP A CD1 1 ATOM 1474 C CD2 . TRP A 1 192 ? -24.786 1.217 40.757 1.00 69.02 ? 192 TRP A CD2 1 ATOM 1475 N NE1 . TRP A 1 192 ? -26.168 0.564 39.109 1.00 68.93 ? 192 TRP A NE1 1 ATOM 1476 C CE2 . TRP A 1 192 ? -24.941 1.125 39.356 1.00 70.47 ? 192 TRP A CE2 1 ATOM 1477 C CE3 . TRP A 1 192 ? -23.596 1.756 41.258 1.00 69.29 ? 192 TRP A CE3 1 ATOM 1478 C CZ2 . TRP A 1 192 ? -23.955 1.546 38.478 1.00 70.44 ? 192 TRP A CZ2 1 ATOM 1479 C CZ3 . TRP A 1 192 ? -22.637 2.162 40.377 1.00 68.71 ? 192 TRP A CZ3 1 ATOM 1480 C CH2 . TRP A 1 192 ? -22.809 2.059 39.025 1.00 68.59 ? 192 TRP A CH2 1 ATOM 1481 N N . LEU A 1 193 ? -27.521 -2.332 43.285 1.00 70.31 ? 193 LEU A N 1 ATOM 1482 C CA . LEU A 1 193 ? -28.070 -3.613 42.855 1.00 70.52 ? 193 LEU A CA 1 ATOM 1483 C C . LEU A 1 193 ? -29.112 -3.464 41.761 1.00 70.84 ? 193 LEU A C 1 ATOM 1484 O O . LEU A 1 193 ? -29.805 -2.449 41.656 1.00 70.11 ? 193 LEU A O 1 ATOM 1485 C CB . LEU A 1 193 ? -28.744 -4.340 44.021 1.00 70.06 ? 193 LEU A CB 1 ATOM 1486 C CG . LEU A 1 193 ? -27.949 -4.659 45.278 1.00 69.79 ? 193 LEU A CG 1 ATOM 1487 C CD1 . LEU A 1 193 ? -28.724 -5.625 46.150 1.00 67.79 ? 193 LEU A CD1 1 ATOM 1488 C CD2 . LEU A 1 193 ? -26.594 -5.222 44.897 1.00 69.28 ? 193 LEU A CD2 1 ATOM 1489 N N . SER A 1 194 ? -29.211 -4.501 40.942 1.00 71.56 ? 194 SER A N 1 ATOM 1490 C CA . SER A 1 194 ? -30.252 -4.596 39.937 1.00 72.76 ? 194 SER A CA 1 ATOM 1491 C C . SER A 1 194 ? -30.498 -6.062 39.583 1.00 72.52 ? 194 SER A C 1 ATOM 1492 O O . SER A 1 194 ? -29.821 -6.959 40.086 1.00 71.43 ? 194 SER A O 1 ATOM 1493 C CB . SER A 1 194 ? -29.894 -3.781 38.690 1.00 73.57 ? 194 SER A CB 1 ATOM 1494 O OG . SER A 1 194 ? -28.574 -4.069 38.269 1.00 77.44 ? 194 SER A OG 1 ATOM 1495 N N . SER A 1 195 ? -31.475 -6.296 38.725 1.00 72.58 ? 195 SER A N 1 ATOM 1496 C CA . SER A 1 195 ? -31.710 -7.634 38.244 1.00 73.94 ? 195 SER A CA 1 ATOM 1497 C C . SER A 1 195 ? -32.258 -7.579 36.860 1.00 74.57 ? 195 SER A C 1 ATOM 1498 O O . SER A 1 195 ? -32.804 -6.546 36.438 1.00 74.61 ? 195 SER A O 1 ATOM 1499 C CB . SER A 1 195 ? -32.703 -8.391 39.120 1.00 74.22 ? 195 SER A CB 1 ATOM 1500 O OG . SER A 1 195 ? -33.987 -7.796 39.059 1.00 75.73 ? 195 SER A OG 1 ATOM 1501 N N . VAL A 1 196 ? -32.103 -8.711 36.173 1.00 75.26 ? 196 VAL A N 1 ATOM 1502 C CA . VAL A 1 196 ? -32.611 -8.906 34.829 1.00 75.97 ? 196 VAL A CA 1 ATOM 1503 C C . VAL A 1 196 ? -33.397 -10.240 34.748 1.00 76.77 ? 196 VAL A C 1 ATOM 1504 O O . VAL A 1 196 ? -32.999 -11.252 35.339 1.00 76.53 ? 196 VAL A O 1 ATOM 1505 C CB . VAL A 1 196 ? -31.488 -8.782 33.736 1.00 76.29 ? 196 VAL A CB 1 ATOM 1506 C CG1 . VAL A 1 196 ? -30.806 -7.385 33.781 1.00 76.38 ? 196 VAL A CG1 1 ATOM 1507 C CG2 . VAL A 1 196 ? -30.426 -9.848 33.887 1.00 76.94 ? 196 VAL A CG2 1 ATOM 1508 N N . PRO A 1 197 ? -34.519 -10.210 34.027 1.00 76.92 ? 197 PRO A N 1 ATOM 1509 C CA . PRO A 1 197 ? -35.349 -11.390 33.756 1.00 77.80 ? 197 PRO A CA 1 ATOM 1510 C C . PRO A 1 197 ? -34.632 -12.599 33.119 1.00 77.94 ? 197 PRO A C 1 ATOM 1511 O O . PRO A 1 197 ? -33.582 -12.440 32.500 1.00 78.56 ? 197 PRO A O 1 ATOM 1512 C CB . PRO A 1 197 ? -36.379 -10.847 32.766 1.00 78.35 ? 197 PRO A CB 1 ATOM 1513 C CG . PRO A 1 197 ? -35.738 -9.538 32.256 1.00 77.40 ? 197 PRO A CG 1 ATOM 1514 C CD . PRO A 1 197 ? -35.079 -8.986 33.422 1.00 76.62 ? 197 PRO A CD 1 ATOM 1515 N N . GLY A 1 202 ? -38.960 -19.065 35.319 1.00 76.47 ? 202 GLY A N 1 ATOM 1516 C CA . GLY A 1 202 ? -38.761 -17.700 35.806 1.00 76.58 ? 202 GLY A CA 1 ATOM 1517 C C . GLY A 1 202 ? -37.468 -17.439 36.588 1.00 76.70 ? 202 GLY A C 1 ATOM 1518 O O . GLY A 1 202 ? -37.509 -17.079 37.769 1.00 76.52 ? 202 GLY A O 1 ATOM 1519 N N . HIS A 1 203 ? -36.317 -17.615 35.944 1.00 76.33 ? 203 HIS A N 1 ATOM 1520 C CA . HIS A 1 203 ? -35.051 -17.418 36.623 1.00 76.27 ? 203 HIS A CA 1 ATOM 1521 C C . HIS A 1 203 ? -34.619 -15.987 36.363 1.00 76.50 ? 203 HIS A C 1 ATOM 1522 O O . HIS A 1 203 ? -34.990 -15.417 35.337 1.00 76.81 ? 203 HIS A O 1 ATOM 1523 C CB . HIS A 1 203 ? -34.005 -18.433 36.143 1.00 76.48 ? 203 HIS A CB 1 ATOM 1524 C CG . HIS A 1 203 ? -34.305 -19.853 36.545 1.00 77.50 ? 203 HIS A CG 1 ATOM 1525 N ND1 . HIS A 1 203 ? -35.262 -20.621 35.917 1.00 79.61 ? 203 HIS A ND1 1 ATOM 1526 C CD2 . HIS A 1 203 ? -33.771 -20.641 37.510 1.00 77.57 ? 203 HIS A CD2 1 ATOM 1527 C CE1 . HIS A 1 203 ? -35.308 -21.820 36.475 1.00 80.01 ? 203 HIS A CE1 1 ATOM 1528 N NE2 . HIS A 1 203 ? -34.413 -21.856 37.446 1.00 80.42 ? 203 HIS A NE2 1 ATOM 1529 N N . ARG A 1 204 ? -33.852 -15.397 37.276 1.00 75.97 ? 204 ARG A N 1 ATOM 1530 C CA . ARG A 1 204 ? -33.388 -14.011 37.078 1.00 76.53 ? 204 ARG A CA 1 ATOM 1531 C C . ARG A 1 204 ? -31.912 -13.892 37.325 1.00 75.70 ? 204 ARG A C 1 ATOM 1532 O O . ARG A 1 204 ? -31.291 -14.754 37.935 1.00 76.21 ? 204 ARG A O 1 ATOM 1533 C CB . ARG A 1 204 ? -34.098 -13.009 37.999 1.00 76.09 ? 204 ARG A CB 1 ATOM 1534 C CG . ARG A 1 204 ? -35.617 -13.044 37.967 1.00 78.21 ? 204 ARG A CG 1 ATOM 1535 C CD . ARG A 1 204 ? -36.249 -11.847 38.620 1.00 78.02 ? 204 ARG A CD 1 ATOM 1536 N NE . ARG A 1 204 ? -35.915 -10.628 37.884 1.00 82.82 ? 204 ARG A NE 1 ATOM 1537 C CZ . ARG A 1 204 ? -36.059 -9.387 38.358 1.00 84.89 ? 204 ARG A CZ 1 ATOM 1538 N NH1 . ARG A 1 204 ? -36.534 -9.176 39.592 1.00 85.74 ? 204 ARG A NH1 1 ATOM 1539 N NH2 . ARG A 1 204 ? -35.721 -8.350 37.593 1.00 83.81 ? 204 ARG A NH2 1 ATOM 1540 N N . GLN A 1 205 ? -31.333 -12.814 36.851 1.00 75.17 ? 205 GLN A N 1 ATOM 1541 C CA . GLN A 1 205 ? -29.964 -12.615 37.170 1.00 74.81 ? 205 GLN A CA 1 ATOM 1542 C C . GLN A 1 205 ? -29.851 -11.386 38.037 1.00 74.01 ? 205 GLN A C 1 ATOM 1543 O O . GLN A 1 205 ? -30.289 -10.300 37.663 1.00 73.76 ? 205 GLN A O 1 ATOM 1544 C CB . GLN A 1 205 ? -29.111 -12.517 35.914 1.00 75.31 ? 205 GLN A CB 1 ATOM 1545 C CG . GLN A 1 205 ? -27.648 -12.652 36.205 1.00 76.46 ? 205 GLN A CG 1 ATOM 1546 C CD . GLN A 1 205 ? -26.808 -12.208 35.051 1.00 78.59 ? 205 GLN A CD 1 ATOM 1547 O OE1 . GLN A 1 205 ? -26.150 -11.177 35.119 1.00 78.44 ? 205 GLN A OE1 1 ATOM 1548 N NE2 . GLN A 1 205 ? -26.827 -12.977 33.982 1.00 77.55 ? 205 GLN A NE2 1 ATOM 1549 N N . LEU A 1 206 ? -29.265 -11.580 39.205 1.00 72.99 ? 206 LEU A N 1 ATOM 1550 C CA . LEU A 1 206 ? -28.998 -10.489 40.101 1.00 73.05 ? 206 LEU A CA 1 ATOM 1551 C C . LEU A 1 206 ? -27.633 -9.862 39.774 1.00 73.24 ? 206 LEU A C 1 ATOM 1552 O O . LEU A 1 206 ? -26.650 -10.572 39.614 1.00 72.83 ? 206 LEU A O 1 ATOM 1553 C CB . LEU A 1 206 ? -29.062 -10.995 41.546 1.00 73.35 ? 206 LEU A CB 1 ATOM 1554 C CG . LEU A 1 206 ? -30.352 -10.910 42.372 1.00 71.99 ? 206 LEU A CG 1 ATOM 1555 C CD1 . LEU A 1 206 ? -31.638 -11.113 41.602 1.00 71.50 ? 206 LEU A CD1 1 ATOM 1556 C CD2 . LEU A 1 206 ? -30.251 -11.884 43.507 1.00 71.56 ? 206 LEU A CD2 1 ATOM 1557 N N . VAL A 1 207 ? -27.589 -8.532 39.673 1.00 73.85 ? 207 VAL A N 1 ATOM 1558 C CA . VAL A 1 207 ? -26.357 -7.806 39.335 1.00 74.26 ? 207 VAL A CA 1 ATOM 1559 C C . VAL A 1 207 ? -25.922 -6.788 40.410 1.00 75.25 ? 207 VAL A C 1 ATOM 1560 O O . VAL A 1 207 ? -26.653 -5.878 40.778 1.00 75.26 ? 207 VAL A O 1 ATOM 1561 C CB . VAL A 1 207 ? -26.454 -7.130 37.914 1.00 74.48 ? 207 VAL A CB 1 ATOM 1562 C CG1 . VAL A 1 207 ? -25.089 -6.650 37.422 1.00 73.94 ? 207 VAL A CG1 1 ATOM 1563 C CG2 . VAL A 1 207 ? -27.036 -8.117 36.870 1.00 73.90 ? 207 VAL A CG2 1 ATOM 1564 N N . CYS A 1 208 ? -24.714 -6.963 40.909 1.00 75.74 ? 208 CYS A N 1 ATOM 1565 C CA . CYS A 1 208 ? -24.185 -6.041 41.841 1.00 76.09 ? 208 CYS A CA 1 ATOM 1566 C C . CYS A 1 208 ? -23.160 -5.199 41.090 1.00 76.09 ? 208 CYS A C 1 ATOM 1567 O O . CYS A 1 208 ? -22.136 -5.738 40.684 1.00 76.12 ? 208 CYS A O 1 ATOM 1568 C CB . CYS A 1 208 ? -23.492 -6.819 42.938 1.00 76.25 ? 208 CYS A CB 1 ATOM 1569 S SG . CYS A 1 208 ? -22.830 -5.734 44.205 1.00 78.46 ? 208 CYS A SG 1 ATOM 1570 N N . HIS A 1 209 ? -23.436 -3.901 40.905 1.00 74.90 ? 209 HIS A N 1 ATOM 1571 C CA . HIS A 1 209 ? -22.529 -3.002 40.199 1.00 74.41 ? 209 HIS A CA 1 ATOM 1572 C C . HIS A 1 209 ? -21.657 -2.299 41.228 1.00 74.61 ? 209 HIS A C 1 ATOM 1573 O O . HIS A 1 209 ? -22.152 -1.894 42.269 1.00 75.49 ? 209 HIS A O 1 ATOM 1574 C CB . HIS A 1 209 ? -23.277 -1.905 39.461 1.00 74.28 ? 209 HIS A CB 1 ATOM 1575 C CG . HIS A 1 209 ? -24.407 -2.377 38.610 1.00 72.56 ? 209 HIS A CG 1 ATOM 1576 N ND1 . HIS A 1 209 ? -24.321 -2.454 37.242 1.00 73.23 ? 209 HIS A ND1 1 ATOM 1577 C CD2 . HIS A 1 209 ? -25.658 -2.779 38.929 1.00 76.03 ? 209 HIS A CD2 1 ATOM 1578 C CE1 . HIS A 1 209 ? -25.468 -2.891 36.750 1.00 74.82 ? 209 HIS A CE1 1 ATOM 1579 N NE2 . HIS A 1 209 ? -26.302 -3.093 37.753 1.00 73.50 ? 209 HIS A NE2 1 ATOM 1580 N N . VAL A 1 210 ? -20.372 -2.146 40.934 1.00 73.98 ? 210 VAL A N 1 ATOM 1581 C CA . VAL A 1 210 ? -19.400 -1.586 41.875 1.00 73.50 ? 210 VAL A CA 1 ATOM 1582 C C . VAL A 1 210 ? -18.512 -0.637 41.113 1.00 73.33 ? 210 VAL A C 1 ATOM 1583 O O . VAL A 1 210 ? -17.739 -1.056 40.270 1.00 73.68 ? 210 VAL A O 1 ATOM 1584 C CB . VAL A 1 210 ? -18.530 -2.695 42.470 1.00 73.81 ? 210 VAL A CB 1 ATOM 1585 C CG1 . VAL A 1 210 ? -17.614 -2.153 43.593 1.00 72.07 ? 210 VAL A CG1 1 ATOM 1586 C CG2 . VAL A 1 210 ? -19.414 -3.816 43.000 1.00 75.29 ? 210 VAL A CG2 1 ATOM 1587 N N . SER A 1 211 ? -18.608 0.650 41.400 1.00 72.94 ? 211 SER A N 1 ATOM 1588 C CA . SER A 1 211 ? -17.866 1.602 40.602 1.00 72.29 ? 211 SER A CA 1 ATOM 1589 C C . SER A 1 211 ? -17.219 2.744 41.332 1.00 71.71 ? 211 SER A C 1 ATOM 1590 O O . SER A 1 211 ? -17.693 3.178 42.388 1.00 71.15 ? 211 SER A O 1 ATOM 1591 C CB . SER A 1 211 ? -18.759 2.241 39.571 1.00 73.41 ? 211 SER A CB 1 ATOM 1592 O OG . SER A 1 211 ? -18.069 3.355 39.029 1.00 73.67 ? 211 SER A OG 1 ATOM 1593 N N . GLY A 1 212 ? -16.137 3.226 40.731 1.00 70.25 ? 212 GLY A N 1 ATOM 1594 C CA . GLY A 1 212 ? -15.468 4.411 41.216 1.00 69.87 ? 212 GLY A CA 1 ATOM 1595 C C . GLY A 1 212 ? -14.342 4.134 42.185 1.00 68.82 ? 212 GLY A C 1 ATOM 1596 O O . GLY A 1 212 ? -13.847 5.057 42.841 1.00 68.75 ? 212 GLY A O 1 ATOM 1597 N N . PHE A 1 213 ? -13.933 2.868 42.265 1.00 67.94 ? 213 PHE A N 1 ATOM 1598 C CA . PHE A 1 213 ? -12.851 2.447 43.183 1.00 67.05 ? 213 PHE A CA 1 ATOM 1599 C C . PHE A 1 213 ? -11.405 2.481 42.653 1.00 66.09 ? 213 PHE A C 1 ATOM 1600 O O . PHE A 1 213 ? -11.179 2.352 41.470 1.00 64.26 ? 213 PHE A O 1 ATOM 1601 C CB . PHE A 1 213 ? -13.176 1.055 43.788 1.00 67.55 ? 213 PHE A CB 1 ATOM 1602 C CG . PHE A 1 213 ? -13.336 -0.051 42.772 1.00 67.88 ? 213 PHE A CG 1 ATOM 1603 C CD1 . PHE A 1 213 ? -14.578 -0.296 42.172 1.00 68.35 ? 213 PHE A CD1 1 ATOM 1604 C CD2 . PHE A 1 213 ? -12.242 -0.853 42.419 1.00 68.74 ? 213 PHE A CD2 1 ATOM 1605 C CE1 . PHE A 1 213 ? -14.733 -1.298 41.254 1.00 68.61 ? 213 PHE A CE1 1 ATOM 1606 C CE2 . PHE A 1 213 ? -12.387 -1.879 41.477 1.00 68.43 ? 213 PHE A CE2 1 ATOM 1607 C CZ . PHE A 1 213 ? -13.639 -2.100 40.896 1.00 69.43 ? 213 PHE A CZ 1 ATOM 1608 N N . TYR A 1 214 ? -10.422 2.654 43.568 1.00 65.74 ? 214 TYR A N 1 ATOM 1609 C CA . TYR A 1 214 ? -9.018 2.641 43.242 1.00 65.53 ? 214 TYR A CA 1 ATOM 1610 C C . TYR A 1 214 ? -8.144 2.473 44.536 1.00 66.19 ? 214 TYR A C 1 ATOM 1611 O O . TYR A 1 214 ? -8.439 3.100 45.540 1.00 63.90 ? 214 TYR A O 1 ATOM 1612 C CB . TYR A 1 214 ? -8.638 3.912 42.467 1.00 66.93 ? 214 TYR A CB 1 ATOM 1613 C CG . TYR A 1 214 ? -7.215 3.880 41.906 1.00 69.89 ? 214 TYR A CG 1 ATOM 1614 C CD1 . TYR A 1 214 ? -6.135 4.352 42.663 1.00 70.72 ? 214 TYR A CD1 1 ATOM 1615 C CD2 . TYR A 1 214 ? -6.952 3.365 40.632 1.00 71.00 ? 214 TYR A CD2 1 ATOM 1616 C CE1 . TYR A 1 214 ? -4.859 4.320 42.170 1.00 71.60 ? 214 TYR A CE1 1 ATOM 1617 C CE2 . TYR A 1 214 ? -5.661 3.330 40.132 1.00 70.07 ? 214 TYR A CE2 1 ATOM 1618 C CZ . TYR A 1 214 ? -4.634 3.806 40.908 1.00 71.23 ? 214 TYR A CZ 1 ATOM 1619 O OH . TYR A 1 214 ? -3.353 3.779 40.428 1.00 71.58 ? 214 TYR A OH 1 ATOM 1620 N N . PRO A 1 215 ? -7.085 1.655 44.518 1.00 67.04 ? 215 PRO A N 1 ATOM 1621 C CA . PRO A 1 215 ? -6.605 0.915 43.337 1.00 68.31 ? 215 PRO A CA 1 ATOM 1622 C C . PRO A 1 215 ? -7.519 -0.216 42.815 1.00 70.57 ? 215 PRO A C 1 ATOM 1623 O O . PRO A 1 215 ? -8.600 -0.486 43.385 1.00 70.79 ? 215 PRO A O 1 ATOM 1624 C CB . PRO A 1 215 ? -5.271 0.333 43.825 1.00 69.13 ? 215 PRO A CB 1 ATOM 1625 C CG . PRO A 1 215 ? -4.943 1.092 45.097 1.00 67.50 ? 215 PRO A CG 1 ATOM 1626 C CD . PRO A 1 215 ? -6.243 1.399 45.712 1.00 67.19 ? 215 PRO A CD 1 ATOM 1627 N N . LYS A 1 216 ? -7.075 -0.870 41.739 1.00 71.93 ? 216 LYS A N 1 ATOM 1628 C CA . LYS A 1 216 ? -7.829 -1.961 41.088 1.00 73.26 ? 216 LYS A CA 1 ATOM 1629 C C . LYS A 1 216 ? -8.267 -3.166 41.977 1.00 73.20 ? 216 LYS A C 1 ATOM 1630 O O . LYS A 1 216 ? -9.410 -3.577 41.871 1.00 74.09 ? 216 LYS A O 1 ATOM 1631 C CB . LYS A 1 216 ? -7.115 -2.426 39.793 1.00 73.17 ? 216 LYS A CB 1 ATOM 1632 C CG . LYS A 1 216 ? -8.090 -2.853 38.677 1.00 74.59 ? 216 LYS A CG 1 ATOM 1633 C CD . LYS A 1 216 ? -7.459 -2.971 37.274 1.00 75.37 ? 216 LYS A CD 1 ATOM 1634 C CE . LYS A 1 216 ? -6.925 -4.378 36.961 1.00 80.47 ? 216 LYS A CE 1 ATOM 1635 N NZ . LYS A 1 216 ? -6.184 -4.493 35.651 1.00 78.09 ? 216 LYS A NZ 1 ATOM 1636 N N . PRO A 1 217 ? -7.411 -3.737 42.834 1.00 72.72 ? 217 PRO A N 1 ATOM 1637 C CA . PRO A 1 217 ? -7.799 -4.914 43.634 1.00 72.73 ? 217 PRO A CA 1 ATOM 1638 C C . PRO A 1 217 ? -9.106 -4.780 44.440 1.00 73.21 ? 217 PRO A C 1 ATOM 1639 O O . PRO A 1 217 ? -9.240 -3.870 45.269 1.00 72.92 ? 217 PRO A O 1 ATOM 1640 C CB . PRO A 1 217 ? -6.612 -5.102 44.599 1.00 72.55 ? 217 PRO A CB 1 ATOM 1641 C CG . PRO A 1 217 ? -5.453 -4.487 43.918 1.00 72.22 ? 217 PRO A CG 1 ATOM 1642 C CD . PRO A 1 217 ? -6.021 -3.334 43.106 1.00 73.09 ? 217 PRO A CD 1 ATOM 1643 N N . VAL A 1 218 ? -10.053 -5.690 44.191 1.00 73.57 ? 218 VAL A N 1 ATOM 1644 C CA . VAL A 1 218 ? -11.352 -5.668 44.862 1.00 73.92 ? 218 VAL A CA 1 ATOM 1645 C C . VAL A 1 218 ? -11.995 -7.043 45.043 1.00 74.16 ? 218 VAL A C 1 ATOM 1646 O O . VAL A 1 218 ? -11.683 -8.008 44.341 1.00 74.42 ? 218 VAL A O 1 ATOM 1647 C CB . VAL A 1 218 ? -12.327 -4.736 44.166 1.00 73.71 ? 218 VAL A CB 1 ATOM 1648 C CG1 . VAL A 1 218 ? -13.363 -4.280 45.117 1.00 73.65 ? 218 VAL A CG1 1 ATOM 1649 C CG2 . VAL A 1 218 ? -11.619 -3.521 43.719 1.00 75.64 ? 218 VAL A CG2 1 ATOM 1650 N N . TRP A 1 219 ? -12.904 -7.105 46.010 1.00 74.40 ? 219 TRP A N 1 ATOM 1651 C CA . TRP A 1 219 ? -13.596 -8.331 46.381 1.00 74.76 ? 219 TRP A CA 1 ATOM 1652 C C . TRP A 1 219 ? -15.080 -8.045 46.422 1.00 74.22 ? 219 TRP A C 1 ATOM 1653 O O . TRP A 1 219 ? -15.525 -7.238 47.214 1.00 74.41 ? 219 TRP A O 1 ATOM 1654 C CB . TRP A 1 219 ? -13.107 -8.783 47.754 1.00 74.73 ? 219 TRP A CB 1 ATOM 1655 C CG . TRP A 1 219 ? -13.547 -10.142 48.217 1.00 75.44 ? 219 TRP A CG 1 ATOM 1656 C CD1 . TRP A 1 219 ? -12.852 -11.311 48.095 1.00 76.25 ? 219 TRP A CD1 1 ATOM 1657 C CD2 . TRP A 1 219 ? -14.773 -10.478 48.894 1.00 75.88 ? 219 TRP A CD2 1 ATOM 1658 N NE1 . TRP A 1 219 ? -13.565 -12.352 48.647 1.00 76.90 ? 219 TRP A NE1 1 ATOM 1659 C CE2 . TRP A 1 219 ? -14.747 -11.874 49.144 1.00 75.79 ? 219 TRP A CE2 1 ATOM 1660 C CE3 . TRP A 1 219 ? -15.895 -9.742 49.313 1.00 75.17 ? 219 TRP A CE3 1 ATOM 1661 C CZ2 . TRP A 1 219 ? -15.790 -12.548 49.789 1.00 75.65 ? 219 TRP A CZ2 1 ATOM 1662 C CZ3 . TRP A 1 219 ? -16.936 -10.410 49.954 1.00 76.15 ? 219 TRP A CZ3 1 ATOM 1663 C CH2 . TRP A 1 219 ? -16.872 -11.804 50.186 1.00 76.10 ? 219 TRP A CH2 1 ATOM 1664 N N . VAL A 1 220 ? -15.828 -8.711 45.551 1.00 74.27 ? 220 VAL A N 1 ATOM 1665 C CA . VAL A 1 220 ? -17.277 -8.584 45.478 1.00 74.57 ? 220 VAL A CA 1 ATOM 1666 C C . VAL A 1 220 ? -17.792 -10.009 45.468 1.00 74.97 ? 220 VAL A C 1 ATOM 1667 O O . VAL A 1 220 ? -17.165 -10.869 44.849 1.00 75.16 ? 220 VAL A O 1 ATOM 1668 C CB . VAL A 1 220 ? -17.751 -7.870 44.193 1.00 74.45 ? 220 VAL A CB 1 ATOM 1669 C CG1 . VAL A 1 220 ? -19.224 -7.530 44.289 1.00 72.78 ? 220 VAL A CG1 1 ATOM 1670 C CG2 . VAL A 1 220 ? -16.940 -6.602 43.932 1.00 74.85 ? 220 VAL A CG2 1 ATOM 1671 N N . MET A 1 221 ? -18.916 -10.250 46.150 1.00 74.90 ? 221 MET A N 1 ATOM 1672 C CA . MET A 1 221 ? -19.520 -11.578 46.274 1.00 75.21 ? 221 MET A CA 1 ATOM 1673 C C . MET A 1 221 ? -20.976 -11.515 46.728 1.00 74.83 ? 221 MET A C 1 ATOM 1674 O O . MET A 1 221 ? -21.319 -10.745 47.630 1.00 75.26 ? 221 MET A O 1 ATOM 1675 C CB . MET A 1 221 ? -18.766 -12.419 47.307 1.00 75.27 ? 221 MET A CB 1 ATOM 1676 C CG . MET A 1 221 ? -17.510 -13.090 46.843 1.00 78.84 ? 221 MET A CG 1 ATOM 1677 S SD . MET A 1 221 ? -17.771 -14.561 45.839 1.00 83.91 ? 221 MET A SD 1 ATOM 1678 C CE . MET A 1 221 ? -19.141 -15.309 46.717 1.00 84.49 ? 221 MET A CE 1 ATOM 1679 N N . TRP A 1 222 ? -21.839 -12.320 46.110 1.00 74.19 ? 222 TRP A N 1 ATOM 1680 C CA . TRP A 1 222 ? -23.198 -12.494 46.636 1.00 73.23 ? 222 TRP A CA 1 ATOM 1681 C C . TRP A 1 222 ? -23.082 -13.430 47.850 1.00 73.05 ? 222 TRP A C 1 ATOM 1682 O O . TRP A 1 222 ? -22.306 -14.402 47.826 1.00 72.58 ? 222 TRP A O 1 ATOM 1683 C CB . TRP A 1 222 ? -24.187 -13.008 45.574 1.00 72.70 ? 222 TRP A CB 1 ATOM 1684 C CG . TRP A 1 222 ? -24.576 -11.931 44.642 1.00 71.60 ? 222 TRP A CG 1 ATOM 1685 C CD1 . TRP A 1 222 ? -23.985 -11.620 43.461 1.00 70.55 ? 222 TRP A CD1 1 ATOM 1686 C CD2 . TRP A 1 222 ? -25.648 -10.998 44.816 1.00 70.23 ? 222 TRP A CD2 1 ATOM 1687 N NE1 . TRP A 1 222 ? -24.624 -10.551 42.880 1.00 68.92 ? 222 TRP A NE1 1 ATOM 1688 C CE2 . TRP A 1 222 ? -25.650 -10.146 43.694 1.00 70.85 ? 222 TRP A CE2 1 ATOM 1689 C CE3 . TRP A 1 222 ? -26.615 -10.795 45.810 1.00 70.13 ? 222 TRP A CE3 1 ATOM 1690 C CZ2 . TRP A 1 222 ? -26.581 -9.098 43.536 1.00 70.29 ? 222 TRP A CZ2 1 ATOM 1691 C CZ3 . TRP A 1 222 ? -27.536 -9.758 45.649 1.00 70.39 ? 222 TRP A CZ3 1 ATOM 1692 C CH2 . TRP A 1 222 ? -27.509 -8.924 44.518 1.00 70.31 ? 222 TRP A CH2 1 ATOM 1693 N N . MET A 1 223 ? -23.845 -13.107 48.899 1.00 72.62 ? 223 MET A N 1 ATOM 1694 C CA . MET A 1 223 ? -23.795 -13.803 50.186 1.00 72.54 ? 223 MET A CA 1 ATOM 1695 C C . MET A 1 223 ? -25.195 -14.179 50.640 1.00 72.02 ? 223 MET A C 1 ATOM 1696 O O . MET A 1 223 ? -26.166 -13.485 50.348 1.00 71.99 ? 223 MET A O 1 ATOM 1697 C CB . MET A 1 223 ? -23.179 -12.900 51.270 1.00 73.08 ? 223 MET A CB 1 ATOM 1698 C CG . MET A 1 223 ? -21.781 -12.341 50.989 1.00 73.29 ? 223 MET A CG 1 ATOM 1699 S SD . MET A 1 223 ? -20.519 -13.585 51.254 1.00 77.11 ? 223 MET A SD 1 ATOM 1700 C CE . MET A 1 223 ? -20.263 -13.523 53.027 1.00 72.30 ? 223 MET A CE 1 ATOM 1701 N N . ARG A 1 224 ? -25.286 -15.282 51.356 1.00 71.40 ? 224 ARG A N 1 ATOM 1702 C CA . ARG A 1 224 ? -26.519 -15.689 51.974 1.00 71.56 ? 224 ARG A CA 1 ATOM 1703 C C . ARG A 1 224 ? -26.137 -15.889 53.423 1.00 71.30 ? 224 ARG A C 1 ATOM 1704 O O . ARG A 1 224 ? -25.818 -16.996 53.841 1.00 71.23 ? 224 ARG A O 1 ATOM 1705 C CB . ARG A 1 224 ? -27.013 -16.983 51.360 1.00 71.83 ? 224 ARG A CB 1 ATOM 1706 C CG . ARG A 1 224 ? -28.474 -17.154 51.504 1.00 72.33 ? 224 ARG A CG 1 ATOM 1707 C CD . ARG A 1 224 ? -29.009 -18.299 50.727 1.00 73.34 ? 224 ARG A CD 1 ATOM 1708 N NE . ARG A 1 224 ? -30.343 -17.949 50.274 1.00 73.39 ? 224 ARG A NE 1 ATOM 1709 C CZ . ARG A 1 224 ? -30.686 -17.783 49.012 1.00 73.50 ? 224 ARG A CZ 1 ATOM 1710 N NH1 . ARG A 1 224 ? -29.810 -17.940 48.035 1.00 74.27 ? 224 ARG A NH1 1 ATOM 1711 N NH2 . ARG A 1 224 ? -31.930 -17.462 48.725 1.00 75.41 ? 224 ARG A NH2 1 ATOM 1712 N N . GLY A 1 225 ? -26.170 -14.800 54.183 1.00 71.07 ? 225 GLY A N 1 ATOM 1713 C CA . GLY A 1 225 ? -25.629 -14.788 55.530 1.00 70.82 ? 225 GLY A CA 1 ATOM 1714 C C . GLY A 1 225 ? -24.127 -14.700 55.378 1.00 71.10 ? 225 GLY A C 1 ATOM 1715 O O . GLY A 1 225 ? -23.610 -13.768 54.751 1.00 70.99 ? 225 GLY A O 1 ATOM 1716 N N . ASP A 1 226 ? -23.429 -15.676 55.951 1.00 71.40 ? 226 ASP A N 1 ATOM 1717 C CA . ASP A 1 226 ? -21.979 -15.802 55.804 1.00 71.65 ? 226 ASP A CA 1 ATOM 1718 C C . ASP A 1 226 ? -21.608 -16.881 54.781 1.00 71.65 ? 226 ASP A C 1 ATOM 1719 O O . ASP A 1 226 ? -20.459 -17.315 54.723 1.00 71.71 ? 226 ASP A O 1 ATOM 1720 C CB . ASP A 1 226 ? -21.317 -16.090 57.161 1.00 71.71 ? 226 ASP A CB 1 ATOM 1721 C CG . ASP A 1 226 ? -21.168 -14.840 58.026 1.00 72.36 ? 226 ASP A CG 1 ATOM 1722 O OD1 . ASP A 1 226 ? -21.021 -13.721 57.478 1.00 74.30 ? 226 ASP A OD1 1 ATOM 1723 O OD2 . ASP A 1 226 ? -21.178 -14.874 59.271 1.00 72.18 ? 226 ASP A OD2 1 ATOM 1724 N N . GLN A 1 227 ? -22.582 -17.313 53.982 1.00 71.69 ? 227 GLN A N 1 ATOM 1725 C CA . GLN A 1 227 ? -22.328 -18.285 52.927 1.00 71.71 ? 227 GLN A CA 1 ATOM 1726 C C . GLN A 1 227 ? -22.035 -17.515 51.666 1.00 71.78 ? 227 GLN A C 1 ATOM 1727 O O . GLN A 1 227 ? -22.938 -16.892 51.104 1.00 71.11 ? 227 GLN A O 1 ATOM 1728 C CB . GLN A 1 227 ? -23.533 -19.200 52.674 1.00 71.57 ? 227 GLN A CB 1 ATOM 1729 C CG . GLN A 1 227 ? -23.869 -20.168 53.783 1.00 72.69 ? 227 GLN A CG 1 ATOM 1730 C CD . GLN A 1 227 ? -22.935 -21.382 53.849 1.00 73.19 ? 227 GLN A CD 1 ATOM 1731 O OE1 . GLN A 1 227 ? -21.969 -21.489 53.084 1.00 72.01 ? 227 GLN A OE1 1 ATOM 1732 N NE2 . GLN A 1 227 ? -23.230 -22.298 54.773 1.00 72.58 ? 227 GLN A NE2 1 ATOM 1733 N N . GLU A 1 228 ? -20.770 -17.561 51.234 1.00 72.13 ? 228 GLU A N 1 ATOM 1734 C CA . GLU A 1 228 ? -20.346 -16.996 49.964 1.00 72.27 ? 228 GLU A CA 1 ATOM 1735 C C . GLU A 1 228 ? -21.084 -17.795 48.916 1.00 71.49 ? 228 GLU A C 1 ATOM 1736 O O . GLU A 1 228 ? -21.068 -19.017 48.959 1.00 70.84 ? 228 GLU A O 1 ATOM 1737 C CB . GLU A 1 228 ? -18.844 -17.192 49.755 1.00 72.38 ? 228 GLU A CB 1 ATOM 1738 C CG . GLU A 1 228 ? -17.931 -16.141 50.374 1.00 73.41 ? 228 GLU A CG 1 ATOM 1739 C CD . GLU A 1 228 ? -16.433 -16.413 50.145 1.00 74.25 ? 228 GLU A CD 1 ATOM 1740 O OE1 . GLU A 1 228 ? -15.621 -15.924 50.963 1.00 77.49 ? 228 GLU A OE1 1 ATOM 1741 O OE2 . GLU A 1 228 ? -16.041 -17.111 49.164 1.00 76.67 ? 228 GLU A OE2 1 ATOM 1742 N N . GLN A 1 229 ? -21.735 -17.114 47.980 1.00 71.24 ? 229 GLN A N 1 ATOM 1743 C CA . GLN A 1 229 ? -22.433 -17.829 46.924 1.00 70.94 ? 229 GLN A CA 1 ATOM 1744 C C . GLN A 1 229 ? -21.483 -18.153 45.773 1.00 71.30 ? 229 GLN A C 1 ATOM 1745 O O . GLN A 1 229 ? -21.172 -17.291 44.938 1.00 71.31 ? 229 GLN A O 1 ATOM 1746 C CB . GLN A 1 229 ? -23.658 -17.076 46.406 1.00 70.59 ? 229 GLN A CB 1 ATOM 1747 C CG . GLN A 1 229 ? -24.714 -16.707 47.442 1.00 68.76 ? 229 GLN A CG 1 ATOM 1748 C CD . GLN A 1 229 ? -25.262 -17.900 48.207 1.00 65.40 ? 229 GLN A CD 1 ATOM 1749 O OE1 . GLN A 1 229 ? -24.624 -18.390 49.121 1.00 64.47 ? 229 GLN A OE1 1 ATOM 1750 N NE2 . GLN A 1 229 ? -26.446 -18.352 47.839 1.00 62.65 ? 229 GLN A NE2 1 ATOM 1751 N N . GLN A 1 230 ? -21.015 -19.396 45.738 1.00 70.86 ? 230 GLN A N 1 ATOM 1752 C CA . GLN A 1 230 ? -20.225 -19.877 44.607 1.00 71.17 ? 230 GLN A CA 1 ATOM 1753 C C . GLN A 1 230 ? -21.171 -19.744 43.420 1.00 71.38 ? 230 GLN A C 1 ATOM 1754 O O . GLN A 1 230 ? -22.370 -19.984 43.557 1.00 72.18 ? 230 GLN A O 1 ATOM 1755 C CB . GLN A 1 230 ? -19.799 -21.333 44.822 1.00 70.63 ? 230 GLN A CB 1 ATOM 1756 C CG . GLN A 1 230 ? -20.949 -22.306 45.021 1.00 70.33 ? 230 GLN A CG 1 ATOM 1757 C CD . GLN A 1 230 ? -20.497 -23.708 45.463 1.00 71.00 ? 230 GLN A CD 1 ATOM 1758 O OE1 . GLN A 1 230 ? -19.486 -24.228 44.981 1.00 70.47 ? 230 GLN A OE1 1 ATOM 1759 N NE2 . GLN A 1 230 ? -21.254 -24.316 46.384 1.00 69.89 ? 230 GLN A NE2 1 ATOM 1760 N N . GLY A 1 231 ? -20.680 -19.356 42.258 1.00 71.06 ? 231 GLY A N 1 ATOM 1761 C CA . GLY A 1 231 ? -21.629 -19.135 41.177 1.00 70.70 ? 231 GLY A CA 1 ATOM 1762 C C . GLY A 1 231 ? -21.850 -17.656 40.989 1.00 70.40 ? 231 GLY A C 1 ATOM 1763 O O . GLY A 1 231 ? -22.469 -17.226 40.017 1.00 69.78 ? 231 GLY A O 1 ATOM 1764 N N . THR A 1 232 ? -21.343 -16.883 41.944 1.00 70.58 ? 232 THR A N 1 ATOM 1765 C CA . THR A 1 232 ? -21.155 -15.467 41.746 1.00 70.35 ? 232 THR A CA 1 ATOM 1766 C C . THR A 1 232 ? -20.140 -15.406 40.600 1.00 70.67 ? 232 THR A C 1 ATOM 1767 O O . THR A 1 232 ? -19.057 -15.968 40.699 1.00 69.97 ? 232 THR A O 1 ATOM 1768 C CB . THR A 1 232 ? -20.552 -14.829 42.995 1.00 69.98 ? 232 THR A CB 1 ATOM 1769 O OG1 . THR A 1 232 ? -21.536 -14.807 44.019 1.00 67.33 ? 232 THR A OG1 1 ATOM 1770 C CG2 . THR A 1 232 ? -20.221 -13.327 42.752 1.00 71.11 ? 232 THR A CG2 1 ATOM 1771 N N . HIS A 1 233 ? -20.516 -14.731 39.524 1.00 71.43 ? 233 HIS A N 1 ATOM 1772 C CA . HIS A 1 233 ? -19.659 -14.536 38.371 1.00 72.54 ? 233 HIS A CA 1 ATOM 1773 C C . HIS A 1 233 ? -19.188 -13.070 38.274 1.00 72.54 ? 233 HIS A C 1 ATOM 1774 O O . HIS A 1 233 ? -19.997 -12.178 38.146 1.00 72.30 ? 233 HIS A O 1 ATOM 1775 C CB . HIS A 1 233 ? -20.396 -14.982 37.102 1.00 72.54 ? 233 HIS A CB 1 ATOM 1776 C CG . HIS A 1 233 ? -20.716 -16.453 37.073 1.00 75.05 ? 233 HIS A CG 1 ATOM 1777 N ND1 . HIS A 1 233 ? -19.751 -17.435 37.199 1.00 77.60 ? 233 HIS A ND1 1 ATOM 1778 C CD2 . HIS A 1 233 ? -21.893 -17.109 36.927 1.00 76.10 ? 233 HIS A CD2 1 ATOM 1779 C CE1 . HIS A 1 233 ? -20.317 -18.628 37.139 1.00 77.27 ? 233 HIS A CE1 1 ATOM 1780 N NE2 . HIS A 1 233 ? -21.617 -18.459 36.973 1.00 77.72 ? 233 HIS A NE2 1 ATOM 1781 N N . ARG A 1 234 ? -17.874 -12.850 38.345 1.00 73.45 ? 234 ARG A N 1 ATOM 1782 C CA . ARG A 1 234 ? -17.257 -11.521 38.202 1.00 74.16 ? 234 ARG A CA 1 ATOM 1783 C C . ARG A 1 234 ? -17.142 -11.102 36.761 1.00 73.67 ? 234 ARG A C 1 ATOM 1784 O O . ARG A 1 234 ? -16.698 -11.878 35.916 1.00 72.92 ? 234 ARG A O 1 ATOM 1785 C CB . ARG A 1 234 ? -15.838 -11.496 38.777 1.00 74.95 ? 234 ARG A CB 1 ATOM 1786 C CG . ARG A 1 234 ? -15.745 -10.991 40.182 1.00 78.34 ? 234 ARG A CG 1 ATOM 1787 C CD . ARG A 1 234 ? -14.482 -11.402 40.940 1.00 83.87 ? 234 ARG A CD 1 ATOM 1788 N NE . ARG A 1 234 ? -14.719 -11.160 42.372 1.00 88.54 ? 234 ARG A NE 1 ATOM 1789 C CZ . ARG A 1 234 ? -13.977 -11.636 43.379 1.00 92.24 ? 234 ARG A CZ 1 ATOM 1790 N NH1 . ARG A 1 234 ? -12.913 -12.411 43.138 1.00 94.15 ? 234 ARG A NH1 1 ATOM 1791 N NH2 . ARG A 1 234 ? -14.302 -11.339 44.639 1.00 92.43 ? 234 ARG A NH2 1 ATOM 1792 N N . GLY A 1 235 ? -17.536 -9.863 36.482 1.00 73.43 ? 235 GLY A N 1 ATOM 1793 C CA . GLY A 1 235 ? -17.341 -9.305 35.143 1.00 73.93 ? 235 GLY A CA 1 ATOM 1794 C C . GLY A 1 235 ? -15.880 -8.906 34.980 1.00 73.92 ? 235 GLY A C 1 ATOM 1795 O O . GLY A 1 235 ? -15.056 -9.236 35.834 1.00 73.66 ? 235 GLY A O 1 ATOM 1796 N N . ASP A 1 236 ? -15.555 -8.212 33.889 1.00 73.91 ? 236 ASP A N 1 ATOM 1797 C CA . ASP A 1 236 ? -14.222 -7.660 33.705 1.00 73.97 ? 236 ASP A CA 1 ATOM 1798 C C . ASP A 1 236 ? -14.131 -6.274 34.336 1.00 73.93 ? 236 ASP A C 1 ATOM 1799 O O . ASP A 1 236 ? -15.143 -5.595 34.581 1.00 74.16 ? 236 ASP A O 1 ATOM 1800 C CB . ASP A 1 236 ? -13.909 -7.491 32.228 1.00 74.75 ? 236 ASP A CB 1 ATOM 1801 C CG . ASP A 1 236 ? -13.699 -8.805 31.498 1.00 76.69 ? 236 ASP A CG 1 ATOM 1802 O OD1 . ASP A 1 236 ? -13.290 -9.823 32.108 1.00 79.33 ? 236 ASP A OD1 1 ATOM 1803 O OD2 . ASP A 1 236 ? -13.921 -8.891 30.276 1.00 78.42 ? 236 ASP A OD2 1 ATOM 1804 N N . PHE A 1 237 ? -12.904 -5.849 34.594 1.00 73.19 ? 237 PHE A N 1 ATOM 1805 C CA . PHE A 1 237 ? -12.666 -4.502 35.052 1.00 73.02 ? 237 PHE A CA 1 ATOM 1806 C C . PHE A 1 237 ? -12.865 -3.546 33.888 1.00 72.27 ? 237 PHE A C 1 ATOM 1807 O O . PHE A 1 237 ? -12.256 -3.704 32.863 1.00 71.55 ? 237 PHE A O 1 ATOM 1808 C CB . PHE A 1 237 ? -11.251 -4.367 35.596 1.00 73.58 ? 237 PHE A CB 1 ATOM 1809 C CG . PHE A 1 237 ? -11.066 -4.997 36.934 1.00 73.94 ? 237 PHE A CG 1 ATOM 1810 C CD1 . PHE A 1 237 ? -11.346 -4.276 38.092 1.00 73.58 ? 237 PHE A CD1 1 ATOM 1811 C CD2 . PHE A 1 237 ? -10.614 -6.311 37.042 1.00 75.96 ? 237 PHE A CD2 1 ATOM 1812 C CE1 . PHE A 1 237 ? -11.177 -4.855 39.344 1.00 74.67 ? 237 PHE A CE1 1 ATOM 1813 C CE2 . PHE A 1 237 ? -10.439 -6.903 38.291 1.00 75.89 ? 237 PHE A CE2 1 ATOM 1814 C CZ . PHE A 1 237 ? -10.724 -6.174 39.442 1.00 74.82 ? 237 PHE A CZ 1 ATOM 1815 N N . LEU A 1 238 ? -13.726 -2.557 34.070 1.00 71.68 ? 238 LEU A N 1 ATOM 1816 C CA . LEU A 1 238 ? -13.976 -1.593 33.046 1.00 71.96 ? 238 LEU A CA 1 ATOM 1817 C C . LEU A 1 238 ? -13.527 -0.234 33.564 1.00 72.34 ? 238 LEU A C 1 ATOM 1818 O O . LEU A 1 238 ? -13.855 0.148 34.670 1.00 71.66 ? 238 LEU A O 1 ATOM 1819 C CB . LEU A 1 238 ? -15.460 -1.589 32.684 1.00 72.77 ? 238 LEU A CB 1 ATOM 1820 C CG . LEU A 1 238 ? -16.133 -2.965 32.464 1.00 72.07 ? 238 LEU A CG 1 ATOM 1821 C CD1 . LEU A 1 238 ? -17.603 -2.812 32.172 1.00 73.13 ? 238 LEU A CD1 1 ATOM 1822 C CD2 . LEU A 1 238 ? -15.488 -3.735 31.361 1.00 75.64 ? 238 LEU A CD2 1 ATOM 1823 N N . PRO A 1 239 ? -12.781 0.507 32.757 1.00 72.37 ? 239 PRO A N 1 ATOM 1824 C CA . PRO A 1 239 ? -12.259 1.767 33.218 1.00 72.29 ? 239 PRO A CA 1 ATOM 1825 C C . PRO A 1 239 ? -13.389 2.799 33.287 1.00 73.07 ? 239 PRO A C 1 ATOM 1826 O O . PRO A 1 239 ? -14.396 2.696 32.550 1.00 71.78 ? 239 PRO A O 1 ATOM 1827 C CB . PRO A 1 239 ? -11.223 2.136 32.150 1.00 71.91 ? 239 PRO A CB 1 ATOM 1828 C CG . PRO A 1 239 ? -11.683 1.401 30.886 1.00 72.90 ? 239 PRO A CG 1 ATOM 1829 C CD . PRO A 1 239 ? -12.408 0.197 31.362 1.00 72.35 ? 239 PRO A CD 1 ATOM 1830 N N . ASN A 1 240 ? -13.213 3.752 34.185 1.00 71.90 ? 240 ASN A N 1 ATOM 1831 C CA . ASN A 1 240 ? -13.961 4.998 34.179 1.00 72.48 ? 240 ASN A CA 1 ATOM 1832 C C . ASN A 1 240 ? -12.986 6.115 33.744 1.00 71.97 ? 240 ASN A C 1 ATOM 1833 O O . ASN A 1 240 ? -11.780 5.974 33.936 1.00 72.35 ? 240 ASN A O 1 ATOM 1834 C CB . ASN A 1 240 ? -14.519 5.326 35.564 1.00 71.23 ? 240 ASN A CB 1 ATOM 1835 C CG . ASN A 1 240 ? -15.705 4.480 35.934 1.00 72.33 ? 240 ASN A CG 1 ATOM 1836 O OD1 . ASN A 1 240 ? -16.594 4.243 35.110 1.00 76.16 ? 240 ASN A OD1 1 ATOM 1837 N ND2 . ASN A 1 240 ? -15.735 4.016 37.162 1.00 71.90 ? 240 ASN A ND2 1 ATOM 1838 N N . ALA A 1 241 ? -13.514 7.201 33.176 1.00 71.66 ? 241 ALA A N 1 ATOM 1839 C CA . ALA A 1 241 ? -12.737 8.362 32.722 1.00 72.64 ? 241 ALA A CA 1 ATOM 1840 C C . ALA A 1 241 ? -11.763 8.958 33.752 1.00 73.31 ? 241 ALA A C 1 ATOM 1841 O O . ALA A 1 241 ? -10.683 9.462 33.386 1.00 74.92 ? 241 ALA A O 1 ATOM 1842 C CB . ALA A 1 241 ? -13.674 9.429 32.274 1.00 73.19 ? 241 ALA A CB 1 ATOM 1843 N N . ASP A 1 242 ? -12.129 8.913 35.029 1.00 73.09 ? 242 ASP A N 1 ATOM 1844 C CA . ASP A 1 242 ? -11.299 9.546 36.099 1.00 73.35 ? 242 ASP A CA 1 ATOM 1845 C C . ASP A 1 242 ? -10.343 8.562 36.703 1.00 73.41 ? 242 ASP A C 1 ATOM 1846 O O . ASP A 1 242 ? -9.872 8.768 37.815 1.00 75.57 ? 242 ASP A O 1 ATOM 1847 C CB . ASP A 1 242 ? -12.207 10.097 37.182 1.00 72.58 ? 242 ASP A CB 1 ATOM 1848 C CG . ASP A 1 242 ? -13.177 9.029 37.760 1.00 75.57 ? 242 ASP A CG 1 ATOM 1849 O OD1 . ASP A 1 242 ? -13.434 7.948 37.151 1.00 78.38 ? 242 ASP A OD1 1 ATOM 1850 O OD2 . ASP A 1 242 ? -13.751 9.198 38.844 1.00 76.13 ? 242 ASP A OD2 1 ATOM 1851 N N . GLU A 1 243 ? -10.058 7.482 35.977 1.00 74.01 ? 243 GLU A N 1 ATOM 1852 C CA . GLU A 1 243 ? -9.092 6.448 36.382 1.00 73.85 ? 243 GLU A CA 1 ATOM 1853 C C . GLU A 1 243 ? -9.476 5.726 37.683 1.00 73.63 ? 243 GLU A C 1 ATOM 1854 O O . GLU A 1 243 ? -8.622 5.461 38.549 1.00 73.59 ? 243 GLU A O 1 ATOM 1855 C CB . GLU A 1 243 ? -7.705 7.076 36.530 1.00 74.21 ? 243 GLU A CB 1 ATOM 1856 C CG . GLU A 1 243 ? -7.341 8.119 35.463 1.00 76.19 ? 243 GLU A CG 1 ATOM 1857 C CD . GLU A 1 243 ? -6.378 9.198 36.007 1.00 80.68 ? 243 GLU A CD 1 ATOM 1858 O OE1 . GLU A 1 243 ? -5.695 8.968 37.049 1.00 78.44 ? 243 GLU A OE1 1 ATOM 1859 O OE2 . GLU A 1 243 ? -6.308 10.289 35.395 1.00 80.58 ? 243 GLU A OE2 1 ATOM 1860 N N . THR A 1 244 ? -10.761 5.437 37.821 1.00 72.40 ? 244 THR A N 1 ATOM 1861 C CA . THR A 1 244 ? -11.300 4.596 38.870 1.00 72.14 ? 244 THR A CA 1 ATOM 1862 C C . THR A 1 244 ? -11.812 3.386 38.095 1.00 72.85 ? 244 THR A C 1 ATOM 1863 O O . THR A 1 244 ? -11.920 3.437 36.856 1.00 72.14 ? 244 THR A O 1 ATOM 1864 C CB . THR A 1 244 ? -12.513 5.260 39.570 1.00 72.00 ? 244 THR A CB 1 ATOM 1865 O OG1 . THR A 1 244 ? -13.538 5.570 38.598 1.00 73.64 ? 244 THR A OG1 1 ATOM 1866 C CG2 . THR A 1 244 ? -12.169 6.583 40.156 1.00 71.25 ? 244 THR A CG2 1 ATOM 1867 N N . TRP A 1 245 ? -12.155 2.300 38.780 1.00 72.77 ? 245 TRP A N 1 ATOM 1868 C CA . TRP A 1 245 ? -12.673 1.152 38.025 1.00 72.97 ? 245 TRP A CA 1 ATOM 1869 C C . TRP A 1 245 ? -14.167 0.896 38.171 1.00 72.54 ? 245 TRP A C 1 ATOM 1870 O O . TRP A 1 245 ? -14.859 1.492 38.976 1.00 73.36 ? 245 TRP A O 1 ATOM 1871 C CB . TRP A 1 245 ? -11.869 -0.081 38.425 1.00 73.35 ? 245 TRP A CB 1 ATOM 1872 C CG . TRP A 1 245 ? -10.478 0.049 37.990 1.00 73.57 ? 245 TRP A CG 1 ATOM 1873 C CD1 . TRP A 1 245 ? -9.398 0.438 38.745 1.00 73.61 ? 245 TRP A CD1 1 ATOM 1874 C CD2 . TRP A 1 245 ? -9.986 -0.201 36.679 1.00 72.79 ? 245 TRP A CD2 1 ATOM 1875 N NE1 . TRP A 1 245 ? -8.264 0.442 37.972 1.00 71.98 ? 245 TRP A NE1 1 ATOM 1876 C CE2 . TRP A 1 245 ? -8.602 0.057 36.694 1.00 74.19 ? 245 TRP A CE2 1 ATOM 1877 C CE3 . TRP A 1 245 ? -10.583 -0.611 35.475 1.00 75.74 ? 245 TRP A CE3 1 ATOM 1878 C CZ2 . TRP A 1 245 ? -7.806 -0.092 35.557 1.00 73.79 ? 245 TRP A CZ2 1 ATOM 1879 C CZ3 . TRP A 1 245 ? -9.793 -0.760 34.348 1.00 73.93 ? 245 TRP A CZ3 1 ATOM 1880 C CH2 . TRP A 1 245 ? -8.427 -0.501 34.398 1.00 74.06 ? 245 TRP A CH2 1 ATOM 1881 N N . TYR A 1 246 ? -14.666 -0.016 37.380 1.00 73.09 ? 246 TYR A N 1 ATOM 1882 C CA . TYR A 1 246 ? -16.033 -0.420 37.478 1.00 72.43 ? 246 TYR A CA 1 ATOM 1883 C C . TYR A 1 246 ? -15.946 -1.913 37.359 1.00 73.03 ? 246 TYR A C 1 ATOM 1884 O O . TYR A 1 246 ? -15.077 -2.430 36.663 1.00 72.14 ? 246 TYR A O 1 ATOM 1885 C CB . TYR A 1 246 ? -16.813 0.132 36.322 1.00 72.59 ? 246 TYR A CB 1 ATOM 1886 C CG . TYR A 1 246 ? -18.232 -0.403 36.138 1.00 70.94 ? 246 TYR A CG 1 ATOM 1887 C CD1 . TYR A 1 246 ? -19.321 0.344 36.559 1.00 73.45 ? 246 TYR A CD1 1 ATOM 1888 C CD2 . TYR A 1 246 ? -18.483 -1.635 35.531 1.00 71.77 ? 246 TYR A CD2 1 ATOM 1889 C CE1 . TYR A 1 246 ? -20.649 -0.102 36.399 1.00 71.62 ? 246 TYR A CE1 1 ATOM 1890 C CE2 . TYR A 1 246 ? -19.800 -2.098 35.364 1.00 72.12 ? 246 TYR A CE2 1 ATOM 1891 C CZ . TYR A 1 246 ? -20.880 -1.322 35.797 1.00 72.94 ? 246 TYR A CZ 1 ATOM 1892 O OH . TYR A 1 246 ? -22.194 -1.735 35.649 1.00 71.88 ? 246 TYR A OH 1 ATOM 1893 N N . LEU A 1 247 ? -16.846 -2.596 38.057 1.00 73.42 ? 247 LEU A N 1 ATOM 1894 C CA . LEU A 1 247 ? -16.884 -4.035 38.049 1.00 74.53 ? 247 LEU A CA 1 ATOM 1895 C C . LEU A 1 247 ? -18.282 -4.397 38.449 1.00 74.11 ? 247 LEU A C 1 ATOM 1896 O O . LEU A 1 247 ? -18.864 -3.737 39.285 1.00 73.72 ? 247 LEU A O 1 ATOM 1897 C CB . LEU A 1 247 ? -15.913 -4.607 39.080 1.00 74.93 ? 247 LEU A CB 1 ATOM 1898 C CG . LEU A 1 247 ? -15.874 -6.144 39.157 1.00 77.48 ? 247 LEU A CG 1 ATOM 1899 C CD1 . LEU A 1 247 ? -15.012 -6.748 38.087 1.00 75.69 ? 247 LEU A CD1 1 ATOM 1900 C CD2 . LEU A 1 247 ? -15.345 -6.606 40.502 1.00 79.17 ? 247 LEU A CD2 1 ATOM 1901 N N . GLN A 1 248 ? -18.830 -5.431 37.848 1.00 73.00 ? 248 GLN A N 1 ATOM 1902 C CA . GLN A 1 248 ? -20.076 -5.957 38.362 1.00 73.16 ? 248 GLN A CA 1 ATOM 1903 C C . GLN A 1 248 ? -19.953 -7.461 38.557 1.00 72.60 ? 248 GLN A C 1 ATOM 1904 O O . GLN A 1 248 ? -19.184 -8.100 37.863 1.00 71.83 ? 248 GLN A O 1 ATOM 1905 C CB . GLN A 1 248 ? -21.270 -5.600 37.478 1.00 73.22 ? 248 GLN A CB 1 ATOM 1906 C CG . GLN A 1 248 ? -21.156 -6.105 36.103 1.00 74.22 ? 248 GLN A CG 1 ATOM 1907 C CD . GLN A 1 248 ? -22.305 -5.669 35.257 1.00 79.49 ? 248 GLN A CD 1 ATOM 1908 O OE1 . GLN A 1 248 ? -22.678 -4.473 35.244 1.00 79.09 ? 248 GLN A OE1 1 ATOM 1909 N NE2 . GLN A 1 248 ? -22.885 -6.630 34.528 1.00 77.58 ? 248 GLN A NE2 1 ATOM 1910 N N . ALA A 1 249 ? -20.716 -7.990 39.515 1.00 73.01 ? 249 ALA A N 1 ATOM 1911 C CA . ALA A 1 249 ? -20.768 -9.432 39.778 1.00 73.61 ? 249 ALA A CA 1 ATOM 1912 C C . ALA A 1 249 ? -22.227 -9.905 39.753 1.00 73.82 ? 249 ALA A C 1 ATOM 1913 O O . ALA A 1 249 ? -23.122 -9.256 40.288 1.00 74.18 ? 249 ALA A O 1 ATOM 1914 C CB . ALA A 1 249 ? -20.107 -9.776 41.082 1.00 73.37 ? 249 ALA A CB 1 ATOM 1915 N N . THR A 1 250 ? -22.458 -11.043 39.125 1.00 74.16 ? 250 THR A N 1 ATOM 1916 C CA . THR A 1 250 ? -23.809 -11.522 38.933 1.00 74.24 ? 250 THR A CA 1 ATOM 1917 C C . THR A 1 250 ? -24.082 -12.863 39.561 1.00 73.57 ? 250 THR A C 1 ATOM 1918 O O . THR A 1 250 ? -23.152 -13.623 39.831 1.00 74.02 ? 250 THR A O 1 ATOM 1919 C CB . THR A 1 250 ? -24.095 -11.603 37.444 1.00 74.36 ? 250 THR A CB 1 ATOM 1920 O OG1 . THR A 1 250 ? -23.186 -12.525 36.834 1.00 74.89 ? 250 THR A OG1 1 ATOM 1921 C CG2 . THR A 1 250 ? -23.759 -10.269 36.799 1.00 74.64 ? 250 THR A CG2 1 ATOM 1922 N N . LEU A 1 251 ? -25.368 -13.142 39.791 1.00 73.29 ? 251 LEU A N 1 ATOM 1923 C CA . LEU A 1 251 ? -25.800 -14.436 40.293 1.00 72.72 ? 251 LEU A CA 1 ATOM 1924 C C . LEU A 1 251 ? -27.110 -14.842 39.639 1.00 72.84 ? 251 LEU A C 1 ATOM 1925 O O . LEU A 1 251 ? -28.073 -14.062 39.630 1.00 72.67 ? 251 LEU A O 1 ATOM 1926 C CB . LEU A 1 251 ? -25.956 -14.401 41.821 1.00 73.27 ? 251 LEU A CB 1 ATOM 1927 C CG . LEU A 1 251 ? -26.276 -15.721 42.560 1.00 72.45 ? 251 LEU A CG 1 ATOM 1928 C CD1 . LEU A 1 251 ? -25.043 -16.619 42.648 1.00 72.17 ? 251 LEU A CD1 1 ATOM 1929 C CD2 . LEU A 1 251 ? -26.825 -15.467 43.957 1.00 72.02 ? 251 LEU A CD2 1 ATOM 1930 N N . ASP A 1 252 ? -27.139 -16.061 39.090 1.00 73.01 ? 252 ASP A N 1 ATOM 1931 C CA . ASP A 1 252 ? -28.368 -16.652 38.554 1.00 73.19 ? 252 ASP A CA 1 ATOM 1932 C C . ASP A 1 252 ? -29.189 -17.146 39.753 1.00 73.09 ? 252 ASP A C 1 ATOM 1933 O O . ASP A 1 252 ? -28.672 -17.849 40.626 1.00 72.37 ? 252 ASP A O 1 ATOM 1934 C CB . ASP A 1 252 ? -28.068 -17.801 37.585 1.00 73.41 ? 252 ASP A CB 1 ATOM 1935 C CG . ASP A 1 252 ? -27.410 -17.332 36.276 1.00 75.18 ? 252 ASP A CG 1 ATOM 1936 O OD1 . ASP A 1 252 ? -27.258 -18.174 35.352 1.00 77.45 ? 252 ASP A OD1 1 ATOM 1937 O OD2 . ASP A 1 252 ? -27.009 -16.168 36.058 1.00 75.12 ? 252 ASP A OD2 1 ATOM 1938 N N . VAL A 1 253 ? -30.461 -16.765 39.800 1.00 73.32 ? 253 VAL A N 1 ATOM 1939 C CA . VAL A 1 253 ? -31.331 -17.152 40.910 1.00 74.30 ? 253 VAL A CA 1 ATOM 1940 C C . VAL A 1 253 ? -32.706 -17.602 40.421 1.00 74.47 ? 253 VAL A C 1 ATOM 1941 O O . VAL A 1 253 ? -33.232 -17.042 39.460 1.00 74.73 ? 253 VAL A O 1 ATOM 1942 C CB . VAL A 1 253 ? -31.494 -16.007 41.989 1.00 74.47 ? 253 VAL A CB 1 ATOM 1943 C CG1 . VAL A 1 253 ? -30.145 -15.417 42.391 1.00 74.97 ? 253 VAL A CG1 1 ATOM 1944 C CG2 . VAL A 1 253 ? -32.417 -14.881 41.519 1.00 74.78 ? 253 VAL A CG2 1 ATOM 1945 N N . GLU A 1 254 ? -33.273 -18.610 41.081 1.00 74.74 ? 254 GLU A N 1 ATOM 1946 C CA . GLU A 1 254 ? -34.660 -19.032 40.834 1.00 75.55 ? 254 GLU A CA 1 ATOM 1947 C C . GLU A 1 254 ? -35.587 -18.052 41.571 1.00 75.87 ? 254 GLU A C 1 ATOM 1948 O O . GLU A 1 254 ? -35.157 -17.355 42.496 1.00 76.13 ? 254 GLU A O 1 ATOM 1949 C CB . GLU A 1 254 ? -34.789 -20.422 41.587 0.00 40.00 ? 254 GLU A CB 1 ATOM 1950 C CG . GLU A 1 254 ? -34.027 -21.560 40.916 0.00 40.00 ? 254 GLU A CG 1 ATOM 1951 C CD . GLU A 1 254 ? -34.043 -22.863 41.720 0.00 40.00 ? 254 GLU A CD 1 ATOM 1952 O OE1 . GLU A 1 254 ? -33.665 -22.851 42.923 0.00 40.00 ? 254 GLU A OE1 1 ATOM 1953 O OE2 . GLU A 1 254 ? -34.410 -23.919 41.137 0.00 40.00 ? 254 GLU A OE2 1 ATOM 1954 N N . ALA A 1 255 ? -36.850 -17.982 41.167 1.00 76.06 ? 255 ALA A N 1 ATOM 1955 C CA . ALA A 1 255 ? -37.810 -17.134 41.874 1.00 76.41 ? 255 ALA A CA 1 ATOM 1956 C C . ALA A 1 255 ? -37.880 -17.604 43.336 1.00 76.69 ? 255 ALA A C 1 ATOM 1957 O O . ALA A 1 255 ? -37.985 -18.805 43.603 1.00 76.72 ? 255 ALA A O 1 ATOM 1958 C CB . ALA A 1 255 ? -38.942 -16.921 41.333 0.00 40.00 ? 255 ALA A CB 1 ATOM 1959 N N . GLY A 1 256 ? -37.814 -16.662 44.279 1.00 76.96 ? 256 GLY A N 1 ATOM 1960 C CA . GLY A 1 256 ? -37.861 -16.999 45.719 1.00 76.80 ? 256 GLY A CA 1 ATOM 1961 C C . GLY A 1 256 ? -36.572 -17.648 46.205 1.00 76.52 ? 256 GLY A C 1 ATOM 1962 O O . GLY A 1 256 ? -36.569 -18.465 47.155 1.00 76.29 ? 256 GLY A O 1 ATOM 1963 N N . GLU A 1 257 ? -35.489 -17.277 45.522 1.00 75.25 ? 257 GLU A N 1 ATOM 1964 C CA . GLU A 1 257 ? -34.136 -17.632 45.873 1.00 74.50 ? 257 GLU A CA 1 ATOM 1965 C C . GLU A 1 257 ? -33.499 -16.274 46.160 1.00 74.19 ? 257 GLU A C 1 ATOM 1966 O O . GLU A 1 257 ? -32.411 -16.201 46.714 1.00 74.13 ? 257 GLU A O 1 ATOM 1967 C CB . GLU A 1 257 ? -33.234 -18.469 45.232 0.00 40.00 ? 257 GLU A CB 1 ATOM 1968 C CG . GLU A 1 257 ? -33.865 -19.844 45.088 0.00 40.00 ? 257 GLU A CG 1 ATOM 1969 C CD . GLU A 1 257 ? -33.994 -20.567 46.414 0.00 40.00 ? 257 GLU A CD 1 ATOM 1970 O OE1 . GLU A 1 257 ? -33.589 -19.992 47.457 0.00 40.00 ? 257 GLU A OE1 1 ATOM 1971 O OE2 . GLU A 1 257 ? -34.517 -21.701 46.423 0.00 40.00 ? 257 GLU A OE2 1 ATOM 1972 N N . GLU A 1 258 ? -34.212 -15.212 45.772 1.00 73.83 ? 258 GLU A N 1 ATOM 1973 C CA . GLU A 1 258 ? -33.799 -13.813 45.933 1.00 74.04 ? 258 GLU A CA 1 ATOM 1974 C C . GLU A 1 258 ? -33.725 -13.329 47.369 1.00 72.97 ? 258 GLU A C 1 ATOM 1975 O O . GLU A 1 258 ? -32.762 -12.652 47.752 1.00 72.69 ? 258 GLU A O 1 ATOM 1976 C CB . GLU A 1 258 ? -34.791 -12.891 45.215 1.00 74.71 ? 258 GLU A CB 1 ATOM 1977 C CG . GLU A 1 258 ? -34.790 -12.951 43.701 1.00 77.89 ? 258 GLU A CG 1 ATOM 1978 C CD . GLU A 1 258 ? -36.205 -13.011 43.146 1.00 81.98 ? 258 GLU A CD 1 ATOM 1979 O OE1 . GLU A 1 258 ? -37.109 -13.481 43.886 1.00 84.01 ? 258 GLU A OE1 1 ATOM 1980 O OE2 . GLU A 1 258 ? -36.421 -12.600 41.981 1.00 83.10 ? 258 GLU A OE2 1 ATOM 1981 N N . ALA A 1 259 ? -34.751 -13.663 48.153 1.00 71.72 ? 259 ALA A N 1 ATOM 1982 C CA . ALA A 1 259 ? -34.866 -13.172 49.525 1.00 71.07 ? 259 ALA A CA 1 ATOM 1983 C C . ALA A 1 259 ? -33.767 -13.763 50.391 1.00 70.51 ? 259 ALA A C 1 ATOM 1984 O O . ALA A 1 259 ? -33.541 -14.966 50.369 1.00 70.49 ? 259 ALA A O 1 ATOM 1985 C CB . ALA A 1 259 ? -36.251 -13.457 50.099 1.00 70.43 ? 259 ALA A CB 1 ATOM 1986 N N . GLY A 1 260 ? -33.086 -12.902 51.141 1.00 70.18 ? 260 GLY A N 1 ATOM 1987 C CA . GLY A 1 260 ? -31.995 -13.314 52.008 1.00 69.41 ? 260 GLY A CA 1 ATOM 1988 C C . GLY A 1 260 ? -30.615 -13.105 51.415 1.00 69.51 ? 260 GLY A C 1 ATOM 1989 O O . GLY A 1 260 ? -29.620 -13.388 52.068 1.00 69.45 ? 260 GLY A O 1 ATOM 1990 N N . LEU A 1 261 ? -30.542 -12.604 50.186 1.00 69.27 ? 261 LEU A N 1 ATOM 1991 C CA . LEU A 1 261 ? -29.255 -12.424 49.517 1.00 69.74 ? 261 LEU A CA 1 ATOM 1992 C C . LEU A 1 261 ? -28.730 -11.003 49.608 1.00 70.26 ? 261 LEU A C 1 ATOM 1993 O O . LEU A 1 261 ? -29.495 -10.049 49.594 1.00 70.47 ? 261 LEU A O 1 ATOM 1994 C CB . LEU A 1 261 ? -29.335 -12.829 48.045 1.00 69.16 ? 261 LEU A CB 1 ATOM 1995 C CG . LEU A 1 261 ? -29.507 -14.294 47.714 1.00 69.43 ? 261 LEU A CG 1 ATOM 1996 C CD1 . LEU A 1 261 ? -29.625 -14.423 46.217 1.00 69.17 ? 261 LEU A CD1 1 ATOM 1997 C CD2 . LEU A 1 261 ? -28.328 -15.086 48.247 1.00 69.00 ? 261 LEU A CD2 1 ATOM 1998 N N . ALA A 1 262 ? -27.410 -10.893 49.696 1.00 70.82 ? 262 ALA A N 1 ATOM 1999 C CA . ALA A 1 262 ? -26.717 -9.615 49.772 1.00 71.74 ? 262 ALA A CA 1 ATOM 2000 C C . ALA A 1 262 ? -25.419 -9.638 48.936 1.00 72.41 ? 262 ALA A C 1 ATOM 2001 O O . ALA A 1 262 ? -24.875 -10.695 48.629 1.00 71.49 ? 262 ALA A O 1 ATOM 2002 C CB . ALA A 1 262 ? -26.414 -9.244 51.247 1.00 71.15 ? 262 ALA A CB 1 ATOM 2003 N N . CYS A 1 263 ? -24.956 -8.448 48.583 1.00 73.86 ? 263 CYS A N 1 ATOM 2004 C CA . CYS A 1 263 ? -23.715 -8.256 47.901 1.00 74.80 ? 263 CYS A CA 1 ATOM 2005 C C . CYS A 1 263 ? -22.775 -7.690 48.932 1.00 74.95 ? 263 CYS A C 1 ATOM 2006 O O . CYS A 1 263 ? -23.131 -6.748 49.627 1.00 75.56 ? 263 CYS A O 1 ATOM 2007 C CB . CYS A 1 263 ? -23.878 -7.243 46.766 1.00 75.22 ? 263 CYS A CB 1 ATOM 2008 S SG . CYS A 1 263 ? -22.420 -7.085 45.691 1.00 77.23 ? 263 CYS A SG 1 ATOM 2009 N N . ARG A 1 264 ? -21.579 -8.265 49.041 1.00 74.68 ? 264 ARG A N 1 ATOM 2010 C CA . ARG A 1 264 ? -20.575 -7.776 49.985 1.00 74.19 ? 264 ARG A CA 1 ATOM 2011 C C . ARG A 1 264 ? -19.359 -7.279 49.206 1.00 73.47 ? 264 ARG A C 1 ATOM 2012 O O . ARG A 1 264 ? -18.786 -8.030 48.444 1.00 73.70 ? 264 ARG A O 1 ATOM 2013 C CB . ARG A 1 264 ? -20.163 -8.873 50.985 1.00 74.01 ? 264 ARG A CB 1 ATOM 2014 C CG . ARG A 1 264 ? -19.424 -8.323 52.185 1.00 74.17 ? 264 ARG A CG 1 ATOM 2015 C CD . ARG A 1 264 ? -19.084 -9.310 53.285 1.00 75.32 ? 264 ARG A CD 1 ATOM 2016 N NE . ARG A 1 264 ? -19.410 -8.718 54.586 1.00 78.35 ? 264 ARG A NE 1 ATOM 2017 C CZ . ARG A 1 264 ? -18.796 -8.961 55.730 1.00 78.43 ? 264 ARG A CZ 1 ATOM 2018 N NH1 . ARG A 1 264 ? -17.769 -9.807 55.794 1.00 79.27 ? 264 ARG A NH1 1 ATOM 2019 N NH2 . ARG A 1 264 ? -19.216 -8.340 56.824 1.00 78.57 ? 264 ARG A NH2 1 ATOM 2020 N N . VAL A 1 265 ? -18.976 -6.023 49.386 1.00 72.93 ? 265 VAL A N 1 ATOM 2021 C CA . VAL A 1 265 ? -17.751 -5.533 48.781 1.00 72.59 ? 265 VAL A CA 1 ATOM 2022 C C . VAL A 1 265 ? -16.648 -5.079 49.763 1.00 72.44 ? 265 VAL A C 1 ATOM 2023 O O . VAL A 1 265 ? -16.849 -4.216 50.621 1.00 72.43 ? 265 VAL A O 1 ATOM 2024 C CB . VAL A 1 265 ? -17.966 -4.565 47.573 1.00 72.81 ? 265 VAL A CB 1 ATOM 2025 C CG1 . VAL A 1 265 ? -19.236 -3.879 47.617 1.00 72.83 ? 265 VAL A CG1 1 ATOM 2026 C CG2 . VAL A 1 265 ? -16.776 -3.589 47.361 1.00 73.25 ? 265 VAL A CG2 1 ATOM 2027 N N . LYS A 1 266 ? -15.482 -5.686 49.612 1.00 71.59 ? 266 LYS A N 1 ATOM 2028 C CA . LYS A 1 266 ? -14.307 -5.285 50.366 1.00 71.65 ? 266 LYS A CA 1 ATOM 2029 C C . LYS A 1 266 ? -13.339 -4.555 49.431 1.00 71.06 ? 266 LYS A C 1 ATOM 2030 O O . LYS A 1 266 ? -13.129 -4.977 48.302 1.00 70.88 ? 266 LYS A O 1 ATOM 2031 C CB . LYS A 1 266 ? -13.628 -6.502 50.992 1.00 71.12 ? 266 LYS A CB 1 ATOM 2032 C CG . LYS A 1 266 ? -14.603 -7.439 51.665 1.00 71.35 ? 266 LYS A CG 1 ATOM 2033 C CD . LYS A 1 266 ? -13.888 -8.560 52.405 1.00 71.04 ? 266 LYS A CD 1 ATOM 2034 C CE . LYS A 1 266 ? -14.894 -9.483 53.070 1.00 69.91 ? 266 LYS A CE 1 ATOM 2035 N NZ . LYS A 1 266 ? -14.266 -10.320 54.125 1.00 68.08 ? 266 LYS A NZ 1 ATOM 2036 N N . HIS A 1 267 ? -12.772 -3.456 49.914 1.00 70.74 ? 267 HIS A N 1 ATOM 2037 C CA . HIS A 1 267 ? -11.765 -2.709 49.187 1.00 70.72 ? 267 HIS A CA 1 ATOM 2038 C C . HIS A 1 267 ? -10.818 -2.062 50.170 1.00 70.33 ? 267 HIS A C 1 ATOM 2039 O O . HIS A 1 267 ? -11.213 -1.747 51.282 1.00 70.57 ? 267 HIS A O 1 ATOM 2040 C CB . HIS A 1 267 ? -12.377 -1.641 48.285 1.00 70.79 ? 267 HIS A CB 1 ATOM 2041 C CG . HIS A 1 267 ? -11.380 -1.022 47.346 1.00 73.30 ? 267 HIS A CG 1 ATOM 2042 N ND1 . HIS A 1 267 ? -10.831 0.227 47.551 1.00 72.84 ? 267 HIS A ND1 1 ATOM 2043 C CD2 . HIS A 1 267 ? -10.823 -1.493 46.204 1.00 72.76 ? 267 HIS A CD2 1 ATOM 2044 C CE1 . HIS A 1 267 ? -9.987 0.498 46.573 1.00 71.39 ? 267 HIS A CE1 1 ATOM 2045 N NE2 . HIS A 1 267 ? -9.967 -0.528 45.744 1.00 73.09 ? 267 HIS A NE2 1 ATOM 2046 N N . SER A 1 268 ? -9.573 -1.860 49.757 1.00 69.74 ? 268 SER A N 1 ATOM 2047 C CA . SER A 1 268 ? -8.571 -1.243 50.607 1.00 69.56 ? 268 SER A CA 1 ATOM 2048 C C . SER A 1 268 ? -9.037 0.083 51.203 1.00 69.46 ? 268 SER A C 1 ATOM 2049 O O . SER A 1 268 ? -8.769 0.363 52.349 1.00 68.96 ? 268 SER A O 1 ATOM 2050 C CB . SER A 1 268 ? -7.277 -1.027 49.814 1.00 69.45 ? 268 SER A CB 1 ATOM 2051 O OG . SER A 1 268 ? -7.532 -0.216 48.679 1.00 69.84 ? 268 SER A OG 1 ATOM 2052 N N . SER A 1 269 ? -9.741 0.893 50.428 1.00 70.17 ? 269 SER A N 1 ATOM 2053 C CA . SER A 1 269 ? -10.142 2.231 50.871 1.00 71.39 ? 269 SER A CA 1 ATOM 2054 C C . SER A 1 269 ? -11.283 2.332 51.919 1.00 72.88 ? 269 SER A C 1 ATOM 2055 O O . SER A 1 269 ? -11.550 3.425 52.431 1.00 73.34 ? 269 SER A O 1 ATOM 2056 C CB . SER A 1 269 ? -10.524 3.066 49.661 1.00 71.18 ? 269 SER A CB 1 ATOM 2057 O OG . SER A 1 269 ? -11.707 2.566 49.100 1.00 69.73 ? 269 SER A OG 1 ATOM 2058 N N . LEU A 1 270 ? -11.942 1.216 52.237 1.00 73.56 ? 270 LEU A N 1 ATOM 2059 C CA . LEU A 1 270 ? -13.098 1.231 53.123 1.00 74.17 ? 270 LEU A CA 1 ATOM 2060 C C . LEU A 1 270 ? -12.762 1.102 54.606 1.00 74.86 ? 270 LEU A C 1 ATOM 2061 O O . LEU A 1 270 ? -13.636 1.215 55.476 1.00 74.45 ? 270 LEU A O 1 ATOM 2062 C CB . LEU A 1 270 ? -14.076 0.126 52.702 1.00 74.04 ? 270 LEU A CB 1 ATOM 2063 C CG . LEU A 1 270 ? -14.712 0.320 51.332 1.00 75.13 ? 270 LEU A CG 1 ATOM 2064 C CD1 . LEU A 1 270 ? -15.577 -0.879 50.969 1.00 75.41 ? 270 LEU A CD1 1 ATOM 2065 C CD2 . LEU A 1 270 ? -15.528 1.624 51.281 1.00 75.87 ? 270 LEU A CD2 1 ATOM 2066 N N . GLY A 1 271 ? -11.490 0.873 54.895 1.00 75.90 ? 271 GLY A N 1 ATOM 2067 C CA . GLY A 1 271 ? -11.079 0.575 56.268 1.00 76.58 ? 271 GLY A CA 1 ATOM 2068 C C . GLY A 1 271 ? -11.395 -0.892 56.455 1.00 76.93 ? 271 GLY A C 1 ATOM 2069 O O . GLY A 1 271 ? -11.015 -1.721 55.635 1.00 77.56 ? 271 GLY A O 1 ATOM 2070 N N . GLY A 1 272 ? -12.091 -1.231 57.519 1.00 77.35 ? 272 GLY A N 1 ATOM 2071 C CA . GLY A 1 272 ? -12.514 -2.614 57.697 1.00 77.80 ? 272 GLY A CA 1 ATOM 2072 C C . GLY A 1 272 ? -14.019 -2.621 57.653 1.00 77.83 ? 272 GLY A C 1 ATOM 2073 O O . GLY A 1 272 ? -14.670 -3.351 58.402 1.00 78.51 ? 272 GLY A O 1 ATOM 2074 N N . GLN A 1 273 ? -14.565 -1.800 56.764 1.00 77.32 ? 273 GLN A N 1 ATOM 2075 C CA . GLN A 1 273 ? -15.979 -1.519 56.757 1.00 77.01 ? 273 GLN A CA 1 ATOM 2076 C C . GLN A 1 273 ? -16.559 -1.793 55.383 1.00 76.30 ? 273 GLN A C 1 ATOM 2077 O O . GLN A 1 273 ? -16.805 -0.878 54.603 1.00 75.58 ? 273 GLN A O 1 ATOM 2078 C CB . GLN A 1 273 ? -16.189 -0.065 57.231 1.00 77.43 ? 273 GLN A CB 1 ATOM 2079 C CG . GLN A 1 273 ? -17.644 0.458 57.310 1.00 80.35 ? 273 GLN A CG 1 ATOM 2080 C CD . GLN A 1 273 ? -18.556 -0.330 58.255 1.00 82.57 ? 273 GLN A CD 1 ATOM 2081 O OE1 . GLN A 1 273 ? -18.239 -0.516 59.442 1.00 82.93 ? 273 GLN A OE1 1 ATOM 2082 N NE2 . GLN A 1 273 ? -19.701 -0.791 57.725 1.00 82.94 ? 273 GLN A NE2 1 ATOM 2083 N N . ASP A 1 274 ? -16.767 -3.079 55.119 1.00 76.05 ? 274 ASP A N 1 ATOM 2084 C CA . ASP A 1 274 ? -17.331 -3.582 53.865 1.00 76.30 ? 274 ASP A CA 1 ATOM 2085 C C . ASP A 1 274 ? -18.664 -2.942 53.478 1.00 76.38 ? 274 ASP A C 1 ATOM 2086 O O . ASP A 1 274 ? -19.394 -2.428 54.335 1.00 76.48 ? 274 ASP A O 1 ATOM 2087 C CB . ASP A 1 274 ? -17.540 -5.102 53.934 1.00 76.06 ? 274 ASP A CB 1 ATOM 2088 C CG . ASP A 1 274 ? -16.276 -5.867 54.317 1.00 78.15 ? 274 ASP A CG 1 ATOM 2089 O OD1 . ASP A 1 274 ? -15.152 -5.306 54.288 1.00 79.86 ? 274 ASP A OD1 1 ATOM 2090 O OD2 . ASP A 1 274 ? -16.314 -7.059 54.669 1.00 79.73 ? 274 ASP A OD2 1 ATOM 2091 N N . ILE A 1 275 ? -18.979 -2.977 52.186 1.00 76.17 ? 275 ILE A N 1 ATOM 2092 C CA . ILE A 1 275 ? -20.292 -2.534 51.722 1.00 76.53 ? 275 ILE A CA 1 ATOM 2093 C C . ILE A 1 275 ? -21.244 -3.733 51.632 1.00 76.62 ? 275 ILE A C 1 ATOM 2094 O O . ILE A 1 275 ? -20.947 -4.699 50.932 1.00 76.91 ? 275 ILE A O 1 ATOM 2095 C CB . ILE A 1 275 ? -20.202 -1.799 50.375 1.00 76.45 ? 275 ILE A CB 1 ATOM 2096 C CG1 . ILE A 1 275 ? -19.279 -0.566 50.496 1.00 77.14 ? 275 ILE A CG1 1 ATOM 2097 C CG2 . ILE A 1 275 ? -21.609 -1.420 49.911 1.00 76.88 ? 275 ILE A CG2 1 ATOM 2098 C CD1 . ILE A 1 275 ? -19.188 0.317 49.243 1.00 75.92 ? 275 ILE A CD1 1 ATOM 2099 N N . ILE A 1 276 ? -22.371 -3.688 52.346 1.00 76.25 ? 276 ILE A N 1 ATOM 2100 C CA . ILE A 1 276 ? -23.328 -4.798 52.264 1.00 75.76 ? 276 ILE A CA 1 ATOM 2101 C C . ILE A 1 276 ? -24.671 -4.254 51.848 1.00 75.30 ? 276 ILE A C 1 ATOM 2102 O O . ILE A 1 276 ? -25.265 -3.430 52.552 1.00 75.25 ? 276 ILE A O 1 ATOM 2103 C CB . ILE A 1 276 ? -23.451 -5.640 53.572 1.00 75.75 ? 276 ILE A CB 1 ATOM 2104 C CG1 . ILE A 1 276 ? -22.101 -5.821 54.267 1.00 76.04 ? 276 ILE A CG1 1 ATOM 2105 C CG2 . ILE A 1 276 ? -24.061 -7.002 53.252 1.00 75.78 ? 276 ILE A CG2 1 ATOM 2106 C CD1 . ILE A 1 276 ? -22.116 -6.802 55.453 1.00 75.94 ? 276 ILE A CD1 1 ATOM 2107 N N . LEU A 1 277 ? -25.132 -4.720 50.690 1.00 74.29 ? 277 LEU A N 1 ATOM 2108 C CA . LEU A 1 277 ? -26.388 -4.267 50.142 1.00 73.84 ? 277 LEU A CA 1 ATOM 2109 C C . LEU A 1 277 ? -27.273 -5.472 50.037 1.00 73.07 ? 277 LEU A C 1 ATOM 2110 O O . LEU A 1 277 ? -26.858 -6.487 49.511 1.00 72.55 ? 277 LEU A O 1 ATOM 2111 C CB . LEU A 1 277 ? -26.196 -3.643 48.768 1.00 73.85 ? 277 LEU A CB 1 ATOM 2112 C CG . LEU A 1 277 ? -25.230 -2.477 48.611 1.00 74.95 ? 277 LEU A CG 1 ATOM 2113 C CD1 . LEU A 1 277 ? -25.013 -2.225 47.149 1.00 76.60 ? 277 LEU A CD1 1 ATOM 2114 C CD2 . LEU A 1 277 ? -25.727 -1.225 49.300 1.00 76.86 ? 277 LEU A CD2 1 ATOM 2115 N N . TYR A 1 278 ? -28.494 -5.333 50.547 1.00 72.52 ? 278 TYR A N 1 ATOM 2116 C CA . TYR A 1 278 ? -29.463 -6.412 50.613 1.00 71.97 ? 278 TYR A CA 1 ATOM 2117 C C . TYR A 1 278 ? -30.479 -6.317 49.512 1.00 72.23 ? 278 TYR A C 1 ATOM 2118 O O . TYR A 1 278 ? -31.106 -5.280 49.346 1.00 72.30 ? 278 TYR A O 1 ATOM 2119 C CB . TYR A 1 278 ? -30.189 -6.384 51.952 1.00 70.96 ? 278 TYR A CB 1 ATOM 2120 C CG . TYR A 1 278 ? -29.245 -6.520 53.094 1.00 70.43 ? 278 TYR A CG 1 ATOM 2121 C CD1 . TYR A 1 278 ? -28.749 -5.394 53.744 1.00 69.93 ? 278 TYR A CD1 1 ATOM 2122 C CD2 . TYR A 1 278 ? -28.832 -7.779 53.526 1.00 68.67 ? 278 TYR A CD2 1 ATOM 2123 C CE1 . TYR A 1 278 ? -27.864 -5.523 54.801 1.00 70.36 ? 278 TYR A CE1 1 ATOM 2124 C CE2 . TYR A 1 278 ? -27.953 -7.916 54.581 1.00 68.54 ? 278 TYR A CE2 1 ATOM 2125 C CZ . TYR A 1 278 ? -27.475 -6.789 55.210 1.00 69.21 ? 278 TYR A CZ 1 ATOM 2126 O OH . TYR A 1 278 ? -26.604 -6.921 56.254 1.00 70.49 ? 278 TYR A OH 1 ATOM 2127 N N . TRP A 1 279 ? -30.637 -7.416 48.770 1.00 72.37 ? 279 TRP A N 1 ATOM 2128 C CA . TRP A 1 279 ? -31.637 -7.488 47.706 1.00 72.43 ? 279 TRP A CA 1 ATOM 2129 C C . TRP A 1 279 ? -33.061 -7.399 48.257 1.00 72.26 ? 279 TRP A C 1 ATOM 2130 O O . TRP A 1 279 ? -33.746 -6.391 48.053 1.00 71.80 ? 279 TRP A O 1 ATOM 2131 C CB . TRP A 1 279 ? -31.463 -8.746 46.811 1.00 72.34 ? 279 TRP A CB 1 ATOM 2132 C CG . TRP A 1 279 ? -32.480 -8.761 45.689 1.00 72.84 ? 279 TRP A CG 1 ATOM 2133 C CD1 . TRP A 1 279 ? -33.591 -9.551 45.589 1.00 71.68 ? 279 TRP A CD1 1 ATOM 2134 C CD2 . TRP A 1 279 ? -32.479 -7.928 44.523 1.00 71.31 ? 279 TRP A CD2 1 ATOM 2135 N NE1 . TRP A 1 279 ? -34.276 -9.268 44.432 1.00 71.59 ? 279 TRP A NE1 1 ATOM 2136 C CE2 . TRP A 1 279 ? -33.621 -8.275 43.758 1.00 71.48 ? 279 TRP A CE2 1 ATOM 2137 C CE3 . TRP A 1 279 ? -31.633 -6.920 44.050 1.00 71.37 ? 279 TRP A CE3 1 ATOM 2138 C CZ2 . TRP A 1 279 ? -33.930 -7.656 42.548 1.00 71.95 ? 279 TRP A CZ2 1 ATOM 2139 C CZ3 . TRP A 1 279 ? -31.934 -6.296 42.851 1.00 71.95 ? 279 TRP A CZ3 1 ATOM 2140 C CH2 . TRP A 1 279 ? -33.074 -6.670 42.105 1.00 72.32 ? 279 TRP A CH2 1 ATOM 2141 N N . GLN B 2 2 ? -7.839 -10.460 11.745 1.00 84.16 ? 2 GLN B N 1 ATOM 2142 C CA . GLN B 2 2 ? -8.859 -9.382 12.022 1.00 83.89 ? 2 GLN B CA 1 ATOM 2143 C C . GLN B 2 2 ? -9.785 -9.695 13.233 1.00 82.87 ? 2 GLN B C 1 ATOM 2144 O O . GLN B 2 2 ? -10.496 -10.709 13.232 1.00 82.01 ? 2 GLN B O 1 ATOM 2145 C CB . GLN B 2 2 ? -9.668 -9.093 10.735 1.00 83.84 ? 2 GLN B CB 1 ATOM 2146 C CG . GLN B 2 2 ? -10.242 -7.670 10.663 1.00 83.87 ? 2 GLN B CG 1 ATOM 2147 C CD . GLN B 2 2 ? -10.498 -7.189 9.233 1.00 84.56 ? 2 GLN B CD 1 ATOM 2148 O OE1 . GLN B 2 2 ? -11.291 -7.785 8.479 1.00 84.66 ? 2 GLN B OE1 1 ATOM 2149 N NE2 . GLN B 2 2 ? -9.827 -6.101 8.856 1.00 84.38 ? 2 GLN B NE2 1 ATOM 2150 N N . LYS B 2 3 ? -9.754 -8.808 14.243 1.00 82.60 ? 3 LYS B N 1 ATOM 2151 C CA . LYS B 2 3 ? -10.522 -8.928 15.506 1.00 81.32 ? 3 LYS B CA 1 ATOM 2152 C C . LYS B 2 3 ? -11.769 -8.026 15.554 1.00 81.07 ? 3 LYS B C 1 ATOM 2153 O O . LYS B 2 3 ? -11.691 -6.817 15.280 1.00 80.46 ? 3 LYS B O 1 ATOM 2154 C CB . LYS B 2 3 ? -9.673 -8.923 16.327 0.00 40.00 ? 3 LYS B CB 1 ATOM 2155 C CG . LYS B 2 3 ? -8.638 -10.041 16.318 0.00 40.00 ? 3 LYS B CG 1 ATOM 2156 C CD . LYS B 2 3 ? -7.595 -9.880 17.431 0.00 40.00 ? 3 LYS B CD 1 ATOM 2157 C CE . LYS B 2 3 ? -6.396 -9.019 16.981 0.00 40.00 ? 3 LYS B CE 1 ATOM 2158 N NZ . LYS B 2 3 ? -5.749 -9.514 15.707 0.00 40.00 ? 3 LYS B NZ 1 ATOM 2159 N N . THR B 2 4 ? -12.912 -8.627 15.903 1.00 81.03 ? 4 THR B N 1 ATOM 2160 C CA . THR B 2 4 ? -14.230 -7.936 15.989 1.00 80.84 ? 4 THR B CA 1 ATOM 2161 C C . THR B 2 4 ? -14.483 -7.217 17.339 1.00 80.70 ? 4 THR B C 1 ATOM 2162 O O . THR B 2 4 ? -14.350 -7.831 18.394 1.00 81.65 ? 4 THR B O 1 ATOM 2163 C CB . THR B 2 4 ? -15.435 -8.876 15.599 1.00 80.72 ? 4 THR B CB 1 ATOM 2164 O OG1 . THR B 2 4 ? -16.665 -8.281 16.024 1.00 79.24 ? 4 THR B OG1 1 ATOM 2165 C CG2 . THR B 2 4 ? -15.406 -10.227 16.354 1.00 81.49 ? 4 THR B CG2 1 ATOM 2166 N N . PRO B 2 5 ? -14.853 -5.937 17.287 1.00 79.42 ? 5 PRO B N 1 ATOM 2167 C CA . PRO B 2 5 ? -15.029 -5.123 18.466 1.00 79.68 ? 5 PRO B CA 1 ATOM 2168 C C . PRO B 2 5 ? -16.112 -5.618 19.429 1.00 79.74 ? 5 PRO B C 1 ATOM 2169 O O . PRO B 2 5 ? -17.217 -5.935 18.996 1.00 80.40 ? 5 PRO B O 1 ATOM 2170 C CB . PRO B 2 5 ? -15.488 -3.785 17.885 1.00 79.08 ? 5 PRO B CB 1 ATOM 2171 C CG . PRO B 2 5 ? -15.071 -3.789 16.558 1.00 78.55 ? 5 PRO B CG 1 ATOM 2172 C CD . PRO B 2 5 ? -15.153 -5.177 16.068 1.00 79.87 ? 5 PRO B CD 1 ATOM 2173 N N . GLN B 2 6 ? -15.774 -5.678 20.717 1.00 79.55 ? 6 GLN B N 1 ATOM 2174 C CA . GLN B 2 6 ? -16.735 -5.937 21.773 1.00 79.95 ? 6 GLN B CA 1 ATOM 2175 C C . GLN B 2 6 ? -17.115 -4.563 22.338 1.00 78.32 ? 6 GLN B C 1 ATOM 2176 O O . GLN B 2 6 ? -16.276 -3.673 22.441 1.00 78.00 ? 6 GLN B O 1 ATOM 2177 C CB . GLN B 2 6 ? -16.124 -6.854 22.829 1.00 79.89 ? 6 GLN B CB 1 ATOM 2178 C CG . GLN B 2 6 ? -17.089 -7.266 23.954 1.00 83.49 ? 6 GLN B CG 1 ATOM 2179 C CD . GLN B 2 6 ? -16.390 -7.867 25.212 1.00 83.31 ? 6 GLN B CD 1 ATOM 2180 O OE1 . GLN B 2 6 ? -15.242 -8.334 25.142 1.00 88.51 ? 6 GLN B OE1 1 ATOM 2181 N NE2 . GLN B 2 6 ? -17.093 -7.854 26.348 1.00 85.22 ? 6 GLN B NE2 1 ATOM 2182 N N . ILE B 2 7 ? -18.383 -4.370 22.684 1.00 77.40 ? 7 ILE B N 1 ATOM 2183 C CA . ILE B 2 7 ? -18.839 -3.065 23.211 1.00 76.54 ? 7 ILE B CA 1 ATOM 2184 C C . ILE B 2 7 ? -19.548 -3.301 24.537 1.00 76.56 ? 7 ILE B C 1 ATOM 2185 O O . ILE B 2 7 ? -20.388 -4.202 24.658 1.00 76.24 ? 7 ILE B O 1 ATOM 2186 C CB . ILE B 2 7 ? -19.815 -2.366 22.254 1.00 76.26 ? 7 ILE B CB 1 ATOM 2187 C CG1 . ILE B 2 7 ? -19.176 -2.066 20.919 1.00 75.90 ? 7 ILE B CG1 1 ATOM 2188 C CG2 . ILE B 2 7 ? -20.312 -1.060 22.835 1.00 78.96 ? 7 ILE B CG2 1 ATOM 2189 C CD1 . ILE B 2 7 ? -20.218 -1.917 19.833 1.00 77.99 ? 7 ILE B CD1 1 ATOM 2190 N N . GLN B 2 8 ? -19.192 -2.495 25.520 1.00 75.34 ? 8 GLN B N 1 ATOM 2191 C CA . GLN B 2 8 ? -19.789 -2.515 26.840 1.00 75.50 ? 8 GLN B CA 1 ATOM 2192 C C . GLN B 2 8 ? -20.157 -1.046 27.179 1.00 74.27 ? 8 GLN B C 1 ATOM 2193 O O . GLN B 2 8 ? -19.390 -0.125 26.922 1.00 73.38 ? 8 GLN B O 1 ATOM 2194 C CB . GLN B 2 8 ? -18.830 -3.172 27.857 1.00 74.90 ? 8 GLN B CB 1 ATOM 2195 C CG . GLN B 2 8 ? -18.920 -4.703 27.856 1.00 76.94 ? 8 GLN B CG 1 ATOM 2196 C CD . GLN B 2 8 ? -17.660 -5.432 28.376 1.00 78.44 ? 8 GLN B CD 1 ATOM 2197 O OE1 . GLN B 2 8 ? -16.542 -5.188 27.895 1.00 85.13 ? 8 GLN B OE1 1 ATOM 2198 N NE2 . GLN B 2 8 ? -17.846 -6.333 29.345 1.00 79.97 ? 8 GLN B NE2 1 ATOM 2199 N N . VAL B 2 9 ? -21.348 -0.870 27.739 1.00 73.25 ? 9 VAL B N 1 ATOM 2200 C CA . VAL B 2 9 ? -21.935 0.434 28.020 1.00 72.96 ? 9 VAL B CA 1 ATOM 2201 C C . VAL B 2 9 ? -22.424 0.462 29.479 1.00 72.00 ? 9 VAL B C 1 ATOM 2202 O O . VAL B 2 9 ? -23.196 -0.392 29.880 1.00 73.01 ? 9 VAL B O 1 ATOM 2203 C CB . VAL B 2 9 ? -23.103 0.722 27.054 1.00 72.86 ? 9 VAL B CB 1 ATOM 2204 C CG1 . VAL B 2 9 ? -23.560 2.157 27.163 1.00 75.11 ? 9 VAL B CG1 1 ATOM 2205 C CG2 . VAL B 2 9 ? -22.698 0.443 25.615 1.00 74.14 ? 9 VAL B CG2 1 ATOM 2206 N N . TYR B 2 10 ? -21.970 1.450 30.256 1.00 70.75 ? 10 TYR B N 1 ATOM 2207 C CA . TYR B 2 10 ? -22.225 1.544 31.694 1.00 69.67 ? 10 TYR B CA 1 ATOM 2208 C C . TYR B 2 10 ? -22.006 3.002 32.192 1.00 69.62 ? 10 TYR B C 1 ATOM 2209 O O . TYR B 2 10 ? -21.358 3.764 31.491 1.00 69.97 ? 10 TYR B O 1 ATOM 2210 C CB . TYR B 2 10 ? -21.263 0.613 32.426 1.00 69.42 ? 10 TYR B CB 1 ATOM 2211 C CG . TYR B 2 10 ? -19.831 0.849 32.039 1.00 68.58 ? 10 TYR B CG 1 ATOM 2212 C CD1 . TYR B 2 10 ? -19.296 0.228 30.912 1.00 70.13 ? 10 TYR B CD1 1 ATOM 2213 C CD2 . TYR B 2 10 ? -19.008 1.697 32.788 1.00 69.19 ? 10 TYR B CD2 1 ATOM 2214 C CE1 . TYR B 2 10 ? -17.987 0.434 30.534 1.00 69.27 ? 10 TYR B CE1 1 ATOM 2215 C CE2 . TYR B 2 10 ? -17.675 1.919 32.433 1.00 67.67 ? 10 TYR B CE2 1 ATOM 2216 C CZ . TYR B 2 10 ? -17.176 1.277 31.288 1.00 69.52 ? 10 TYR B CZ 1 ATOM 2217 O OH . TYR B 2 10 ? -15.900 1.460 30.881 1.00 66.28 ? 10 TYR B OH 1 ATOM 2218 N N . SER B 2 11 ? -22.533 3.350 33.379 1.00 68.98 ? 11 SER B N 1 ATOM 2219 C CA . SER B 2 11 ? -22.445 4.724 34.010 1.00 69.77 ? 11 SER B CA 1 ATOM 2220 C C . SER B 2 11 ? -21.323 4.839 35.058 1.00 68.63 ? 11 SER B C 1 ATOM 2221 O O . SER B 2 11 ? -20.956 3.814 35.592 1.00 66.50 ? 11 SER B O 1 ATOM 2222 C CB . SER B 2 11 ? -23.734 4.958 34.811 1.00 70.20 ? 11 SER B CB 1 ATOM 2223 O OG . SER B 2 11 ? -24.883 4.759 34.051 1.00 73.64 ? 11 SER B OG 1 ATOM 2224 N N . ARG B 2 12 ? -20.795 6.055 35.354 1.00 69.35 ? 12 ARG B N 1 ATOM 2225 C CA . ARG B 2 12 ? -19.880 6.219 36.502 1.00 69.89 ? 12 ARG B CA 1 ATOM 2226 C C . ARG B 2 12 ? -20.636 5.965 37.766 1.00 70.39 ? 12 ARG B C 1 ATOM 2227 O O . ARG B 2 12 ? -20.136 5.268 38.651 1.00 70.80 ? 12 ARG B O 1 ATOM 2228 C CB . ARG B 2 12 ? -19.199 7.610 36.629 1.00 70.40 ? 12 ARG B CB 1 ATOM 2229 C CG . ARG B 2 12 ? -17.712 7.557 36.407 1.00 71.31 ? 12 ARG B CG 1 ATOM 2230 C CD . ARG B 2 12 ? -16.788 7.577 37.638 1.00 75.27 ? 12 ARG B CD 1 ATOM 2231 N NE . ARG B 2 12 ? -17.409 7.024 38.808 1.00 72.71 ? 12 ARG B NE 1 ATOM 2232 C CZ . ARG B 2 12 ? -16.911 7.142 40.005 1.00 74.50 ? 12 ARG B CZ 1 ATOM 2233 N NH1 . ARG B 2 12 ? -15.774 7.799 40.186 1.00 68.55 ? 12 ARG B NH1 1 ATOM 2234 N NH2 . ARG B 2 12 ? -17.560 6.603 41.032 1.00 76.87 ? 12 ARG B NH2 1 ATOM 2235 N N . HIS B 2 13 ? -21.842 6.530 37.843 1.00 70.42 ? 13 HIS B N 1 ATOM 2236 C CA . HIS B 2 13 ? -22.592 6.563 39.091 1.00 70.80 ? 13 HIS B CA 1 ATOM 2237 C C . HIS B 2 13 ? -23.891 5.820 38.993 1.00 71.51 ? 13 HIS B C 1 ATOM 2238 O O . HIS B 2 13 ? -24.388 5.607 37.883 1.00 71.15 ? 13 HIS B O 1 ATOM 2239 C CB . HIS B 2 13 ? -22.882 8.008 39.459 1.00 70.89 ? 13 HIS B CB 1 ATOM 2240 C CG . HIS B 2 13 ? -21.652 8.861 39.551 1.00 71.81 ? 13 HIS B CG 1 ATOM 2241 N ND1 . HIS B 2 13 ? -20.692 8.674 40.523 1.00 71.49 ? 13 HIS B ND1 1 ATOM 2242 C CD2 . HIS B 2 13 ? -21.230 9.905 38.796 1.00 70.02 ? 13 HIS B CD2 1 ATOM 2243 C CE1 . HIS B 2 13 ? -19.731 9.566 40.363 1.00 70.87 ? 13 HIS B CE1 1 ATOM 2244 N NE2 . HIS B 2 13 ? -20.032 10.324 39.324 1.00 72.41 ? 13 HIS B NE2 1 ATOM 2245 N N . PRO B 2 14 ? -24.461 5.419 40.132 1.00 71.80 ? 14 PRO B N 1 ATOM 2246 C CA . PRO B 2 14 ? -25.784 4.777 40.107 1.00 72.07 ? 14 PRO B CA 1 ATOM 2247 C C . PRO B 2 14 ? -26.720 5.634 39.285 1.00 71.99 ? 14 PRO B C 1 ATOM 2248 O O . PRO B 2 14 ? -26.867 6.796 39.585 1.00 72.54 ? 14 PRO B O 1 ATOM 2249 C CB . PRO B 2 14 ? -26.206 4.780 41.577 1.00 71.92 ? 14 PRO B CB 1 ATOM 2250 C CG . PRO B 2 14 ? -24.921 4.803 42.347 1.00 71.60 ? 14 PRO B CG 1 ATOM 2251 C CD . PRO B 2 14 ? -23.920 5.526 41.500 1.00 71.76 ? 14 PRO B CD 1 ATOM 2252 N N . PRO B 2 15 ? -27.349 5.091 38.245 1.00 72.84 ? 15 PRO B N 1 ATOM 2253 C CA . PRO B 2 15 ? -28.252 5.905 37.436 1.00 73.20 ? 15 PRO B CA 1 ATOM 2254 C C . PRO B 2 15 ? -29.612 6.196 38.112 1.00 74.20 ? 15 PRO B C 1 ATOM 2255 O O . PRO B 2 15 ? -30.393 5.284 38.376 1.00 74.36 ? 15 PRO B O 1 ATOM 2256 C CB . PRO B 2 15 ? -28.423 5.073 36.176 1.00 73.77 ? 15 PRO B CB 1 ATOM 2257 C CG . PRO B 2 15 ? -28.169 3.691 36.604 1.00 73.34 ? 15 PRO B CG 1 ATOM 2258 C CD . PRO B 2 15 ? -27.252 3.707 37.758 1.00 71.54 ? 15 PRO B CD 1 ATOM 2259 N N . GLU B 2 16 ? -29.885 7.468 38.388 1.00 74.57 ? 16 GLU B N 1 ATOM 2260 C CA . GLU B 2 16 ? -31.162 7.874 38.956 1.00 74.75 ? 16 GLU B CA 1 ATOM 2261 C C . GLU B 2 16 ? -31.762 8.786 37.907 1.00 75.13 ? 16 GLU B C 1 ATOM 2262 O O . GLU B 2 16 ? -31.054 9.632 37.372 1.00 76.18 ? 16 GLU B O 1 ATOM 2263 C CB . GLU B 2 16 ? -30.812 8.478 40.231 0.00 40.00 ? 16 GLU B CB 1 ATOM 2264 C CG . GLU B 2 16 ? -31.878 9.432 40.804 0.00 40.00 ? 16 GLU B CG 1 ATOM 2265 C CD . GLU B 2 16 ? -31.675 9.773 42.292 0.00 40.00 ? 16 GLU B CD 1 ATOM 2266 O OE1 . GLU B 2 16 ? -30.609 10.335 42.665 0.00 40.00 ? 16 GLU B OE1 1 ATOM 2267 O OE2 . GLU B 2 16 ? -32.594 9.487 43.109 0.00 40.00 ? 16 GLU B OE2 1 ATOM 2268 N N . ASN B 2 17 ? -33.047 8.628 37.598 1.00 74.75 ? 17 ASN B N 1 ATOM 2269 C CA . ASN B 2 17 ? -33.694 9.527 36.636 1.00 74.47 ? 17 ASN B CA 1 ATOM 2270 C C . ASN B 2 17 ? -33.600 10.998 37.092 1.00 74.79 ? 17 ASN B C 1 ATOM 2271 O O . ASN B 2 17 ? -33.720 11.295 38.286 1.00 74.98 ? 17 ASN B O 1 ATOM 2272 C CB . ASN B 2 17 ? -35.124 9.087 36.349 1.00 74.36 ? 17 ASN B CB 1 ATOM 2273 C CG . ASN B 2 17 ? -35.178 7.787 35.559 1.00 74.51 ? 17 ASN B CG 1 ATOM 2274 O OD1 . ASN B 2 17 ? -34.172 7.316 35.035 1.00 74.67 ? 17 ASN B OD1 1 ATOM 2275 N ND2 . ASN B 2 17 ? -36.351 7.209 35.471 1.00 74.72 ? 17 ASN B ND2 1 ATOM 2276 N N . GLY B 2 18 ? -33.367 11.895 36.132 1.00 74.26 ? 18 GLY B N 1 ATOM 2277 C CA . GLY B 2 18 ? -33.141 13.311 36.403 1.00 73.35 ? 18 GLY B CA 1 ATOM 2278 C C . GLY B 2 18 ? -31.774 13.722 36.941 1.00 72.84 ? 18 GLY B C 1 ATOM 2279 O O . GLY B 2 18 ? -31.469 14.913 36.968 1.00 72.59 ? 18 GLY B O 1 ATOM 2280 N N . LYS B 2 19 ? -30.942 12.767 37.360 1.00 72.39 ? 19 LYS B N 1 ATOM 2281 C CA . LYS B 2 19 ? -29.653 13.093 38.005 1.00 71.49 ? 19 LYS B CA 1 ATOM 2282 C C . LYS B 2 19 ? -28.449 12.971 37.048 1.00 71.85 ? 19 LYS B C 1 ATOM 2283 O O . LYS B 2 19 ? -28.182 11.868 36.558 1.00 71.39 ? 19 LYS B O 1 ATOM 2284 C CB . LYS B 2 19 ? -29.538 12.252 39.217 0.00 40.00 ? 19 LYS B CB 1 ATOM 2285 C CG . LYS B 2 19 ? -28.241 12.520 40.010 0.00 40.00 ? 19 LYS B CG 1 ATOM 2286 C CD . LYS B 2 19 ? -28.217 11.755 41.335 0.00 40.00 ? 19 LYS B CD 1 ATOM 2287 C CE . LYS B 2 19 ? -26.868 11.891 42.070 0.00 40.00 ? 19 LYS B CE 1 ATOM 2288 N NZ . LYS B 2 19 ? -26.480 13.299 42.360 0.00 40.00 ? 19 LYS B NZ 1 ATOM 2289 N N . PRO B 2 20 ? -27.737 14.094 36.791 1.00 71.31 ? 20 PRO B N 1 ATOM 2290 C CA . PRO B 2 20 ? -26.551 14.120 35.928 1.00 70.50 ? 20 PRO B CA 1 ATOM 2291 C C . PRO B 2 20 ? -25.602 12.981 36.211 1.00 70.54 ? 20 PRO B C 1 ATOM 2292 O O . PRO B 2 20 ? -25.202 12.762 37.355 1.00 71.18 ? 20 PRO B O 1 ATOM 2293 C CB . PRO B 2 20 ? -25.865 15.449 36.291 1.00 70.64 ? 20 PRO B CB 1 ATOM 2294 C CG . PRO B 2 20 ? -26.912 16.318 36.825 1.00 70.44 ? 20 PRO B CG 1 ATOM 2295 C CD . PRO B 2 20 ? -28.046 15.440 37.312 1.00 71.21 ? 20 PRO B CD 1 ATOM 2296 N N . ASN B 2 21 ? -25.238 12.255 35.165 1.00 69.90 ? 21 ASN B N 1 ATOM 2297 C CA . ASN B 2 21 ? -24.322 11.127 35.298 1.00 69.54 ? 21 ASN B CA 1 ATOM 2298 C C . ASN B 2 21 ? -23.241 11.171 34.179 1.00 68.03 ? 21 ASN B C 1 ATOM 2299 O O . ASN B 2 21 ? -23.168 12.123 33.409 1.00 67.71 ? 21 ASN B O 1 ATOM 2300 C CB . ASN B 2 21 ? -25.177 9.837 35.287 1.00 69.48 ? 21 ASN B CB 1 ATOM 2301 C CG . ASN B 2 21 ? -24.544 8.681 36.028 1.00 68.82 ? 21 ASN B CG 1 ATOM 2302 O OD1 . ASN B 2 21 ? -23.343 8.509 36.026 1.00 70.81 ? 21 ASN B OD1 1 ATOM 2303 N ND2 . ASN B 2 21 ? -25.371 7.875 36.666 1.00 70.84 ? 21 ASN B ND2 1 ATOM 2304 N N . ILE B 2 22 ? -22.403 10.163 34.095 1.00 66.93 ? 22 ILE B N 1 ATOM 2305 C CA . ILE B 2 22 ? -21.497 10.029 32.951 1.00 67.26 ? 22 ILE B CA 1 ATOM 2306 C C . ILE B 2 22 ? -21.755 8.656 32.364 1.00 66.52 ? 22 ILE B C 1 ATOM 2307 O O . ILE B 2 22 ? -21.726 7.672 33.077 1.00 64.98 ? 22 ILE B O 1 ATOM 2308 C CB . ILE B 2 22 ? -19.991 10.171 33.321 1.00 66.73 ? 22 ILE B CB 1 ATOM 2309 C CG1 . ILE B 2 22 ? -19.695 11.562 33.900 1.00 69.21 ? 22 ILE B CG1 1 ATOM 2310 C CG2 . ILE B 2 22 ? -19.139 9.879 32.091 1.00 65.84 ? 22 ILE B CG2 1 ATOM 2311 C CD1 . ILE B 2 22 ? -18.434 11.616 34.803 1.00 70.06 ? 22 ILE B CD1 1 ATOM 2312 N N . LEU B 2 23 ? -22.020 8.622 31.057 1.00 67.09 ? 23 LEU B N 1 ATOM 2313 C CA . LEU B 2 23 ? -22.166 7.385 30.337 1.00 67.86 ? 23 LEU B CA 1 ATOM 2314 C C . LEU B 2 23 ? -20.830 7.026 29.605 1.00 68.88 ? 23 LEU B C 1 ATOM 2315 O O . LEU B 2 23 ? -20.205 7.892 28.977 1.00 68.21 ? 23 LEU B O 1 ATOM 2316 C CB . LEU B 2 23 ? -23.373 7.448 29.377 1.00 67.06 ? 23 LEU B CB 1 ATOM 2317 C CG . LEU B 2 23 ? -23.822 6.094 28.823 1.00 66.06 ? 23 LEU B CG 1 ATOM 2318 C CD1 . LEU B 2 23 ? -24.409 5.205 29.884 1.00 62.45 ? 23 LEU B CD1 1 ATOM 2319 C CD2 . LEU B 2 23 ? -24.881 6.311 27.690 1.00 68.02 ? 23 LEU B CD2 1 ATOM 2320 N N . ASN B 2 24 ? -20.433 5.752 29.735 1.00 68.81 ? 24 ASN B N 1 ATOM 2321 C CA . ASN B 2 24 ? -19.263 5.168 29.125 1.00 69.55 ? 24 ASN B CA 1 ATOM 2322 C C . ASN B 2 24 ? -19.561 4.131 28.057 1.00 71.19 ? 24 ASN B C 1 ATOM 2323 O O . ASN B 2 24 ? -20.542 3.402 28.141 1.00 71.23 ? 24 ASN B O 1 ATOM 2324 C CB . ASN B 2 24 ? -18.500 4.412 30.170 1.00 69.89 ? 24 ASN B CB 1 ATOM 2325 C CG . ASN B 2 24 ? -18.036 5.307 31.280 1.00 68.41 ? 24 ASN B CG 1 ATOM 2326 O OD1 . ASN B 2 24 ? -17.574 6.410 31.037 1.00 66.34 ? 24 ASN B OD1 1 ATOM 2327 N ND2 . ASN B 2 24 ? -18.170 4.839 32.505 1.00 66.49 ? 24 ASN B ND2 1 ATOM 2328 N N . CYS B 2 25 ? -18.682 4.078 27.072 1.00 72.66 ? 25 CYS B N 1 ATOM 2329 C CA . CYS B 2 25 ? -18.707 3.060 26.069 1.00 73.34 ? 25 CYS B CA 1 ATOM 2330 C C . CYS B 2 25 ? -17.258 2.612 25.804 1.00 73.09 ? 25 CYS B C 1 ATOM 2331 O O . CYS B 2 25 ? -16.424 3.381 25.304 1.00 70.78 ? 25 CYS B O 1 ATOM 2332 C CB . CYS B 2 25 ? -19.345 3.596 24.834 1.00 73.75 ? 25 CYS B CB 1 ATOM 2333 S SG . CYS B 2 25 ? -19.166 2.409 23.557 1.00 77.17 ? 25 CYS B SG 1 ATOM 2334 N N . TYR B 2 26 ? -17.007 1.354 26.165 1.00 71.80 ? 26 TYR B N 1 ATOM 2335 C CA . TYR B 2 26 ? -15.691 0.748 26.146 1.00 71.81 ? 26 TYR B CA 1 ATOM 2336 C C . TYR B 2 26 ? -15.704 -0.289 25.030 1.00 72.53 ? 26 TYR B C 1 ATOM 2337 O O . TYR B 2 26 ? -16.480 -1.252 25.072 1.00 70.44 ? 26 TYR B O 1 ATOM 2338 C CB . TYR B 2 26 ? -15.474 0.030 27.484 1.00 71.70 ? 26 TYR B CB 1 ATOM 2339 C CG . TYR B 2 26 ? -14.073 -0.495 27.829 1.00 69.78 ? 26 TYR B CG 1 ATOM 2340 C CD1 . TYR B 2 26 ? -12.922 0.268 27.588 1.00 65.14 ? 26 TYR B CD1 1 ATOM 2341 C CD2 . TYR B 2 26 ? -13.920 -1.751 28.425 1.00 65.76 ? 26 TYR B CD2 1 ATOM 2342 C CE1 . TYR B 2 26 ? -11.658 -0.202 27.908 1.00 66.28 ? 26 TYR B CE1 1 ATOM 2343 C CE2 . TYR B 2 26 ? -12.671 -2.225 28.750 1.00 66.58 ? 26 TYR B CE2 1 ATOM 2344 C CZ . TYR B 2 26 ? -11.547 -1.455 28.492 1.00 69.27 ? 26 TYR B CZ 1 ATOM 2345 O OH . TYR B 2 26 ? -10.317 -1.938 28.824 1.00 73.94 ? 26 TYR B OH 1 ATOM 2346 N N . VAL B 2 27 ? -14.839 -0.067 24.042 1.00 72.45 ? 27 VAL B N 1 ATOM 2347 C CA . VAL B 2 27 ? -14.745 -0.913 22.854 1.00 72.69 ? 27 VAL B CA 1 ATOM 2348 C C . VAL B 2 27 ? -13.374 -1.574 22.930 1.00 72.94 ? 27 VAL B C 1 ATOM 2349 O O . VAL B 2 27 ? -12.346 -0.886 23.016 1.00 71.20 ? 27 VAL B O 1 ATOM 2350 C CB . VAL B 2 27 ? -14.892 -0.037 21.589 1.00 72.64 ? 27 VAL B CB 1 ATOM 2351 C CG1 . VAL B 2 27 ? -14.981 -0.848 20.376 1.00 72.62 ? 27 VAL B CG1 1 ATOM 2352 C CG2 . VAL B 2 27 ? -16.098 0.910 21.714 1.00 72.40 ? 27 VAL B CG2 1 ATOM 2353 N N . THR B 2 28 ? -13.364 -2.905 22.900 1.00 72.88 ? 28 THR B N 1 ATOM 2354 C CA . THR B 2 28 ? -12.126 -3.674 23.091 1.00 73.77 ? 28 THR B CA 1 ATOM 2355 C C . THR B 2 28 ? -11.978 -4.744 22.023 1.00 73.60 ? 28 THR B C 1 ATOM 2356 O O . THR B 2 28 ? -12.866 -4.942 21.206 1.00 74.99 ? 28 THR B O 1 ATOM 2357 C CB . THR B 2 28 ? -12.136 -4.452 24.455 1.00 73.99 ? 28 THR B CB 1 ATOM 2358 O OG1 . THR B 2 28 ? -13.268 -5.330 24.497 1.00 73.74 ? 28 THR B OG1 1 ATOM 2359 C CG2 . THR B 2 28 ? -12.329 -3.571 25.616 1.00 73.30 ? 28 THR B CG2 1 ATOM 2360 N N . GLN B 2 29 ? -10.850 -5.438 22.033 1.00 73.85 ? 29 GLN B N 1 ATOM 2361 C CA . GLN B 2 29 ? -10.709 -6.663 21.240 1.00 74.20 ? 29 GLN B CA 1 ATOM 2362 C C . GLN B 2 29 ? -10.698 -6.411 19.736 1.00 73.16 ? 29 GLN B C 1 ATOM 2363 O O . GLN B 2 29 ? -11.018 -7.290 18.974 1.00 72.98 ? 29 GLN B O 1 ATOM 2364 C CB . GLN B 2 29 ? -11.907 -7.545 21.579 1.00 74.29 ? 29 GLN B CB 1 ATOM 2365 C CG . GLN B 2 29 ? -11.597 -9.016 21.739 1.00 80.93 ? 29 GLN B CG 1 ATOM 2366 C CD . GLN B 2 29 ? -10.802 -9.274 22.991 1.00 84.38 ? 29 GLN B CD 1 ATOM 2367 O OE1 . GLN B 2 29 ? -10.652 -8.380 23.821 1.00 85.61 ? 29 GLN B OE1 1 ATOM 2368 N NE2 . GLN B 2 29 ? -10.287 -10.495 23.133 1.00 86.64 ? 29 GLN B NE2 1 ATOM 2369 N N . PHE B 2 30 ? -10.349 -5.206 19.290 1.00 73.02 ? 30 PHE B N 1 ATOM 2370 C CA . PHE B 2 30 ? -10.420 -4.952 17.845 1.00 71.84 ? 30 PHE B CA 1 ATOM 2371 C C . PHE B 2 30 ? -9.038 -4.856 17.194 1.00 71.98 ? 30 PHE B C 1 ATOM 2372 O O . PHE B 2 30 ? -8.024 -4.669 17.880 1.00 72.73 ? 30 PHE B O 1 ATOM 2373 C CB . PHE B 2 30 ? -11.407 -3.807 17.489 1.00 70.62 ? 30 PHE B CB 1 ATOM 2374 C CG . PHE B 2 30 ? -10.993 -2.418 17.981 1.00 69.78 ? 30 PHE B CG 1 ATOM 2375 C CD1 . PHE B 2 30 ? -11.363 -1.973 19.229 1.00 68.04 ? 30 PHE B CD1 1 ATOM 2376 C CD2 . PHE B 2 30 ? -10.250 -1.575 17.170 1.00 66.48 ? 30 PHE B CD2 1 ATOM 2377 C CE1 . PHE B 2 30 ? -10.981 -0.669 19.690 1.00 69.12 ? 30 PHE B CE1 1 ATOM 2378 C CE2 . PHE B 2 30 ? -9.860 -0.270 17.614 1.00 70.45 ? 30 PHE B CE2 1 ATOM 2379 C CZ . PHE B 2 30 ? -10.229 0.168 18.882 1.00 67.25 ? 30 PHE B CZ 1 ATOM 2380 N N . HIS B 2 31 ? -9.020 -4.998 15.877 1.00 72.13 ? 31 HIS B N 1 ATOM 2381 C CA . HIS B 2 31 ? -7.831 -4.836 15.023 1.00 72.96 ? 31 HIS B CA 1 ATOM 2382 C C . HIS B 2 31 ? -8.291 -4.804 13.553 1.00 72.95 ? 31 HIS B C 1 ATOM 2383 O O . HIS B 2 31 ? -9.130 -5.640 13.187 1.00 73.25 ? 31 HIS B O 1 ATOM 2384 C CB . HIS B 2 31 ? -6.851 -5.989 15.200 1.00 73.15 ? 31 HIS B CB 1 ATOM 2385 C CG . HIS B 2 31 ? -5.599 -5.839 14.392 1.00 73.97 ? 31 HIS B CG 1 ATOM 2386 N ND1 . HIS B 2 31 ? -4.521 -5.085 14.817 1.00 75.09 ? 31 HIS B ND1 1 ATOM 2387 C CD2 . HIS B 2 31 ? -5.254 -6.345 13.187 1.00 72.98 ? 31 HIS B CD2 1 ATOM 2388 C CE1 . HIS B 2 31 ? -3.568 -5.134 13.907 1.00 72.45 ? 31 HIS B CE1 1 ATOM 2389 N NE2 . HIS B 2 31 ? -3.989 -5.894 12.910 1.00 74.66 ? 31 HIS B NE2 1 ATOM 2390 N N . PRO B 2 32 ? -7.783 -3.887 12.705 1.00 72.85 ? 32 PRO B N 1 ATOM 2391 C CA . PRO B 2 32 ? -6.740 -2.877 13.028 1.00 73.14 ? 32 PRO B CA 1 ATOM 2392 C C . PRO B 2 32 ? -7.249 -1.741 13.901 1.00 72.96 ? 32 PRO B C 1 ATOM 2393 O O . PRO B 2 32 ? -8.440 -1.680 14.131 1.00 73.89 ? 32 PRO B O 1 ATOM 2394 C CB . PRO B 2 32 ? -6.387 -2.303 11.654 1.00 73.29 ? 32 PRO B CB 1 ATOM 2395 C CG . PRO B 2 32 ? -7.058 -3.177 10.653 1.00 72.92 ? 32 PRO B CG 1 ATOM 2396 C CD . PRO B 2 32 ? -8.231 -3.775 11.308 1.00 72.59 ? 32 PRO B CD 1 ATOM 2397 N N . PRO B 2 33 ? -6.374 -0.851 14.379 1.00 73.28 ? 33 PRO B N 1 ATOM 2398 C CA . PRO B 2 33 ? -6.787 0.248 15.242 1.00 73.49 ? 33 PRO B CA 1 ATOM 2399 C C . PRO B 2 33 ? -7.784 1.230 14.644 1.00 74.04 ? 33 PRO B C 1 ATOM 2400 O O . PRO B 2 33 ? -8.207 2.151 15.327 1.00 75.63 ? 33 PRO B O 1 ATOM 2401 C CB . PRO B 2 33 ? -5.465 0.993 15.516 1.00 73.49 ? 33 PRO B CB 1 ATOM 2402 C CG . PRO B 2 33 ? -4.604 0.624 14.376 1.00 73.35 ? 33 PRO B CG 1 ATOM 2403 C CD . PRO B 2 33 ? -4.919 -0.810 14.144 1.00 72.55 ? 33 PRO B CD 1 ATOM 2404 N N . HIS B 2 34 ? -8.184 1.064 13.400 1.00 74.46 ? 34 HIS B N 1 ATOM 2405 C CA . HIS B 2 34 ? -9.016 2.084 12.808 1.00 74.61 ? 34 HIS B CA 1 ATOM 2406 C C . HIS B 2 34 ? -10.484 1.844 13.064 1.00 74.67 ? 34 HIS B C 1 ATOM 2407 O O . HIS B 2 34 ? -11.051 0.850 12.623 1.00 74.29 ? 34 HIS B O 1 ATOM 2408 C CB . HIS B 2 34 ? -8.665 2.206 11.349 1.00 74.73 ? 34 HIS B CB 1 ATOM 2409 C CG . HIS B 2 34 ? -7.191 2.138 11.123 1.00 76.56 ? 34 HIS B CG 1 ATOM 2410 N ND1 . HIS B 2 34 ? -6.592 1.132 10.397 1.00 76.99 ? 34 HIS B ND1 1 ATOM 2411 C CD2 . HIS B 2 34 ? -6.191 2.946 11.554 1.00 77.39 ? 34 HIS B CD2 1 ATOM 2412 C CE1 . HIS B 2 34 ? -5.287 1.332 10.376 1.00 79.03 ? 34 HIS B CE1 1 ATOM 2413 N NE2 . HIS B 2 34 ? -5.018 2.424 11.074 1.00 78.85 ? 34 HIS B NE2 1 ATOM 2414 N N . ILE B 2 35 ? -11.090 2.780 13.786 1.00 74.54 ? 35 ILE B N 1 ATOM 2415 C CA . ILE B 2 35 ? -12.449 2.609 14.238 1.00 74.28 ? 35 ILE B CA 1 ATOM 2416 C C . ILE B 2 35 ? -13.233 3.907 14.321 1.00 74.21 ? 35 ILE B C 1 ATOM 2417 O O . ILE B 2 35 ? -12.675 4.992 14.462 1.00 73.36 ? 35 ILE B O 1 ATOM 2418 C CB . ILE B 2 35 ? -12.386 1.959 15.630 1.00 74.64 ? 35 ILE B CB 1 ATOM 2419 C CG1 . ILE B 2 35 ? -13.698 1.241 15.971 1.00 73.66 ? 35 ILE B CG1 1 ATOM 2420 C CG2 . ILE B 2 35 ? -11.937 3.009 16.660 1.00 74.34 ? 35 ILE B CG2 1 ATOM 2421 C CD1 . ILE B 2 35 ? -13.587 0.387 17.181 1.00 71.89 ? 35 ILE B CD1 1 ATOM 2422 N N . GLU B 2 36 ? -14.548 3.781 14.228 1.00 74.67 ? 36 GLU B N 1 ATOM 2423 C CA . GLU B 2 36 ? -15.418 4.914 14.436 1.00 75.45 ? 36 GLU B CA 1 ATOM 2424 C C . GLU B 2 36 ? -16.479 4.612 15.497 1.00 75.09 ? 36 GLU B C 1 ATOM 2425 O O . GLU B 2 36 ? -17.250 3.666 15.374 1.00 75.30 ? 36 GLU B O 1 ATOM 2426 C CB . GLU B 2 36 ? -16.019 5.406 13.120 1.00 75.89 ? 36 GLU B CB 1 ATOM 2427 C CG . GLU B 2 36 ? -17.007 6.555 13.273 1.00 79.95 ? 36 GLU B CG 1 ATOM 2428 C CD . GLU B 2 36 ? -16.462 7.760 14.066 1.00 86.07 ? 36 GLU B CD 1 ATOM 2429 O OE1 . GLU B 2 36 ? -15.650 7.590 15.037 1.00 86.46 ? 36 GLU B OE1 1 ATOM 2430 O OE2 . GLU B 2 36 ? -16.866 8.904 13.711 1.00 87.03 ? 36 GLU B OE2 1 ATOM 2431 N N . ILE B 2 37 ? -16.494 5.433 16.544 1.00 74.85 ? 37 ILE B N 1 ATOM 2432 C CA . ILE B 2 37 ? -17.439 5.296 17.649 1.00 74.03 ? 37 ILE B CA 1 ATOM 2433 C C . ILE B 2 37 ? -18.260 6.561 17.813 1.00 74.54 ? 37 ILE B C 1 ATOM 2434 O O . ILE B 2 37 ? -17.714 7.678 17.822 1.00 74.18 ? 37 ILE B O 1 ATOM 2435 C CB . ILE B 2 37 ? -16.698 5.040 18.956 1.00 73.92 ? 37 ILE B CB 1 ATOM 2436 C CG1 . ILE B 2 37 ? -15.878 3.758 18.868 1.00 72.71 ? 37 ILE B CG1 1 ATOM 2437 C CG2 . ILE B 2 37 ? -17.678 4.982 20.132 1.00 73.54 ? 37 ILE B CG2 1 ATOM 2438 C CD1 . ILE B 2 37 ? -14.618 3.842 19.706 1.00 70.98 ? 37 ILE B CD1 1 ATOM 2439 N N . GLN B 2 38 ? -19.569 6.365 17.937 1.00 74.33 ? 38 GLN B N 1 ATOM 2440 C CA . GLN B 2 38 ? -20.489 7.431 18.252 1.00 74.60 ? 38 GLN B CA 1 ATOM 2441 C C . GLN B 2 38 ? -21.488 6.979 19.305 1.00 74.98 ? 38 GLN B C 1 ATOM 2442 O O . GLN B 2 38 ? -21.959 5.822 19.313 1.00 74.47 ? 38 GLN B O 1 ATOM 2443 C CB . GLN B 2 38 ? -21.176 7.966 17.009 1.00 75.36 ? 38 GLN B CB 1 ATOM 2444 C CG . GLN B 2 38 ? -21.897 6.952 16.170 1.00 76.09 ? 38 GLN B CG 1 ATOM 2445 C CD . GLN B 2 38 ? -22.340 7.555 14.857 1.00 79.20 ? 38 GLN B CD 1 ATOM 2446 O OE1 . GLN B 2 38 ? -23.506 7.413 14.449 1.00 79.33 ? 38 GLN B OE1 1 ATOM 2447 N NE2 . GLN B 2 38 ? -21.413 8.243 14.185 1.00 79.94 ? 38 GLN B NE2 1 ATOM 2448 N N . MET B 2 39 ? -21.799 7.905 20.206 1.00 74.56 ? 39 MET B N 1 ATOM 2449 C CA . MET B 2 39 ? -22.730 7.639 21.276 1.00 74.43 ? 39 MET B CA 1 ATOM 2450 C C . MET B 2 39 ? -23.998 8.346 20.869 1.00 73.11 ? 39 MET B C 1 ATOM 2451 O O . MET B 2 39 ? -23.955 9.485 20.370 1.00 72.64 ? 39 MET B O 1 ATOM 2452 C CB . MET B 2 39 ? -22.177 8.090 22.638 1.00 74.81 ? 39 MET B CB 1 ATOM 2453 C CG . MET B 2 39 ? -20.943 7.255 23.125 1.00 74.40 ? 39 MET B CG 1 ATOM 2454 S SD . MET B 2 39 ? -20.377 7.631 24.821 1.00 78.08 ? 39 MET B SD 1 ATOM 2455 C CE . MET B 2 39 ? -21.631 6.701 25.708 1.00 75.81 ? 39 MET B CE 1 ATOM 2456 N N . LEU B 2 40 ? -25.121 7.659 21.078 1.00 71.84 ? 40 LEU B N 1 ATOM 2457 C CA . LEU B 2 40 ? -26.409 8.130 20.588 1.00 71.80 ? 40 LEU B CA 1 ATOM 2458 C C . LEU B 2 40 ? -27.429 8.420 21.672 1.00 71.30 ? 40 LEU B C 1 ATOM 2459 O O . LEU B 2 40 ? -27.408 7.815 22.732 1.00 70.72 ? 40 LEU B O 1 ATOM 2460 C CB . LEU B 2 40 ? -27.009 7.133 19.599 1.00 70.87 ? 40 LEU B CB 1 ATOM 2461 C CG . LEU B 2 40 ? -26.267 6.732 18.326 1.00 71.10 ? 40 LEU B CG 1 ATOM 2462 C CD1 . LEU B 2 40 ? -26.951 5.478 17.809 1.00 70.09 ? 40 LEU B CD1 1 ATOM 2463 C CD2 . LEU B 2 40 ? -26.254 7.822 17.230 1.00 68.58 ? 40 LEU B CD2 1 ATOM 2464 N N . LYS B 2 41 ? -28.318 9.364 21.372 1.00 71.21 ? 41 LYS B N 1 ATOM 2465 C CA . LYS B 2 41 ? -29.445 9.685 22.225 1.00 70.88 ? 41 LYS B CA 1 ATOM 2466 C C . LYS B 2 41 ? -30.689 9.796 21.351 1.00 71.05 ? 41 LYS B C 1 ATOM 2467 O O . LYS B 2 41 ? -30.805 10.663 20.487 1.00 71.03 ? 41 LYS B O 1 ATOM 2468 C CB . LYS B 2 41 ? -29.211 10.940 23.043 1.00 70.67 ? 41 LYS B CB 1 ATOM 2469 C CG . LYS B 2 41 ? -30.303 11.175 24.062 1.00 71.61 ? 41 LYS B CG 1 ATOM 2470 C CD . LYS B 2 41 ? -30.373 12.614 24.541 1.00 75.17 ? 41 LYS B CD 1 ATOM 2471 C CE . LYS B 2 41 ? -31.540 12.769 25.521 1.00 77.78 ? 41 LYS B CE 1 ATOM 2472 N NZ . LYS B 2 41 ? -31.915 14.188 25.844 1.00 80.14 ? 41 LYS B NZ 1 ATOM 2473 N N . ASN B 2 42 ? -31.621 8.889 21.592 1.00 71.06 ? 42 ASN B N 1 ATOM 2474 C CA . ASN B 2 42 ? -32.825 8.804 20.819 1.00 70.66 ? 42 ASN B CA 1 ATOM 2475 C C . ASN B 2 42 ? -32.502 8.670 19.348 1.00 70.70 ? 42 ASN B C 1 ATOM 2476 O O . ASN B 2 42 ? -33.097 9.348 18.522 1.00 70.47 ? 42 ASN B O 1 ATOM 2477 C CB . ASN B 2 42 ? -33.717 10.008 21.108 1.00 71.11 ? 42 ASN B CB 1 ATOM 2478 C CG . ASN B 2 42 ? -34.181 10.032 22.533 1.00 69.82 ? 42 ASN B CG 1 ATOM 2479 O OD1 . ASN B 2 42 ? -34.309 8.983 23.149 1.00 68.23 ? 42 ASN B OD1 1 ATOM 2480 N ND2 . ASN B 2 42 ? -34.434 11.218 23.068 1.00 68.30 ? 42 ASN B ND2 1 ATOM 2481 N N . GLY B 2 43 ? -31.542 7.790 19.052 1.00 71.07 ? 43 GLY B N 1 ATOM 2482 C CA . GLY B 2 43 ? -31.067 7.512 17.683 1.00 71.77 ? 43 GLY B CA 1 ATOM 2483 C C . GLY B 2 43 ? -30.253 8.615 17.003 1.00 72.07 ? 43 GLY B C 1 ATOM 2484 O O . GLY B 2 43 ? -29.940 8.519 15.802 1.00 71.84 ? 43 GLY B O 1 ATOM 2485 N N . LYS B 2 44 ? -29.915 9.657 17.768 1.00 72.08 ? 44 LYS B N 1 ATOM 2486 C CA . LYS B 2 44 ? -29.208 10.818 17.249 1.00 72.37 ? 44 LYS B CA 1 ATOM 2487 C C . LYS B 2 44 ? -27.879 11.031 17.980 1.00 72.30 ? 44 LYS B C 1 ATOM 2488 O O . LYS B 2 44 ? -27.831 11.086 19.202 1.00 71.18 ? 44 LYS B O 1 ATOM 2489 C CB . LYS B 2 44 ? -30.087 12.065 17.360 1.00 72.93 ? 44 LYS B CB 1 ATOM 2490 C CG . LYS B 2 44 ? -31.499 11.982 16.693 1.00 73.91 ? 44 LYS B CG 1 ATOM 2491 C CD . LYS B 2 44 ? -31.463 12.289 15.205 1.00 77.16 ? 44 LYS B CD 1 ATOM 2492 C CE . LYS B 2 44 ? -31.236 11.066 14.308 1.00 78.55 ? 44 LYS B CE 1 ATOM 2493 N NZ . LYS B 2 44 ? -32.522 10.511 13.779 1.00 79.24 ? 44 LYS B NZ 1 ATOM 2494 N N . LYS B 2 45 ? -26.812 11.143 17.191 1.00 72.97 ? 45 LYS B N 1 ATOM 2495 C CA . LYS B 2 45 ? -25.439 11.415 17.640 1.00 73.54 ? 45 LYS B CA 1 ATOM 2496 C C . LYS B 2 45 ? -25.331 12.554 18.688 1.00 73.53 ? 45 LYS B C 1 ATOM 2497 O O . LYS B 2 45 ? -25.848 13.648 18.489 1.00 73.33 ? 45 LYS B O 1 ATOM 2498 C CB . LYS B 2 45 ? -24.592 11.758 16.402 1.00 73.34 ? 45 LYS B CB 1 ATOM 2499 C CG . LYS B 2 45 ? -23.090 11.576 16.549 1.00 74.29 ? 45 LYS B CG 1 ATOM 2500 C CD . LYS B 2 45 ? -22.337 12.208 15.370 1.00 74.72 ? 45 LYS B CD 1 ATOM 2501 C CE . LYS B 2 45 ? -22.241 13.738 15.509 1.00 76.69 ? 45 LYS B CE 1 ATOM 2502 N NZ . LYS B 2 45 ? -21.814 14.466 14.262 1.00 77.43 ? 45 LYS B NZ 1 ATOM 2503 N N . ILE B 2 46 ? -24.655 12.270 19.797 1.00 74.25 ? 46 ILE B N 1 ATOM 2504 C CA . ILE B 2 46 ? -24.371 13.239 20.855 1.00 74.71 ? 46 ILE B CA 1 ATOM 2505 C C . ILE B 2 46 ? -23.055 13.950 20.465 1.00 75.56 ? 46 ILE B C 1 ATOM 2506 O O . ILE B 2 46 ? -22.097 13.281 20.046 1.00 75.48 ? 46 ILE B O 1 ATOM 2507 C CB . ILE B 2 46 ? -24.245 12.488 22.223 1.00 74.92 ? 46 ILE B CB 1 ATOM 2508 C CG1 . ILE B 2 46 ? -25.527 11.713 22.530 1.00 74.45 ? 46 ILE B CG1 1 ATOM 2509 C CG2 . ILE B 2 46 ? -23.872 13.437 23.388 1.00 74.25 ? 46 ILE B CG2 1 ATOM 2510 C CD1 . ILE B 2 46 ? -25.445 10.872 23.822 1.00 74.43 ? 46 ILE B CD1 1 ATOM 2511 N N . PRO B 2 47 ? -22.992 15.279 20.593 1.00 76.17 ? 47 PRO B N 1 ATOM 2512 C CA . PRO B 2 47 ? -21.833 16.046 20.127 1.00 76.98 ? 47 PRO B CA 1 ATOM 2513 C C . PRO B 2 47 ? -20.625 16.148 21.094 1.00 77.97 ? 47 PRO B C 1 ATOM 2514 O O . PRO B 2 47 ? -19.475 16.208 20.639 1.00 77.98 ? 47 PRO B O 1 ATOM 2515 C CB . PRO B 2 47 ? -22.431 17.450 19.876 1.00 77.32 ? 47 PRO B CB 1 ATOM 2516 C CG . PRO B 2 47 ? -23.905 17.357 20.280 1.00 75.91 ? 47 PRO B CG 1 ATOM 2517 C CD . PRO B 2 47 ? -24.002 16.173 21.186 1.00 76.56 ? 47 PRO B CD 1 ATOM 2518 N N . LYS B 2 48 ? -20.858 16.164 22.403 1.00 78.89 ? 48 LYS B N 1 ATOM 2519 C CA . LYS B 2 48 ? -19.748 16.352 23.329 1.00 79.33 ? 48 LYS B CA 1 ATOM 2520 C C . LYS B 2 48 ? -19.161 15.035 23.875 1.00 79.57 ? 48 LYS B C 1 ATOM 2521 O O . LYS B 2 48 ? -19.023 14.880 25.091 1.00 80.33 ? 48 LYS B O 1 ATOM 2522 C CB . LYS B 2 48 ? -20.173 17.343 24.440 1.00 80.50 ? 48 LYS B CB 1 ATOM 2523 C CG . LYS B 2 48 ? -19.107 17.799 25.487 1.00 79.96 ? 48 LYS B CG 1 ATOM 2524 C CD . LYS B 2 48 ? -17.697 17.992 24.924 1.00 80.67 ? 48 LYS B CD 1 ATOM 2525 C CE . LYS B 2 48 ? -16.842 18.905 25.844 1.00 81.99 ? 48 LYS B CE 1 ATOM 2526 N NZ . LYS B 2 48 ? -16.991 20.363 25.597 1.00 77.63 ? 48 LYS B NZ 1 ATOM 2527 N N . VAL B 2 49 ? -18.814 14.099 22.979 1.00 78.79 ? 49 VAL B N 1 ATOM 2528 C CA . VAL B 2 49 ? -18.270 12.777 23.378 1.00 77.82 ? 49 VAL B CA 1 ATOM 2529 C C . VAL B 2 49 ? -16.734 12.807 23.438 1.00 77.99 ? 49 VAL B C 1 ATOM 2530 O O . VAL B 2 49 ? -16.082 12.886 22.397 1.00 78.58 ? 49 VAL B O 1 ATOM 2531 C CB . VAL B 2 49 ? -18.691 11.667 22.370 1.00 77.90 ? 49 VAL B CB 1 ATOM 2532 C CG1 . VAL B 2 49 ? -18.273 10.271 22.860 1.00 76.61 ? 49 VAL B CG1 1 ATOM 2533 C CG2 . VAL B 2 49 ? -20.185 11.716 22.067 1.00 76.71 ? 49 VAL B CG2 1 ATOM 2534 N N . GLU B 2 50 ? -16.148 12.754 24.636 1.00 77.57 ? 50 GLU B N 1 ATOM 2535 C CA . GLU B 2 50 ? -14.681 12.675 24.763 1.00 77.43 ? 50 GLU B CA 1 ATOM 2536 C C . GLU B 2 50 ? -14.212 11.256 24.562 1.00 76.95 ? 50 GLU B C 1 ATOM 2537 O O . GLU B 2 50 ? -14.934 10.326 24.881 1.00 75.95 ? 50 GLU B O 1 ATOM 2538 C CB . GLU B 2 50 ? -14.169 13.120 26.130 1.00 77.15 ? 50 GLU B CB 1 ATOM 2539 C CG . GLU B 2 50 ? -13.787 14.579 26.203 1.00 82.27 ? 50 GLU B CG 1 ATOM 2540 C CD . GLU B 2 50 ? -14.900 15.410 26.779 1.00 88.38 ? 50 GLU B CD 1 ATOM 2541 O OE1 . GLU B 2 50 ? -15.297 15.111 27.937 1.00 90.20 ? 50 GLU B OE1 1 ATOM 2542 O OE2 . GLU B 2 50 ? -15.368 16.351 26.086 1.00 91.27 ? 50 GLU B OE2 1 ATOM 2543 N N . MET B 2 51 ? -12.998 11.110 24.039 1.00 76.28 ? 51 MET B N 1 ATOM 2544 C CA . MET B 2 51 ? -12.390 9.810 23.857 1.00 76.88 ? 51 MET B CA 1 ATOM 2545 C C . MET B 2 51 ? -10.982 9.621 24.423 1.00 75.37 ? 51 MET B C 1 ATOM 2546 O O . MET B 2 51 ? -10.177 10.541 24.439 1.00 73.46 ? 51 MET B O 1 ATOM 2547 C CB . MET B 2 51 ? -12.472 9.398 22.395 1.00 76.65 ? 51 MET B CB 1 ATOM 2548 C CG . MET B 2 51 ? -13.643 8.493 22.213 1.00 78.16 ? 51 MET B CG 1 ATOM 2549 S SD . MET B 2 51 ? -14.133 8.330 20.536 1.00 81.51 ? 51 MET B SD 1 ATOM 2550 C CE . MET B 2 51 ? -15.519 9.482 20.421 1.00 79.24 ? 51 MET B CE 1 ATOM 2551 N N . SER B 2 52 ? -10.688 8.410 24.888 1.00 73.77 ? 52 SER B N 1 ATOM 2552 C CA . SER B 2 52 ? -9.362 8.186 25.415 1.00 72.95 ? 52 SER B CA 1 ATOM 2553 C C . SER B 2 52 ? -8.396 8.055 24.242 1.00 72.45 ? 52 SER B C 1 ATOM 2554 O O . SER B 2 52 ? -8.813 7.921 23.096 1.00 72.56 ? 52 SER B O 1 ATOM 2555 C CB . SER B 2 52 ? -9.335 6.925 26.304 1.00 72.88 ? 52 SER B CB 1 ATOM 2556 O OG . SER B 2 52 ? -9.678 5.735 25.571 1.00 73.18 ? 52 SER B OG 1 ATOM 2557 N N . ASP B 2 53 ? -7.104 8.090 24.511 1.00 71.85 ? 53 ASP B N 1 ATOM 2558 C CA . ASP B 2 53 ? -6.159 7.740 23.478 1.00 71.65 ? 53 ASP B CA 1 ATOM 2559 C C . ASP B 2 53 ? -6.351 6.267 23.149 1.00 72.94 ? 53 ASP B C 1 ATOM 2560 O O . ASP B 2 53 ? -6.744 5.502 24.016 1.00 72.70 ? 53 ASP B O 1 ATOM 2561 C CB . ASP B 2 53 ? -4.753 7.911 23.976 1.00 72.01 ? 53 ASP B CB 1 ATOM 2562 C CG . ASP B 2 53 ? -4.423 9.353 24.259 1.00 69.82 ? 53 ASP B CG 1 ATOM 2563 O OD1 . ASP B 2 53 ? -4.976 10.234 23.585 1.00 66.67 ? 53 ASP B OD1 1 ATOM 2564 O OD2 . ASP B 2 53 ? -3.628 9.673 25.134 1.00 72.96 ? 53 ASP B OD2 1 ATOM 2565 N N . MET B 2 54 ? -6.077 5.908 21.902 1.00 72.57 ? 54 MET B N 1 ATOM 2566 C CA . MET B 2 54 ? -6.090 4.550 21.478 1.00 74.44 ? 54 MET B CA 1 ATOM 2567 C C . MET B 2 54 ? -4.938 3.955 22.242 1.00 73.47 ? 54 MET B C 1 ATOM 2568 O O . MET B 2 54 ? -3.862 4.520 22.252 1.00 74.09 ? 54 MET B O 1 ATOM 2569 C CB . MET B 2 54 ? -5.863 4.479 19.956 1.00 74.89 ? 54 MET B CB 1 ATOM 2570 C CG . MET B 2 54 ? -5.782 3.078 19.375 1.00 78.22 ? 54 MET B CG 1 ATOM 2571 S SD . MET B 2 54 ? -7.355 2.213 19.282 1.00 83.75 ? 54 MET B SD 1 ATOM 2572 C CE . MET B 2 54 ? -8.250 3.297 18.176 1.00 83.41 ? 54 MET B CE 1 ATOM 2573 N N . SER B 2 55 ? -5.183 2.832 22.903 1.00 72.25 ? 55 SER B N 1 ATOM 2574 C CA . SER B 2 55 ? -4.132 2.084 23.551 1.00 70.72 ? 55 SER B CA 1 ATOM 2575 C C . SER B 2 55 ? -4.336 0.648 23.066 1.00 70.05 ? 55 SER B C 1 ATOM 2576 O O . SER B 2 55 ? -5.287 0.419 22.317 1.00 69.76 ? 55 SER B O 1 ATOM 2577 C CB . SER B 2 55 ? -4.220 2.166 25.051 1.00 70.33 ? 55 SER B CB 1 ATOM 2578 O OG . SER B 2 55 ? -3.070 1.578 25.613 1.00 71.08 ? 55 SER B OG 1 ATOM 2579 N N . PHE B 2 56 ? -3.460 -0.272 23.469 1.00 68.68 ? 56 PHE B N 1 ATOM 2580 C CA . PHE B 2 56 ? -3.616 -1.732 23.198 1.00 68.85 ? 56 PHE B CA 1 ATOM 2581 C C . PHE B 2 56 ? -3.278 -2.591 24.442 1.00 70.25 ? 56 PHE B C 1 ATOM 2582 O O . PHE B 2 56 ? -2.692 -2.095 25.424 1.00 69.88 ? 56 PHE B O 1 ATOM 2583 C CB . PHE B 2 56 ? -2.926 -2.202 21.906 1.00 68.22 ? 56 PHE B CB 1 ATOM 2584 C CG . PHE B 2 56 ? -1.413 -2.165 21.907 1.00 68.77 ? 56 PHE B CG 1 ATOM 2585 C CD1 . PHE B 2 56 ? -0.654 -3.152 22.557 1.00 69.69 ? 56 PHE B CD1 1 ATOM 2586 C CD2 . PHE B 2 56 ? -0.722 -1.144 21.223 1.00 67.38 ? 56 PHE B CD2 1 ATOM 2587 C CE1 . PHE B 2 56 ? 0.757 -3.096 22.531 1.00 67.45 ? 56 PHE B CE1 1 ATOM 2588 C CE2 . PHE B 2 56 ? 0.686 -1.102 21.191 1.00 63.37 ? 56 PHE B CE2 1 ATOM 2589 C CZ . PHE B 2 56 ? 1.413 -2.057 21.846 1.00 65.56 ? 56 PHE B CZ 1 ATOM 2590 N N . SER B 2 57 ? -3.653 -3.858 24.414 1.00 71.37 ? 57 SER B N 1 ATOM 2591 C CA . SER B 2 57 ? -3.567 -4.703 25.590 1.00 72.97 ? 57 SER B CA 1 ATOM 2592 C C . SER B 2 57 ? -2.445 -5.674 25.536 1.00 73.54 ? 57 SER B C 1 ATOM 2593 O O . SER B 2 57 ? -1.725 -5.735 24.547 1.00 73.78 ? 57 SER B O 1 ATOM 2594 C CB . SER B 2 57 ? -4.866 -5.484 25.754 1.00 73.88 ? 57 SER B CB 1 ATOM 2595 O OG . SER B 2 57 ? -5.896 -4.613 26.212 1.00 77.35 ? 57 SER B OG 1 ATOM 2596 N N . LYS B 2 58 ? -2.307 -6.436 26.621 1.00 74.17 ? 58 LYS B N 1 ATOM 2597 C CA . LYS B 2 58 ? -1.311 -7.490 26.720 1.00 74.51 ? 58 LYS B CA 1 ATOM 2598 C C . LYS B 2 58 ? -1.408 -8.336 25.445 1.00 75.04 ? 58 LYS B C 1 ATOM 2599 O O . LYS B 2 58 ? -0.382 -8.608 24.807 1.00 75.43 ? 58 LYS B O 1 ATOM 2600 C CB . LYS B 2 58 ? -1.483 -8.538 27.776 0.00 40.00 ? 58 LYS B CB 1 ATOM 2601 C CG . LYS B 2 58 ? -0.619 -9.807 27.834 0.00 40.00 ? 58 LYS B CG 1 ATOM 2602 C CD . LYS B 2 58 ? 0.576 -9.657 28.816 0.00 40.00 ? 58 LYS B CD 1 ATOM 2603 C CE . LYS B 2 58 ? 1.784 -10.551 28.444 0.00 40.00 ? 58 LYS B CE 1 ATOM 2604 N NZ . LYS B 2 58 ? 2.850 -9.765 27.720 0.00 40.00 ? 58 LYS B NZ 1 ATOM 2605 N N . ASP B 2 59 ? -2.627 -8.739 25.065 1.00 74.65 ? 59 ASP B N 1 ATOM 2606 C CA . ASP B 2 59 ? -2.844 -9.621 23.884 1.00 74.22 ? 59 ASP B CA 1 ATOM 2607 C C . ASP B 2 59 ? -2.780 -8.977 22.470 1.00 73.25 ? 59 ASP B C 1 ATOM 2608 O O . ASP B 2 59 ? -3.104 -9.615 21.461 1.00 73.07 ? 59 ASP B O 1 ATOM 2609 C CB . ASP B 2 59 ? -4.121 -10.484 24.079 1.00 75.20 ? 59 ASP B CB 1 ATOM 2610 C CG . ASP B 2 59 ? -5.434 -9.799 23.613 1.00 76.07 ? 59 ASP B CG 1 ATOM 2611 O OD1 . ASP B 2 59 ? -5.538 -8.561 23.517 1.00 72.97 ? 59 ASP B OD1 1 ATOM 2612 O OD2 . ASP B 2 59 ? -6.441 -10.485 23.308 1.00 79.83 ? 59 ASP B OD2 1 ATOM 2613 N N . TRP B 2 60 ? -2.358 -7.713 22.425 1.00 72.75 ? 60 TRP B N 1 ATOM 2614 C CA . TRP B 2 60 ? -2.125 -6.957 21.193 1.00 72.00 ? 60 TRP B CA 1 ATOM 2615 C C . TRP B 2 60 ? -3.400 -6.355 20.590 1.00 72.11 ? 60 TRP B C 1 ATOM 2616 O O . TRP B 2 60 ? -3.327 -5.659 19.580 1.00 73.09 ? 60 TRP B O 1 ATOM 2617 C CB . TRP B 2 60 ? -1.294 -7.755 20.133 1.00 71.35 ? 60 TRP B CB 1 ATOM 2618 C CG . TRP B 2 60 ? 0.127 -8.175 20.574 1.00 69.79 ? 60 TRP B CG 1 ATOM 2619 C CD1 . TRP B 2 60 ? 0.549 -9.449 20.884 1.00 68.72 ? 60 TRP B CD1 1 ATOM 2620 C CD2 . TRP B 2 60 ? 1.281 -7.327 20.747 1.00 69.81 ? 60 TRP B CD2 1 ATOM 2621 N NE1 . TRP B 2 60 ? 1.876 -9.442 21.233 1.00 68.52 ? 60 TRP B NE1 1 ATOM 2622 C CE2 . TRP B 2 60 ? 2.354 -8.156 21.162 1.00 70.20 ? 60 TRP B CE2 1 ATOM 2623 C CE3 . TRP B 2 60 ? 1.524 -5.941 20.598 1.00 68.54 ? 60 TRP B CE3 1 ATOM 2624 C CZ2 . TRP B 2 60 ? 3.633 -7.654 21.421 1.00 67.97 ? 60 TRP B CZ2 1 ATOM 2625 C CZ3 . TRP B 2 60 ? 2.797 -5.456 20.857 1.00 68.14 ? 60 TRP B CZ3 1 ATOM 2626 C CH2 . TRP B 2 60 ? 3.829 -6.309 21.262 1.00 68.15 ? 60 TRP B CH2 1 ATOM 2627 N N . SER B 2 61 ? -4.561 -6.602 21.196 1.00 72.10 ? 61 SER B N 1 ATOM 2628 C CA . SER B 2 61 ? -5.832 -6.041 20.688 1.00 71.44 ? 61 SER B CA 1 ATOM 2629 C C . SER B 2 61 ? -6.073 -4.600 21.180 1.00 71.02 ? 61 SER B C 1 ATOM 2630 O O . SER B 2 61 ? -5.718 -4.259 22.290 1.00 68.44 ? 61 SER B O 1 ATOM 2631 C CB . SER B 2 61 ? -7.004 -6.931 21.105 1.00 73.09 ? 61 SER B CB 1 ATOM 2632 O OG . SER B 2 61 ? -7.278 -6.714 22.483 1.00 75.13 ? 61 SER B OG 1 ATOM 2633 N N . PHE B 2 62 ? -6.687 -3.770 20.343 1.00 70.42 ? 62 PHE B N 1 ATOM 2634 C CA . PHE B 2 62 ? -6.888 -2.388 20.705 1.00 70.10 ? 62 PHE B CA 1 ATOM 2635 C C . PHE B 2 62 ? -8.138 -2.203 21.538 1.00 70.76 ? 62 PHE B C 1 ATOM 2636 O O . PHE B 2 62 ? -9.059 -3.006 21.502 1.00 71.51 ? 62 PHE B O 1 ATOM 2637 C CB . PHE B 2 62 ? -6.848 -1.472 19.461 1.00 69.83 ? 62 PHE B CB 1 ATOM 2638 C CG . PHE B 2 62 ? -5.520 -1.484 18.742 1.00 68.63 ? 62 PHE B CG 1 ATOM 2639 C CD1 . PHE B 2 62 ? -5.207 -2.482 17.831 1.00 68.26 ? 62 PHE B CD1 1 ATOM 2640 C CD2 . PHE B 2 62 ? -4.573 -0.502 18.983 1.00 67.14 ? 62 PHE B CD2 1 ATOM 2641 C CE1 . PHE B 2 62 ? -3.965 -2.497 17.161 1.00 68.77 ? 62 PHE B CE1 1 ATOM 2642 C CE2 . PHE B 2 62 ? -3.339 -0.513 18.325 1.00 67.03 ? 62 PHE B CE2 1 ATOM 2643 C CZ . PHE B 2 62 ? -3.037 -1.497 17.419 1.00 68.56 ? 62 PHE B CZ 1 ATOM 2644 N N . TYR B 2 63 ? -8.151 -1.133 22.308 1.00 70.69 ? 63 TYR B N 1 ATOM 2645 C CA . TYR B 2 63 ? -9.264 -0.744 23.140 1.00 71.36 ? 63 TYR B CA 1 ATOM 2646 C C . TYR B 2 63 ? -9.298 0.792 23.202 1.00 71.93 ? 63 TYR B C 1 ATOM 2647 O O . TYR B 2 63 ? -8.262 1.443 23.058 1.00 71.63 ? 63 TYR B O 1 ATOM 2648 C CB . TYR B 2 63 ? -9.199 -1.359 24.550 1.00 72.50 ? 63 TYR B CB 1 ATOM 2649 C CG . TYR B 2 63 ? -8.025 -0.958 25.474 1.00 73.10 ? 63 TYR B CG 1 ATOM 2650 C CD1 . TYR B 2 63 ? -8.038 0.236 26.203 1.00 74.80 ? 63 TYR B CD1 1 ATOM 2651 C CD2 . TYR B 2 63 ? -6.908 -1.795 25.609 1.00 75.25 ? 63 TYR B CD2 1 ATOM 2652 C CE1 . TYR B 2 63 ? -6.933 0.599 27.060 1.00 74.01 ? 63 TYR B CE1 1 ATOM 2653 C CE2 . TYR B 2 63 ? -5.813 -1.468 26.452 1.00 74.62 ? 63 TYR B CE2 1 ATOM 2654 C CZ . TYR B 2 63 ? -5.832 -0.275 27.167 1.00 75.24 ? 63 TYR B CZ 1 ATOM 2655 O OH . TYR B 2 63 ? -4.742 -0.001 27.970 1.00 75.87 ? 63 TYR B OH 1 ATOM 2656 N N . ILE B 2 64 ? -10.489 1.340 23.400 1.00 71.49 ? 64 ILE B N 1 ATOM 2657 C CA . ILE B 2 64 ? -10.655 2.756 23.645 1.00 72.82 ? 64 ILE B CA 1 ATOM 2658 C C . ILE B 2 64 ? -11.877 2.892 24.563 1.00 71.96 ? 64 ILE B C 1 ATOM 2659 O O . ILE B 2 64 ? -12.720 1.946 24.659 1.00 71.25 ? 64 ILE B O 1 ATOM 2660 C CB . ILE B 2 64 ? -10.733 3.564 22.292 1.00 72.83 ? 64 ILE B CB 1 ATOM 2661 C CG1 . ILE B 2 64 ? -10.706 5.063 22.496 1.00 76.31 ? 64 ILE B CG1 1 ATOM 2662 C CG2 . ILE B 2 64 ? -11.954 3.260 21.524 1.00 74.15 ? 64 ILE B CG2 1 ATOM 2663 C CD1 . ILE B 2 64 ? -10.537 5.847 21.145 1.00 74.54 ? 64 ILE B CD1 1 ATOM 2664 N N . LEU B 2 65 ? -11.943 4.045 25.226 1.00 70.57 ? 65 LEU B N 1 ATOM 2665 C CA . LEU B 2 65 ? -13.054 4.466 26.061 1.00 70.76 ? 65 LEU B CA 1 ATOM 2666 C C . LEU B 2 65 ? -13.607 5.797 25.557 1.00 72.01 ? 65 LEU B C 1 ATOM 2667 O O . LEU B 2 65 ? -12.883 6.808 25.414 1.00 72.82 ? 65 LEU B O 1 ATOM 2668 C CB . LEU B 2 65 ? -12.639 4.644 27.517 1.00 70.12 ? 65 LEU B CB 1 ATOM 2669 C CG . LEU B 2 65 ? -13.640 5.068 28.597 1.00 69.22 ? 65 LEU B CG 1 ATOM 2670 C CD1 . LEU B 2 65 ? -14.802 4.137 28.754 1.00 68.99 ? 65 LEU B CD1 1 ATOM 2671 C CD2 . LEU B 2 65 ? -12.875 5.211 29.947 1.00 70.52 ? 65 LEU B CD2 1 ATOM 2672 N N . ALA B 2 66 ? -14.905 5.761 25.299 1.00 71.92 ? 66 ALA B N 1 ATOM 2673 C CA . ALA B 2 66 ? -15.672 6.897 24.904 1.00 72.24 ? 66 ALA B CA 1 ATOM 2674 C C . ALA B 2 66 ? -16.575 7.184 26.092 1.00 72.02 ? 66 ALA B C 1 ATOM 2675 O O . ALA B 2 66 ? -17.102 6.236 26.733 1.00 70.76 ? 66 ALA B O 1 ATOM 2676 C CB . ALA B 2 66 ? -16.487 6.519 23.697 1.00 71.75 ? 66 ALA B CB 1 ATOM 2677 N N . HIS B 2 67 ? -16.761 8.463 26.400 1.00 69.84 ? 67 HIS B N 1 ATOM 2678 C CA . HIS B 2 67 ? -17.657 8.807 27.501 1.00 70.86 ? 67 HIS B CA 1 ATOM 2679 C C . HIS B 2 67 ? -18.283 10.201 27.385 1.00 70.94 ? 67 HIS B C 1 ATOM 2680 O O . HIS B 2 67 ? -17.692 11.123 26.833 1.00 71.22 ? 67 HIS B O 1 ATOM 2681 C CB . HIS B 2 67 ? -16.927 8.743 28.856 1.00 70.97 ? 67 HIS B CB 1 ATOM 2682 C CG . HIS B 2 67 ? -15.886 9.801 29.015 1.00 71.93 ? 67 HIS B CG 1 ATOM 2683 N ND1 . HIS B 2 67 ? -16.176 11.061 29.500 1.00 76.91 ? 67 HIS B ND1 1 ATOM 2684 C CD2 . HIS B 2 67 ? -14.555 9.794 28.752 1.00 72.35 ? 67 HIS B CD2 1 ATOM 2685 C CE1 . HIS B 2 67 ? -15.069 11.784 29.538 1.00 70.98 ? 67 HIS B CE1 1 ATOM 2686 N NE2 . HIS B 2 67 ? -14.073 11.039 29.090 1.00 74.30 ? 67 HIS B NE2 1 ATOM 2687 N N . THR B 2 68 ? -19.476 10.343 27.939 1.00 70.54 ? 68 THR B N 1 ATOM 2688 C CA . THR B 2 68 ? -20.175 11.589 27.831 1.00 70.90 ? 68 THR B CA 1 ATOM 2689 C C . THR B 2 68 ? -21.068 11.842 29.020 1.00 70.82 ? 68 THR B C 1 ATOM 2690 O O . THR B 2 68 ? -21.603 10.919 29.628 1.00 71.74 ? 68 THR B O 1 ATOM 2691 C CB . THR B 2 68 ? -20.965 11.631 26.501 1.00 69.95 ? 68 THR B CB 1 ATOM 2692 O OG1 . THR B 2 68 ? -21.330 12.986 26.193 1.00 73.75 ? 68 THR B OG1 1 ATOM 2693 C CG2 . THR B 2 68 ? -22.278 10.879 26.594 1.00 71.87 ? 68 THR B CG2 1 ATOM 2694 N N . GLU B 2 69 ? -21.228 13.115 29.348 1.00 70.42 ? 69 GLU B N 1 ATOM 2695 C CA . GLU B 2 69 ? -22.162 13.524 30.359 1.00 70.40 ? 69 GLU B CA 1 ATOM 2696 C C . GLU B 2 69 ? -23.578 13.223 29.874 1.00 71.83 ? 69 GLU B C 1 ATOM 2697 O O . GLU B 2 69 ? -23.907 13.476 28.709 1.00 72.48 ? 69 GLU B O 1 ATOM 2698 C CB . GLU B 2 69 ? -21.992 15.026 30.608 1.00 70.62 ? 69 GLU B CB 1 ATOM 2699 C CG . GLU B 2 69 ? -20.607 15.430 31.123 1.00 67.86 ? 69 GLU B CG 1 ATOM 2700 C CD . GLU B 2 69 ? -20.461 16.958 31.228 1.00 70.79 ? 69 GLU B CD 1 ATOM 2701 O OE1 . GLU B 2 69 ? -21.509 17.628 31.363 1.00 69.36 ? 69 GLU B OE1 1 ATOM 2702 O OE2 . GLU B 2 69 ? -19.322 17.480 31.170 1.00 68.51 ? 69 GLU B OE2 1 ATOM 2703 N N . PHE B 2 70 ? -24.417 12.677 30.753 1.00 72.44 ? 70 PHE B N 1 ATOM 2704 C CA . PHE B 2 70 ? -25.832 12.400 30.423 1.00 72.66 ? 70 PHE B CA 1 ATOM 2705 C C . PHE B 2 70 ? -26.668 12.345 31.690 1.00 73.20 ? 70 PHE B C 1 ATOM 2706 O O . PHE B 2 70 ? -26.149 12.134 32.809 1.00 73.54 ? 70 PHE B O 1 ATOM 2707 C CB . PHE B 2 70 ? -26.015 11.098 29.592 1.00 72.39 ? 70 PHE B CB 1 ATOM 2708 C CG . PHE B 2 70 ? -26.230 9.833 30.404 1.00 71.99 ? 70 PHE B CG 1 ATOM 2709 C CD1 . PHE B 2 70 ? -25.400 9.487 31.468 1.00 72.98 ? 70 PHE B CD1 1 ATOM 2710 C CD2 . PHE B 2 70 ? -27.286 8.960 30.068 1.00 75.65 ? 70 PHE B CD2 1 ATOM 2711 C CE1 . PHE B 2 70 ? -25.606 8.314 32.198 1.00 72.36 ? 70 PHE B CE1 1 ATOM 2712 C CE2 . PHE B 2 70 ? -27.514 7.778 30.777 1.00 73.51 ? 70 PHE B CE2 1 ATOM 2713 C CZ . PHE B 2 70 ? -26.675 7.449 31.848 1.00 73.48 ? 70 PHE B CZ 1 ATOM 2714 N N . THR B 2 71 ? -27.959 12.537 31.509 1.00 73.28 ? 71 THR B N 1 ATOM 2715 C CA . THR B 2 71 ? -28.877 12.421 32.594 1.00 73.77 ? 71 THR B CA 1 ATOM 2716 C C . THR B 2 71 ? -29.958 11.449 32.190 1.00 74.23 ? 71 THR B C 1 ATOM 2717 O O . THR B 2 71 ? -30.738 11.712 31.277 1.00 75.18 ? 71 THR B O 1 ATOM 2718 C CB . THR B 2 71 ? -29.361 13.815 33.167 1.00 73.99 ? 71 THR B CB 1 ATOM 2719 O OG1 . THR B 2 71 ? -30.784 13.805 33.342 1.00 75.13 ? 71 THR B OG1 1 ATOM 2720 C CG2 . THR B 2 71 ? -29.114 14.964 32.207 1.00 73.39 ? 71 THR B CG2 1 ATOM 2721 N N . PRO B 2 72 ? -29.966 10.301 32.871 1.00 74.30 ? 72 PRO B N 1 ATOM 2722 C CA . PRO B 2 72 ? -30.944 9.245 32.644 1.00 74.18 ? 72 PRO B CA 1 ATOM 2723 C C . PRO B 2 72 ? -32.388 9.737 32.787 1.00 74.94 ? 72 PRO B C 1 ATOM 2724 O O . PRO B 2 72 ? -32.725 10.521 33.700 1.00 74.25 ? 72 PRO B O 1 ATOM 2725 C CB . PRO B 2 72 ? -30.640 8.231 33.752 1.00 74.27 ? 72 PRO B CB 1 ATOM 2726 C CG . PRO B 2 72 ? -29.286 8.502 34.172 1.00 73.89 ? 72 PRO B CG 1 ATOM 2727 C CD . PRO B 2 72 ? -29.001 9.945 33.925 1.00 74.05 ? 72 PRO B CD 1 ATOM 2728 N N . THR B 2 73 ? -33.222 9.260 31.872 1.00 75.18 ? 73 THR B N 1 ATOM 2729 C CA . THR B 2 73 ? -34.617 9.605 31.808 1.00 75.39 ? 73 THR B CA 1 ATOM 2730 C C . THR B 2 73 ? -35.403 8.369 31.398 1.00 76.05 ? 73 THR B C 1 ATOM 2731 O O . THR B 2 73 ? -34.840 7.383 30.905 1.00 75.85 ? 73 THR B O 1 ATOM 2732 C CB . THR B 2 73 ? -34.793 10.775 30.847 1.00 75.75 ? 73 THR B CB 1 ATOM 2733 O OG1 . THR B 2 73 ? -34.755 11.988 31.603 1.00 76.56 ? 73 THR B OG1 1 ATOM 2734 C CG2 . THR B 2 73 ? -36.176 10.832 30.245 1.00 75.56 ? 73 THR B CG2 1 ATOM 2735 N N . GLU B 2 74 ? -36.709 8.438 31.626 1.00 76.03 ? 74 GLU B N 1 ATOM 2736 C CA . GLU B 2 74 ? -37.629 7.357 31.368 1.00 76.52 ? 74 GLU B CA 1 ATOM 2737 C C . GLU B 2 74 ? -38.243 7.510 29.977 1.00 75.96 ? 74 GLU B C 1 ATOM 2738 O O . GLU B 2 74 ? -39.142 6.761 29.604 1.00 76.06 ? 74 GLU B O 1 ATOM 2739 C CB . GLU B 2 74 ? -38.718 7.357 32.467 1.00 77.44 ? 74 GLU B CB 1 ATOM 2740 C CG . GLU B 2 74 ? -39.499 8.676 32.643 1.00 79.46 ? 74 GLU B CG 1 ATOM 2741 C CD . GLU B 2 74 ? -38.668 9.869 33.165 1.00 82.42 ? 74 GLU B CD 1 ATOM 2742 O OE1 . GLU B 2 74 ? -38.859 10.985 32.625 1.00 84.19 ? 74 GLU B OE1 1 ATOM 2743 O OE2 . GLU B 2 74 ? -37.832 9.720 34.098 1.00 81.77 ? 74 GLU B OE2 1 ATOM 2744 N N . THR B 2 75 ? -37.756 8.488 29.218 1.00 74.87 ? 75 THR B N 1 ATOM 2745 C CA . THR B 2 75 ? -38.209 8.702 27.842 1.00 74.36 ? 75 THR B CA 1 ATOM 2746 C C . THR B 2 75 ? -37.071 8.640 26.806 1.00 73.56 ? 75 THR B C 1 ATOM 2747 O O . THR B 2 75 ? -37.338 8.587 25.598 1.00 73.37 ? 75 THR B O 1 ATOM 2748 C CB . THR B 2 75 ? -38.961 10.037 27.701 1.00 74.53 ? 75 THR B CB 1 ATOM 2749 O OG1 . THR B 2 75 ? -38.296 11.021 28.502 1.00 75.06 ? 75 THR B OG1 1 ATOM 2750 C CG2 . THR B 2 75 ? -40.332 9.954 28.300 1.00 73.46 ? 75 THR B CG2 1 ATOM 2751 N N . ASP B 2 76 ? -35.829 8.639 27.278 1.00 71.99 ? 76 ASP B N 1 ATOM 2752 C CA . ASP B 2 76 ? -34.665 8.674 26.403 1.00 71.81 ? 76 ASP B CA 1 ATOM 2753 C C . ASP B 2 76 ? -33.929 7.356 26.354 1.00 71.48 ? 76 ASP B C 1 ATOM 2754 O O . ASP B 2 76 ? -33.683 6.778 27.404 1.00 71.88 ? 76 ASP B O 1 ATOM 2755 C CB . ASP B 2 76 ? -33.682 9.720 26.898 1.00 71.14 ? 76 ASP B CB 1 ATOM 2756 C CG . ASP B 2 76 ? -34.252 11.116 26.882 1.00 72.97 ? 76 ASP B CG 1 ATOM 2757 O OD1 . ASP B 2 76 ? -34.777 11.555 25.822 1.00 72.03 ? 76 ASP B OD1 1 ATOM 2758 O OD2 . ASP B 2 76 ? -34.208 11.853 27.899 1.00 73.25 ? 76 ASP B OD2 1 ATOM 2759 N N . THR B 2 77 ? -33.583 6.887 25.148 1.00 70.91 ? 77 THR B N 1 ATOM 2760 C CA . THR B 2 77 ? -32.716 5.721 24.990 1.00 70.76 ? 77 THR B CA 1 ATOM 2761 C C . THR B 2 77 ? -31.328 6.210 24.610 1.00 70.55 ? 77 THR B C 1 ATOM 2762 O O . THR B 2 77 ? -31.225 7.064 23.737 1.00 71.11 ? 77 THR B O 1 ATOM 2763 C CB . THR B 2 77 ? -33.182 4.810 23.857 1.00 70.99 ? 77 THR B CB 1 ATOM 2764 O OG1 . THR B 2 77 ? -33.149 5.555 22.635 1.00 72.45 ? 77 THR B OG1 1 ATOM 2765 C CG2 . THR B 2 77 ? -34.626 4.375 24.020 1.00 69.45 ? 77 THR B CG2 1 ATOM 2766 N N . TYR B 2 78 ? -30.284 5.683 25.257 1.00 69.70 ? 78 TYR B N 1 ATOM 2767 C CA . TYR B 2 78 ? -28.874 5.950 24.901 1.00 69.35 ? 78 TYR B CA 1 ATOM 2768 C C . TYR B 2 78 ? -28.260 4.685 24.288 1.00 69.67 ? 78 TYR B C 1 ATOM 2769 O O . TYR B 2 78 ? -28.632 3.582 24.664 1.00 69.70 ? 78 TYR B O 1 ATOM 2770 C CB . TYR B 2 78 ? -28.029 6.481 26.103 1.00 68.85 ? 78 TYR B CB 1 ATOM 2771 C CG . TYR B 2 78 ? -28.640 7.724 26.698 1.00 68.11 ? 78 TYR B CG 1 ATOM 2772 C CD1 . TYR B 2 78 ? -29.671 7.626 27.632 1.00 69.59 ? 78 TYR B CD1 1 ATOM 2773 C CD2 . TYR B 2 78 ? -28.220 8.989 26.314 1.00 67.88 ? 78 TYR B CD2 1 ATOM 2774 C CE1 . TYR B 2 78 ? -30.263 8.746 28.182 1.00 69.82 ? 78 TYR B CE1 1 ATOM 2775 C CE2 . TYR B 2 78 ? -28.805 10.131 26.858 1.00 69.41 ? 78 TYR B CE2 1 ATOM 2776 C CZ . TYR B 2 78 ? -29.827 10.001 27.795 1.00 69.93 ? 78 TYR B CZ 1 ATOM 2777 O OH . TYR B 2 78 ? -30.436 11.109 28.354 1.00 70.19 ? 78 TYR B OH 1 ATOM 2778 N N . ALA B 2 79 ? -27.326 4.860 23.350 1.00 69.56 ? 79 ALA B N 1 ATOM 2779 C CA . ALA B 2 79 ? -26.674 3.733 22.669 1.00 70.52 ? 79 ALA B CA 1 ATOM 2780 C C . ALA B 2 79 ? -25.195 3.999 22.301 1.00 71.10 ? 79 ALA B C 1 ATOM 2781 O O . ALA B 2 79 ? -24.727 5.126 22.343 1.00 70.53 ? 79 ALA B O 1 ATOM 2782 C CB . ALA B 2 79 ? -27.455 3.367 21.423 1.00 68.48 ? 79 ALA B CB 1 ATOM 2783 N N . CYS B 2 80 ? -24.472 2.948 21.937 1.00 72.58 ? 80 CYS B N 1 ATOM 2784 C CA . CYS B 2 80 ? -23.122 3.110 21.395 1.00 73.25 ? 80 CYS B CA 1 ATOM 2785 C C . CYS B 2 80 ? -23.097 2.478 20.001 1.00 73.62 ? 80 CYS B C 1 ATOM 2786 O O . CYS B 2 80 ? -23.527 1.339 19.826 1.00 74.40 ? 80 CYS B O 1 ATOM 2787 C CB . CYS B 2 80 ? -22.064 2.568 22.367 1.00 74.40 ? 80 CYS B CB 1 ATOM 2788 S SG . CYS B 2 80 ? -20.341 3.071 22.041 1.00 75.11 ? 80 CYS B SG 1 ATOM 2789 N N . ARG B 2 81 ? -22.619 3.221 19.000 1.00 73.24 ? 81 ARG B N 1 ATOM 2790 C CA . ARG B 2 81 ? -22.564 2.703 17.634 1.00 72.44 ? 81 ARG B CA 1 ATOM 2791 C C . ARG B 2 81 ? -21.154 2.659 17.099 1.00 72.39 ? 81 ARG B C 1 ATOM 2792 O O . ARG B 2 81 ? -20.447 3.670 17.081 1.00 71.93 ? 81 ARG B O 1 ATOM 2793 C CB . ARG B 2 81 ? -23.469 3.495 16.691 1.00 73.17 ? 81 ARG B CB 1 ATOM 2794 C CG . ARG B 2 81 ? -23.585 2.943 15.274 1.00 71.29 ? 81 ARG B CG 1 ATOM 2795 C CD . ARG B 2 81 ? -24.682 3.607 14.483 1.00 72.56 ? 81 ARG B CD 1 ATOM 2796 N NE . ARG B 2 81 ? -25.970 3.360 15.117 1.00 73.62 ? 81 ARG B NE 1 ATOM 2797 C CZ . ARG B 2 81 ? -27.151 3.787 14.673 1.00 75.30 ? 81 ARG B CZ 1 ATOM 2798 N NH1 . ARG B 2 81 ? -27.260 4.510 13.563 1.00 73.90 ? 81 ARG B NH1 1 ATOM 2799 N NH2 . ARG B 2 81 ? -28.243 3.484 15.355 1.00 77.16 ? 81 ARG B NH2 1 ATOM 2800 N N . VAL B 2 82 ? -20.764 1.468 16.660 1.00 71.46 ? 82 VAL B N 1 ATOM 2801 C CA . VAL B 2 82 ? -19.403 1.210 16.221 1.00 70.67 ? 82 VAL B CA 1 ATOM 2802 C C . VAL B 2 82 ? -19.298 0.719 14.794 1.00 70.40 ? 82 VAL B C 1 ATOM 2803 O O . VAL B 2 82 ? -19.945 -0.265 14.420 1.00 70.00 ? 82 VAL B O 1 ATOM 2804 C CB . VAL B 2 82 ? -18.694 0.199 17.194 1.00 71.25 ? 82 VAL B CB 1 ATOM 2805 C CG1 . VAL B 2 82 ? -17.378 -0.356 16.608 1.00 69.31 ? 82 VAL B CG1 1 ATOM 2806 C CG2 . VAL B 2 82 ? -18.445 0.874 18.558 1.00 70.40 ? 82 VAL B CG2 1 ATOM 2807 N N . LYS B 2 83 ? -18.474 1.427 14.018 1.00 69.88 ? 83 LYS B N 1 ATOM 2808 C CA . LYS B 2 83 ? -18.115 1.058 12.638 1.00 69.34 ? 83 LYS B CA 1 ATOM 2809 C C . LYS B 2 83 ? -16.648 0.560 12.639 1.00 68.64 ? 83 LYS B C 1 ATOM 2810 O O . LYS B 2 83 ? -15.734 1.263 13.070 1.00 67.77 ? 83 LYS B O 1 ATOM 2811 C CB . LYS B 2 83 ? -18.290 2.087 11.785 0.00 40.00 ? 83 LYS B CB 1 ATOM 2812 C CG . LYS B 2 83 ? -18.747 1.627 10.427 0.00 40.00 ? 83 LYS B CG 1 ATOM 2813 C CD . LYS B 2 83 ? -18.480 2.676 9.328 0.00 40.00 ? 83 LYS B CD 1 ATOM 2814 C CE . LYS B 2 83 ? -19.442 2.481 8.137 0.00 40.00 ? 83 LYS B CE 1 ATOM 2815 N NZ . LYS B 2 83 ? -19.912 1.051 7.982 0.00 40.00 ? 83 LYS B NZ 1 ATOM 2816 N N . HIS B 2 84 ? -16.450 -0.658 12.157 1.00 68.25 ? 84 HIS B N 1 ATOM 2817 C CA . HIS B 2 84 ? -15.138 -1.252 12.061 1.00 68.35 ? 84 HIS B CA 1 ATOM 2818 C C . HIS B 2 84 ? -15.111 -2.117 10.816 1.00 68.67 ? 84 HIS B C 1 ATOM 2819 O O . HIS B 2 84 ? -16.126 -2.688 10.448 1.00 69.17 ? 84 HIS B O 1 ATOM 2820 C CB . HIS B 2 84 ? -14.818 -2.073 13.307 1.00 67.95 ? 84 HIS B CB 1 ATOM 2821 C CG . HIS B 2 84 ? -13.390 -2.531 13.368 1.00 68.64 ? 84 HIS B CG 1 ATOM 2822 N ND1 . HIS B 2 84 ? -13.023 -3.852 13.238 1.00 69.06 ? 84 HIS B ND1 1 ATOM 2823 C CD2 . HIS B 2 84 ? -12.237 -1.839 13.538 1.00 68.45 ? 84 HIS B CD2 1 ATOM 2824 C CE1 . HIS B 2 84 ? -11.709 -3.960 13.330 1.00 66.74 ? 84 HIS B CE1 1 ATOM 2825 N NE2 . HIS B 2 84 ? -11.207 -2.751 13.511 1.00 69.12 ? 84 HIS B NE2 1 ATOM 2826 N N . ALA B 2 85 ? -13.954 -2.214 10.166 1.00 69.42 ? 85 ALA B N 1 ATOM 2827 C CA . ALA B 2 85 ? -13.835 -2.931 8.887 1.00 70.20 ? 85 ALA B CA 1 ATOM 2828 C C . ALA B 2 85 ? -14.152 -4.426 8.967 1.00 70.97 ? 85 ALA B C 1 ATOM 2829 O O . ALA B 2 85 ? -14.517 -5.030 7.956 1.00 71.50 ? 85 ALA B O 1 ATOM 2830 C CB . ALA B 2 85 ? -12.476 -2.644 8.168 1.00 69.74 ? 85 ALA B CB 1 ATOM 2831 N N . SER B 2 86 ? -14.030 -5.022 10.152 1.00 71.96 ? 86 SER B N 1 ATOM 2832 C CA . SER B 2 86 ? -14.412 -6.431 10.330 1.00 72.85 ? 86 SER B CA 1 ATOM 2833 C C . SER B 2 86 ? -15.922 -6.672 10.426 1.00 73.40 ? 86 SER B C 1 ATOM 2834 O O . SER B 2 86 ? -16.358 -7.832 10.459 1.00 73.99 ? 86 SER B O 1 ATOM 2835 C CB . SER B 2 86 ? -13.740 -7.017 11.544 1.00 72.80 ? 86 SER B CB 1 ATOM 2836 O OG . SER B 2 86 ? -13.963 -6.160 12.646 1.00 75.70 ? 86 SER B OG 1 ATOM 2837 N N . MET B 2 87 ? -16.725 -5.606 10.461 1.00 73.82 ? 87 MET B N 1 ATOM 2838 C CA . MET B 2 87 ? -18.185 -5.776 10.486 1.00 74.92 ? 87 MET B CA 1 ATOM 2839 C C . MET B 2 87 ? -18.882 -5.307 9.201 1.00 74.82 ? 87 MET B C 1 ATOM 2840 O O . MET B 2 87 ? -18.458 -4.345 8.553 1.00 75.29 ? 87 MET B O 1 ATOM 2841 C CB . MET B 2 87 ? -18.812 -5.113 11.699 1.00 74.17 ? 87 MET B CB 1 ATOM 2842 C CG . MET B 2 87 ? -17.899 -5.147 12.899 1.00 76.73 ? 87 MET B CG 1 ATOM 2843 S SD . MET B 2 87 ? -18.822 -5.117 14.411 1.00 76.26 ? 87 MET B SD 1 ATOM 2844 C CE . MET B 2 87 ? -19.316 -6.850 14.463 1.00 78.23 ? 87 MET B CE 1 ATOM 2845 N N . ALA B 2 88 ? -19.955 -6.001 8.847 1.00 74.68 ? 88 ALA B N 1 ATOM 2846 C CA . ALA B 2 88 ? -20.685 -5.718 7.612 1.00 74.65 ? 88 ALA B CA 1 ATOM 2847 C C . ALA B 2 88 ? -21.321 -4.322 7.668 1.00 74.52 ? 88 ALA B C 1 ATOM 2848 O O . ALA B 2 88 ? -21.122 -3.511 6.755 1.00 74.85 ? 88 ALA B O 1 ATOM 2849 C CB . ALA B 2 88 ? -21.726 -6.785 7.367 1.00 74.26 ? 88 ALA B CB 1 ATOM 2850 N N . GLU B 2 89 ? -22.075 -4.059 8.740 1.00 73.90 ? 89 GLU B N 1 ATOM 2851 C CA . GLU B 2 89 ? -22.719 -2.771 8.972 1.00 72.67 ? 89 GLU B CA 1 ATOM 2852 C C . GLU B 2 89 ? -22.309 -2.344 10.363 1.00 72.26 ? 89 GLU B C 1 ATOM 2853 O O . GLU B 2 89 ? -21.764 -3.153 11.112 1.00 71.82 ? 89 GLU B O 1 ATOM 2854 C CB . GLU B 2 89 ? -24.401 -3.142 8.939 0.00 40.00 ? 89 GLU B CB 1 ATOM 2855 C CG . GLU B 2 89 ? -24.926 -4.512 9.393 0.00 40.00 ? 89 GLU B CG 1 ATOM 2856 C CD . GLU B 2 89 ? -26.325 -4.451 10.019 0.00 40.00 ? 89 GLU B CD 1 ATOM 2857 O OE1 . GLU B 2 89 ? -27.327 -4.751 9.321 0.00 40.00 ? 89 GLU B OE1 1 ATOM 2858 O OE2 . GLU B 2 89 ? -26.424 -4.101 11.220 0.00 40.00 ? 89 GLU B OE2 1 ATOM 2859 N N . PRO B 2 90 ? -22.556 -1.089 10.731 1.00 72.23 ? 90 PRO B N 1 ATOM 2860 C CA . PRO B 2 90 ? -22.220 -0.626 12.087 1.00 71.56 ? 90 PRO B CA 1 ATOM 2861 C C . PRO B 2 90 ? -22.930 -1.505 13.137 1.00 71.21 ? 90 PRO B C 1 ATOM 2862 O O . PRO B 2 90 ? -23.988 -2.067 12.864 1.00 71.05 ? 90 PRO B O 1 ATOM 2863 C CB . PRO B 2 90 ? -22.761 0.813 12.124 1.00 71.77 ? 90 PRO B CB 1 ATOM 2864 C CG . PRO B 2 90 ? -22.929 1.224 10.702 1.00 72.02 ? 90 PRO B CG 1 ATOM 2865 C CD . PRO B 2 90 ? -23.171 -0.029 9.909 1.00 72.12 ? 90 PRO B CD 1 ATOM 2866 N N . LYS B 2 91 ? -22.357 -1.633 14.322 1.00 70.63 ? 91 LYS B N 1 ATOM 2867 C CA . LYS B 2 91 ? -22.976 -2.413 15.389 1.00 70.44 ? 91 LYS B CA 1 ATOM 2868 C C . LYS B 2 91 ? -23.372 -1.476 16.549 1.00 69.51 ? 91 LYS B C 1 ATOM 2869 O O . LYS B 2 91 ? -22.533 -0.795 17.079 1.00 68.53 ? 91 LYS B O 1 ATOM 2870 C CB . LYS B 2 91 ? -22.011 -3.490 15.883 1.00 70.31 ? 91 LYS B CB 1 ATOM 2871 C CG . LYS B 2 91 ? -22.567 -4.314 17.013 1.00 74.50 ? 91 LYS B CG 1 ATOM 2872 C CD . LYS B 2 91 ? -21.454 -4.803 17.944 1.00 79.39 ? 91 LYS B CD 1 ATOM 2873 C CE . LYS B 2 91 ? -20.754 -6.105 17.456 1.00 81.54 ? 91 LYS B CE 1 ATOM 2874 N NZ . LYS B 2 91 ? -19.651 -6.574 18.394 1.00 80.34 ? 91 LYS B NZ 1 ATOM 2875 N N . THR B 2 92 ? -24.650 -1.458 16.924 1.00 68.84 ? 92 THR B N 1 ATOM 2876 C CA . THR B 2 92 ? -25.115 -0.620 18.045 1.00 68.14 ? 92 THR B CA 1 ATOM 2877 C C . THR B 2 92 ? -25.412 -1.448 19.305 1.00 67.85 ? 92 THR B C 1 ATOM 2878 O O . THR B 2 92 ? -26.003 -2.521 19.259 1.00 66.66 ? 92 THR B O 1 ATOM 2879 C CB . THR B 2 92 ? -26.427 0.127 17.707 1.00 68.55 ? 92 THR B CB 1 ATOM 2880 O OG1 . THR B 2 92 ? -26.484 0.512 16.328 1.00 68.98 ? 92 THR B OG1 1 ATOM 2881 C CG2 . THR B 2 92 ? -26.538 1.418 18.469 1.00 66.58 ? 92 THR B CG2 1 ATOM 2882 N N . VAL B 2 93 ? -24.988 -0.942 20.446 1.00 67.76 ? 93 VAL B N 1 ATOM 2883 C CA . VAL B 2 93 ? -25.512 -1.491 21.673 1.00 67.48 ? 93 VAL B CA 1 ATOM 2884 C C . VAL B 2 93 ? -26.113 -0.452 22.595 1.00 67.87 ? 93 VAL B C 1 ATOM 2885 O O . VAL B 2 93 ? -25.506 0.609 22.889 1.00 65.93 ? 93 VAL B O 1 ATOM 2886 C CB . VAL B 2 93 ? -24.596 -2.523 22.356 1.00 67.90 ? 93 VAL B CB 1 ATOM 2887 C CG1 . VAL B 2 93 ? -23.367 -2.799 21.519 1.00 66.37 ? 93 VAL B CG1 1 ATOM 2888 C CG2 . VAL B 2 93 ? -24.346 -2.188 23.840 1.00 67.59 ? 93 VAL B CG2 1 ATOM 2889 N N . TYR B 2 94 ? -27.327 -0.779 23.034 1.00 68.01 ? 94 TYR B N 1 ATOM 2890 C CA . TYR B 2 94 ? -28.118 0.121 23.834 1.00 69.08 ? 94 TYR B CA 1 ATOM 2891 C C . TYR B 2 94 ? -27.726 0.019 25.272 1.00 69.88 ? 94 TYR B C 1 ATOM 2892 O O . TYR B 2 94 ? -27.426 -1.069 25.753 1.00 69.20 ? 94 TYR B O 1 ATOM 2893 C CB . TYR B 2 94 ? -29.633 -0.118 23.618 1.00 69.46 ? 94 TYR B CB 1 ATOM 2894 C CG . TYR B 2 94 ? -30.058 0.475 22.319 1.00 68.62 ? 94 TYR B CG 1 ATOM 2895 C CD1 . TYR B 2 94 ? -29.878 -0.221 21.142 1.00 70.19 ? 94 TYR B CD1 1 ATOM 2896 C CD2 . TYR B 2 94 ? -30.620 1.748 22.267 1.00 68.72 ? 94 TYR B CD2 1 ATOM 2897 C CE1 . TYR B 2 94 ? -30.259 0.331 19.919 1.00 71.69 ? 94 TYR B CE1 1 ATOM 2898 C CE2 . TYR B 2 94 ? -31.001 2.314 21.053 1.00 68.63 ? 94 TYR B CE2 1 ATOM 2899 C CZ . TYR B 2 94 ? -30.814 1.600 19.897 1.00 69.45 ? 94 TYR B CZ 1 ATOM 2900 O OH . TYR B 2 94 ? -31.182 2.133 18.704 1.00 71.28 ? 94 TYR B OH 1 ATOM 2901 N N . TRP B 2 95 ? -27.723 1.159 25.956 1.00 70.59 ? 95 TRP B N 1 ATOM 2902 C CA . TRP B 2 95 ? -27.515 1.132 27.383 1.00 72.28 ? 95 TRP B CA 1 ATOM 2903 C C . TRP B 2 95 ? -28.755 0.528 28.028 1.00 73.87 ? 95 TRP B C 1 ATOM 2904 O O . TRP B 2 95 ? -29.866 0.960 27.766 1.00 73.45 ? 95 TRP B O 1 ATOM 2905 C CB . TRP B 2 95 ? -27.247 2.528 27.882 1.00 72.01 ? 95 TRP B CB 1 ATOM 2906 C CG . TRP B 2 95 ? -27.204 2.722 29.394 1.00 72.93 ? 95 TRP B CG 1 ATOM 2907 C CD1 . TRP B 2 95 ? -26.290 2.191 30.310 1.00 72.66 ? 95 TRP B CD1 1 ATOM 2908 C CD2 . TRP B 2 95 ? -28.107 3.510 30.159 1.00 71.76 ? 95 TRP B CD2 1 ATOM 2909 N NE1 . TRP B 2 95 ? -26.597 2.616 31.584 1.00 70.95 ? 95 TRP B NE1 1 ATOM 2910 C CE2 . TRP B 2 95 ? -27.704 3.425 31.522 1.00 71.44 ? 95 TRP B CE2 1 ATOM 2911 C CE3 . TRP B 2 95 ? -29.226 4.280 29.839 1.00 71.95 ? 95 TRP B CE3 1 ATOM 2912 C CZ2 . TRP B 2 95 ? -28.382 4.081 32.539 1.00 70.07 ? 95 TRP B CZ2 1 ATOM 2913 C CZ3 . TRP B 2 95 ? -29.896 4.935 30.866 1.00 71.75 ? 95 TRP B CZ3 1 ATOM 2914 C CH2 . TRP B 2 95 ? -29.465 4.827 32.194 1.00 71.18 ? 95 TRP B CH2 1 ATOM 2915 N N . ASP B 2 96 ? -28.580 -0.485 28.860 1.00 75.54 ? 96 ASP B N 1 ATOM 2916 C CA . ASP B 2 96 ? -29.734 -0.950 29.597 1.00 77.20 ? 96 ASP B CA 1 ATOM 2917 C C . ASP B 2 96 ? -29.678 -0.271 30.949 1.00 78.42 ? 96 ASP B C 1 ATOM 2918 O O . ASP B 2 96 ? -28.853 -0.623 31.808 1.00 78.55 ? 96 ASP B O 1 ATOM 2919 C CB . ASP B 2 96 ? -29.822 -2.453 29.714 1.00 77.11 ? 96 ASP B CB 1 ATOM 2920 C CG . ASP B 2 96 ? -31.126 -2.904 30.413 1.00 78.46 ? 96 ASP B CG 1 ATOM 2921 O OD1 . ASP B 2 96 ? -31.339 -2.537 31.583 1.00 78.85 ? 96 ASP B OD1 1 ATOM 2922 O OD2 . ASP B 2 96 ? -31.993 -3.627 29.875 1.00 78.65 ? 96 ASP B OD2 1 ATOM 2923 N N . ARG B 2 97 ? -30.575 0.711 31.083 1.00 80.09 ? 97 ARG B N 1 ATOM 2924 C CA . ARG B 2 97 ? -30.775 1.583 32.232 1.00 80.88 ? 97 ARG B CA 1 ATOM 2925 C C . ARG B 2 97 ? -30.301 1.106 33.599 1.00 81.66 ? 97 ARG B C 1 ATOM 2926 O O . ARG B 2 97 ? -30.640 1.713 34.606 1.00 81.70 ? 97 ARG B O 1 ATOM 2927 C CB . ARG B 2 97 ? -32.326 1.803 32.494 0.00 40.00 ? 97 ARG B CB 1 ATOM 2928 C CG . ARG B 2 97 ? -33.036 2.469 31.327 0.00 40.00 ? 97 ARG B CG 1 ATOM 2929 C CD . ARG B 2 97 ? -34.447 2.887 31.706 0.00 40.00 ? 97 ARG B CD 1 ATOM 2930 N NE . ARG B 2 97 ? -35.144 3.528 30.594 0.00 40.00 ? 97 ARG B NE 1 ATOM 2931 C CZ . ARG B 2 97 ? -36.390 3.988 30.659 0.00 40.00 ? 97 ARG B CZ 1 ATOM 2932 N NH1 . ARG B 2 97 ? -37.079 3.877 31.786 0.00 40.00 ? 97 ARG B NH1 1 ATOM 2933 N NH2 . ARG B 2 97 ? -36.942 4.557 29.597 0.00 40.00 ? 97 ARG B NH2 1 ATOM 2934 N N . ASP B 2 98 ? -29.528 0.030 33.625 1.00 82.40 ? 98 ASP B N 1 ATOM 2935 C CA . ASP B 2 98 ? -29.081 -0.586 34.858 1.00 83.61 ? 98 ASP B CA 1 ATOM 2936 C C . ASP B 2 98 ? -27.592 -0.288 35.032 1.00 84.66 ? 98 ASP B C 1 ATOM 2937 O O . ASP B 2 98 ? -27.133 0.239 36.082 1.00 83.91 ? 98 ASP B O 1 ATOM 2938 C CB . ASP B 2 98 ? -29.262 -2.101 34.768 1.00 83.61 ? 98 ASP B CB 1 ATOM 2939 C CG . ASP B 2 98 ? -30.722 -2.552 34.766 1.00 85.03 ? 98 ASP B CG 1 ATOM 2940 O OD1 . ASP B 2 98 ? -31.635 -1.759 35.056 1.00 87.60 ? 98 ASP B OD1 1 ATOM 2941 O OD2 . ASP B 2 98 ? -31.049 -3.726 34.491 1.00 84.84 ? 98 ASP B OD2 1 ATOM 2942 N N . MET B 2 99 ? -26.857 -0.640 33.964 1.00 85.79 ? 99 MET B N 1 ATOM 2943 C CA . MET B 2 99 ? -25.385 -0.635 33.909 1.00 86.68 ? 99 MET B CA 1 ATOM 2944 C C . MET B 2 99 ? -24.717 0.732 34.068 1.00 85.83 ? 99 MET B C 1 ATOM 2945 O O . MET B 2 99 ? -23.726 0.814 34.795 1.00 85.68 ? 99 MET B O 1 ATOM 2946 C CB . MET B 2 99 ? -24.925 -1.344 32.637 1.00 85.89 ? 99 MET B CB 1 ATOM 2947 C CG . MET B 2 99 ? -23.612 -2.066 32.777 1.00 86.81 ? 99 MET B CG 1 ATOM 2948 S SD . MET B 2 99 ? -23.519 -3.476 31.663 1.00 90.74 ? 99 MET B SD 1 ATOM 2949 C CE . MET B 2 99 ? -21.721 -3.650 31.476 1.00 85.38 ? 99 MET B CE 1 ATOM 2950 O OXT . MET B 2 99 ? -25.137 1.747 33.498 1.00 85.72 ? 99 MET B OXT 1 ATOM 2951 N N . ASN C 1 7 ? 33.371 32.692 38.247 1.00 86.81 ? 7 ASN C N 1 ATOM 2952 C CA . ASN C 1 7 ? 31.916 33.055 38.206 1.00 86.85 ? 7 ASN C CA 1 ATOM 2953 C C . ASN C 1 7 ? 31.539 34.399 37.506 1.00 86.84 ? 7 ASN C C 1 ATOM 2954 O O . ASN C 1 7 ? 30.519 35.012 37.838 1.00 87.18 ? 7 ASN C O 1 ATOM 2955 C CB . ASN C 1 7 ? 31.307 32.986 39.623 1.00 86.69 ? 7 ASN C CB 1 ATOM 2956 C CG . ASN C 1 7 ? 31.928 33.995 40.584 1.00 86.43 ? 7 ASN C CG 1 ATOM 2957 O OD1 . ASN C 1 7 ? 33.055 34.446 40.377 1.00 85.30 ? 7 ASN C OD1 1 ATOM 2958 N ND2 . ASN C 1 7 ? 31.192 34.352 41.642 1.00 85.55 ? 7 ASN C ND2 1 ATOM 2959 N N . TYR C 1 8 ? 32.346 34.859 36.550 1.00 86.34 ? 8 TYR C N 1 ATOM 2960 C CA . TYR C 1 8 ? 31.993 36.050 35.752 1.00 85.69 ? 8 TYR C CA 1 ATOM 2961 C C . TYR C 1 8 ? 32.615 35.996 34.353 1.00 85.05 ? 8 TYR C C 1 ATOM 2962 O O . TYR C 1 8 ? 33.844 36.082 34.211 1.00 85.49 ? 8 TYR C O 1 ATOM 2963 C CB . TYR C 1 8 ? 32.416 37.350 36.438 1.00 85.83 ? 8 TYR C CB 1 ATOM 2964 C CG . TYR C 1 8 ? 31.421 37.974 37.402 1.00 85.86 ? 8 TYR C CG 1 ATOM 2965 C CD1 . TYR C 1 8 ? 31.634 37.929 38.772 1.00 84.89 ? 8 TYR C CD1 1 ATOM 2966 C CD2 . TYR C 1 8 ? 30.278 38.620 36.936 1.00 85.46 ? 8 TYR C CD2 1 ATOM 2967 C CE1 . TYR C 1 8 ? 30.739 38.501 39.652 1.00 86.26 ? 8 TYR C CE1 1 ATOM 2968 C CE2 . TYR C 1 8 ? 29.374 39.195 37.813 1.00 85.76 ? 8 TYR C CE2 1 ATOM 2969 C CZ . TYR C 1 8 ? 29.610 39.133 39.168 1.00 86.10 ? 8 TYR C CZ 1 ATOM 2970 O OH . TYR C 1 8 ? 28.718 39.699 40.053 1.00 87.40 ? 8 TYR C OH 1 ATOM 2971 N N . THR C 1 9 ? 31.770 35.859 33.333 1.00 83.52 ? 9 THR C N 1 ATOM 2972 C CA . THR C 1 9 ? 32.230 35.750 31.964 1.00 82.28 ? 9 THR C CA 1 ATOM 2973 C C . THR C 1 9 ? 32.090 37.062 31.222 1.00 81.73 ? 9 THR C C 1 ATOM 2974 O O . THR C 1 9 ? 31.039 37.690 31.232 1.00 81.68 ? 9 THR C O 1 ATOM 2975 C CB . THR C 1 9 ? 31.479 34.634 31.224 1.00 82.44 ? 9 THR C CB 1 ATOM 2976 O OG1 . THR C 1 9 ? 31.684 33.394 31.909 1.00 82.10 ? 9 THR C OG1 1 ATOM 2977 C CG2 . THR C 1 9 ? 32.103 34.394 29.845 1.00 80.98 ? 9 THR C CG2 1 ATOM 2978 N N . PHE C 1 10 ? 33.182 37.456 30.581 1.00 80.83 ? 10 PHE C N 1 ATOM 2979 C CA . PHE C 1 10 ? 33.257 38.654 29.747 1.00 79.93 ? 10 PHE C CA 1 ATOM 2980 C C . PHE C 1 10 ? 33.243 38.203 28.290 1.00 79.54 ? 10 PHE C C 1 ATOM 2981 O O . PHE C 1 10 ? 34.024 37.326 27.896 1.00 78.86 ? 10 PHE C O 1 ATOM 2982 C CB . PHE C 1 10 ? 34.547 39.387 30.070 1.00 79.04 ? 10 PHE C CB 1 ATOM 2983 C CG . PHE C 1 10 ? 34.788 40.611 29.265 1.00 78.25 ? 10 PHE C CG 1 ATOM 2984 C CD1 . PHE C 1 10 ? 34.081 41.767 29.511 1.00 77.59 ? 10 PHE C CD1 1 ATOM 2985 C CD2 . PHE C 1 10 ? 35.755 40.614 28.257 1.00 78.00 ? 10 PHE C CD2 1 ATOM 2986 C CE1 . PHE C 1 10 ? 34.320 42.913 28.760 1.00 77.69 ? 10 PHE C CE1 1 ATOM 2987 C CE2 . PHE C 1 10 ? 35.997 41.740 27.511 1.00 76.98 ? 10 PHE C CE2 1 ATOM 2988 C CZ . PHE C 1 10 ? 35.276 42.904 27.765 1.00 77.91 ? 10 PHE C CZ 1 ATOM 2989 N N . ARG C 1 11 ? 32.355 38.784 27.491 1.00 79.55 ? 11 ARG C N 1 ATOM 2990 C CA . ARG C 1 11 ? 32.314 38.402 26.082 1.00 80.34 ? 11 ARG C CA 1 ATOM 2991 C C . ARG C 1 11 ? 32.072 39.546 25.095 1.00 80.01 ? 11 ARG C C 1 ATOM 2992 O O . ARG C 1 11 ? 31.118 40.325 25.239 1.00 79.98 ? 11 ARG C O 1 ATOM 2993 C CB . ARG C 1 11 ? 31.430 37.165 25.838 1.00 80.45 ? 11 ARG C CB 1 ATOM 2994 C CG . ARG C 1 11 ? 29.944 37.356 25.939 1.00 83.22 ? 11 ARG C CG 1 ATOM 2995 C CD . ARG C 1 11 ? 29.260 36.194 26.611 1.00 89.56 ? 11 ARG C CD 1 ATOM 2996 N NE . ARG C 1 11 ? 29.494 36.322 28.053 1.00 95.87 ? 11 ARG C NE 1 ATOM 2997 C CZ . ARG C 1 11 ? 28.605 36.772 28.953 1.00 97.64 ? 11 ARG C CZ 1 ATOM 2998 N NH1 . ARG C 1 11 ? 27.377 37.136 28.584 1.00 98.92 ? 11 ARG C NH1 1 ATOM 2999 N NH2 . ARG C 1 11 ? 28.946 36.850 30.233 1.00 97.56 ? 11 ARG C NH2 1 ATOM 3000 N N . CYS C 1 12 ? 32.977 39.618 24.112 1.00 79.24 ? 12 CYS C N 1 ATOM 3001 C CA . CYS C 1 12 ? 32.872 40.521 22.981 1.00 79.08 ? 12 CYS C CA 1 ATOM 3002 C C . CYS C 1 12 ? 32.250 39.713 21.866 1.00 78.32 ? 12 CYS C C 1 ATOM 3003 O O . CYS C 1 12 ? 32.728 38.635 21.497 1.00 78.42 ? 12 CYS C O 1 ATOM 3004 C CB . CYS C 1 12 ? 34.233 41.056 22.539 1.00 79.41 ? 12 CYS C CB 1 ATOM 3005 S SG . CYS C 1 12 ? 35.100 41.915 23.865 1.00 83.30 ? 12 CYS C SG 1 ATOM 3006 N N . LEU C 1 13 ? 31.170 40.257 21.346 1.00 76.71 ? 13 LEU C N 1 ATOM 3007 C CA . LEU C 1 13 ? 30.364 39.600 20.351 1.00 75.42 ? 13 LEU C CA 1 ATOM 3008 C C . LEU C 1 13 ? 30.410 40.491 19.151 1.00 75.68 ? 13 LEU C C 1 ATOM 3009 O O . LEU C 1 13 ? 29.982 41.641 19.213 1.00 75.34 ? 13 LEU C O 1 ATOM 3010 C CB . LEU C 1 13 ? 28.938 39.473 20.883 1.00 74.17 ? 13 LEU C CB 1 ATOM 3011 C CG . LEU C 1 13 ? 28.660 38.165 21.596 1.00 73.20 ? 13 LEU C CG 1 ATOM 3012 C CD1 . LEU C 1 13 ? 29.845 37.574 22.298 1.00 74.16 ? 13 LEU C CD1 1 ATOM 3013 C CD2 . LEU C 1 13 ? 27.436 38.184 22.466 1.00 69.96 ? 13 LEU C CD2 1 ATOM 3014 N N . GLN C 1 14 ? 30.950 39.965 18.059 1.00 75.86 ? 14 GLN C N 1 ATOM 3015 C CA . GLN C 1 14 ? 31.008 40.703 16.794 1.00 75.72 ? 14 GLN C CA 1 ATOM 3016 C C . GLN C 1 14 ? 30.090 39.995 15.805 1.00 75.64 ? 14 GLN C C 1 ATOM 3017 O O . GLN C 1 14 ? 30.088 38.758 15.728 1.00 76.12 ? 14 GLN C O 1 ATOM 3018 C CB . GLN C 1 14 ? 32.430 40.750 16.252 1.00 75.54 ? 14 GLN C CB 1 ATOM 3019 C CG . GLN C 1 14 ? 32.580 41.511 14.963 1.00 74.92 ? 14 GLN C CG 1 ATOM 3020 C CD . GLN C 1 14 ? 33.938 41.321 14.355 1.00 77.32 ? 14 GLN C CD 1 ATOM 3021 O OE1 . GLN C 1 14 ? 34.065 41.183 13.132 1.00 76.85 ? 14 GLN C OE1 1 ATOM 3022 N NE2 . GLN C 1 14 ? 34.964 41.305 15.192 1.00 76.45 ? 14 GLN C NE2 1 ATOM 3023 N N . MET C 1 15 ? 29.312 40.778 15.066 1.00 75.13 ? 15 MET C N 1 ATOM 3024 C CA . MET C 1 15 ? 28.447 40.230 14.042 1.00 76.04 ? 15 MET C CA 1 ATOM 3025 C C . MET C 1 15 ? 28.771 40.950 12.740 1.00 74.55 ? 15 MET C C 1 ATOM 3026 O O . MET C 1 15 ? 28.659 42.167 12.661 1.00 73.14 ? 15 MET C O 1 ATOM 3027 C CB . MET C 1 15 ? 26.982 40.447 14.408 1.00 75.48 ? 15 MET C CB 1 ATOM 3028 C CG . MET C 1 15 ? 26.559 39.759 15.670 1.00 77.71 ? 15 MET C CG 1 ATOM 3029 S SD . MET C 1 15 ? 25.367 40.738 16.625 1.00 79.69 ? 15 MET C SD 1 ATOM 3030 C CE . MET C 1 15 ? 24.655 41.692 15.253 1.00 80.71 ? 15 MET C CE 1 ATOM 3031 N N . SER C 1 16 ? 29.181 40.175 11.738 1.00 73.91 ? 16 SER C N 1 ATOM 3032 C CA . SER C 1 16 ? 29.466 40.708 10.406 1.00 73.94 ? 16 SER C CA 1 ATOM 3033 C C . SER C 1 16 ? 28.611 40.087 9.302 1.00 73.47 ? 16 SER C C 1 ATOM 3034 O O . SER C 1 16 ? 28.478 38.849 9.226 1.00 73.64 ? 16 SER C O 1 ATOM 3035 C CB . SER C 1 16 ? 30.938 40.540 10.052 1.00 73.49 ? 16 SER C CB 1 ATOM 3036 O OG . SER C 1 16 ? 31.720 41.277 10.946 1.00 72.93 ? 16 SER C OG 1 ATOM 3037 N N . SER C 1 17 ? 28.045 40.960 8.459 1.00 72.64 ? 17 SER C N 1 ATOM 3038 C CA . SER C 1 17 ? 27.245 40.565 7.305 1.00 72.05 ? 17 SER C CA 1 ATOM 3039 C C . SER C 1 17 ? 27.905 41.078 6.045 1.00 71.89 ? 17 SER C C 1 ATOM 3040 O O . SER C 1 17 ? 28.184 42.268 5.937 1.00 72.31 ? 17 SER C O 1 ATOM 3041 C CB . SER C 1 17 ? 25.854 41.171 7.385 1.00 71.88 ? 17 SER C CB 1 ATOM 3042 O OG . SER C 1 17 ? 25.267 40.953 8.648 1.00 72.51 ? 17 SER C OG 1 ATOM 3043 N N . PHE C 1 18 ? 28.148 40.166 5.103 1.00 71.82 ? 18 PHE C N 1 ATOM 3044 C CA . PHE C 1 18 ? 28.691 40.455 3.776 1.00 71.13 ? 18 PHE C CA 1 ATOM 3045 C C . PHE C 1 18 ? 27.636 40.032 2.765 1.00 71.11 ? 18 PHE C C 1 ATOM 3046 O O . PHE C 1 18 ? 27.391 38.846 2.549 1.00 70.47 ? 18 PHE C O 1 ATOM 3047 C CB . PHE C 1 18 ? 29.991 39.688 3.539 1.00 70.68 ? 18 PHE C CB 1 ATOM 3048 C CG . PHE C 1 18 ? 31.092 40.011 4.534 1.00 71.08 ? 18 PHE C CG 1 ATOM 3049 C CD1 . PHE C 1 18 ? 31.182 39.332 5.758 1.00 71.32 ? 18 PHE C CD1 1 ATOM 3050 C CD2 . PHE C 1 18 ? 32.043 40.988 4.243 1.00 70.87 ? 18 PHE C CD2 1 ATOM 3051 C CE1 . PHE C 1 18 ? 32.194 39.629 6.666 1.00 69.49 ? 18 PHE C CE1 1 ATOM 3052 C CE2 . PHE C 1 18 ? 33.051 41.295 5.134 1.00 70.63 ? 18 PHE C CE2 1 ATOM 3053 C CZ . PHE C 1 18 ? 33.132 40.620 6.345 1.00 72.21 ? 18 PHE C CZ 1 ATOM 3054 N N . ALA C 1 19 ? 27.001 41.020 2.152 1.00 71.59 ? 19 ALA C N 1 ATOM 3055 C CA . ALA C 1 19 ? 25.979 40.763 1.138 1.00 72.19 ? 19 ALA C CA 1 ATOM 3056 C C . ALA C 1 19 ? 26.574 40.490 -0.260 1.00 72.38 ? 19 ALA C C 1 ATOM 3057 O O . ALA C 1 19 ? 26.111 39.606 -0.977 1.00 72.55 ? 19 ALA C O 1 ATOM 3058 C CB . ALA C 1 19 ? 24.981 41.918 1.085 1.00 71.77 ? 19 ALA C CB 1 ATOM 3059 N N . ASN C 1 20 ? 27.594 41.264 -0.630 1.00 72.40 ? 20 ASN C N 1 ATOM 3060 C CA . ASN C 1 20 ? 28.274 41.152 -1.920 1.00 71.93 ? 20 ASN C CA 1 ATOM 3061 C C . ASN C 1 20 ? 29.674 41.753 -1.796 1.00 71.83 ? 20 ASN C C 1 ATOM 3062 O O . ASN C 1 20 ? 30.025 42.278 -0.752 1.00 71.60 ? 20 ASN C O 1 ATOM 3063 C CB . ASN C 1 20 ? 27.430 41.777 -3.063 1.00 71.67 ? 20 ASN C CB 1 ATOM 3064 C CG . ASN C 1 20 ? 26.999 43.225 -2.787 1.00 71.18 ? 20 ASN C CG 1 ATOM 3065 O OD1 . ASN C 1 20 ? 27.806 44.052 -2.382 1.00 71.74 ? 20 ASN C OD1 1 ATOM 3066 N ND2 . ASN C 1 20 ? 25.721 43.530 -3.021 1.00 70.00 ? 20 ASN C ND2 1 ATOM 3067 N N . ARG C 1 21 ? 30.468 41.672 -2.853 1.00 72.43 ? 21 ARG C N 1 ATOM 3068 C CA . ARG C 1 21 ? 31.837 42.206 -2.859 1.00 73.07 ? 21 ARG C CA 1 ATOM 3069 C C . ARG C 1 21 ? 31.972 43.653 -2.370 1.00 73.28 ? 21 ARG C C 1 ATOM 3070 O O . ARG C 1 21 ? 33.058 44.080 -1.978 1.00 72.57 ? 21 ARG C O 1 ATOM 3071 C CB . ARG C 1 21 ? 32.511 41.937 -4.099 0.00 40.00 ? 21 ARG C CB 1 ATOM 3072 C CG . ARG C 1 21 ? 32.947 40.468 -4.320 0.00 40.00 ? 21 ARG C CG 1 ATOM 3073 C CD . ARG C 1 21 ? 33.148 40.072 -5.781 0.00 40.00 ? 21 ARG C CD 1 ATOM 3074 N NE . ARG C 1 21 ? 33.743 41.191 -6.509 0.00 40.00 ? 21 ARG C NE 1 ATOM 3075 C CZ . ARG C 1 21 ? 33.533 41.497 -7.793 0.00 40.00 ? 21 ARG C CZ 1 ATOM 3076 N NH1 . ARG C 1 21 ? 32.726 40.761 -8.569 0.00 40.00 ? 21 ARG C NH1 1 ATOM 3077 N NH2 . ARG C 1 21 ? 34.151 42.560 -8.294 0.00 40.00 ? 21 ARG C NH2 1 ATOM 3078 N N . SER C 1 22 ? 30.872 44.399 -2.393 1.00 74.13 ? 22 SER C N 1 ATOM 3079 C CA . SER C 1 22 ? 30.909 45.810 -2.007 1.00 75.10 ? 22 SER C CA 1 ATOM 3080 C C . SER C 1 22 ? 29.803 46.279 -1.041 1.00 75.50 ? 22 SER C C 1 ATOM 3081 O O . SER C 1 22 ? 29.276 47.384 -1.187 1.00 75.75 ? 22 SER C O 1 ATOM 3082 C CB . SER C 1 22 ? 30.910 46.693 -3.256 1.00 75.34 ? 22 SER C CB 1 ATOM 3083 O OG . SER C 1 22 ? 29.647 46.664 -3.908 1.00 75.92 ? 22 SER C OG 1 ATOM 3084 N N . TRP C 1 23 ? 29.452 45.450 -0.064 1.00 75.67 ? 23 TRP C N 1 ATOM 3085 C CA . TRP C 1 23 ? 28.486 45.834 0.972 1.00 76.06 ? 23 TRP C CA 1 ATOM 3086 C C . TRP C 1 23 ? 28.777 44.988 2.209 1.00 76.28 ? 23 TRP C C 1 ATOM 3087 O O . TRP C 1 23 ? 28.627 43.758 2.183 1.00 75.96 ? 23 TRP C O 1 ATOM 3088 C CB . TRP C 1 23 ? 27.025 45.646 0.516 1.00 75.98 ? 23 TRP C CB 1 ATOM 3089 C CG . TRP C 1 23 ? 25.963 46.337 1.408 1.00 76.18 ? 23 TRP C CG 1 ATOM 3090 C CD1 . TRP C 1 23 ? 25.346 47.539 1.166 1.00 76.20 ? 23 TRP C CD1 1 ATOM 3091 C CD2 . TRP C 1 23 ? 25.414 45.863 2.652 1.00 75.94 ? 23 TRP C CD2 1 ATOM 3092 N NE1 . TRP C 1 23 ? 24.457 47.839 2.170 1.00 75.94 ? 23 TRP C NE1 1 ATOM 3093 C CE2 . TRP C 1 23 ? 24.477 46.832 3.097 1.00 76.54 ? 23 TRP C CE2 1 ATOM 3094 C CE3 . TRP C 1 23 ? 25.617 44.715 3.442 1.00 76.73 ? 23 TRP C CE3 1 ATOM 3095 C CZ2 . TRP C 1 23 ? 23.747 46.690 4.293 1.00 76.47 ? 23 TRP C CZ2 1 ATOM 3096 C CZ3 . TRP C 1 23 ? 24.886 44.574 4.638 1.00 76.31 ? 23 TRP C CZ3 1 ATOM 3097 C CH2 . TRP C 1 23 ? 23.965 45.559 5.046 1.00 76.16 ? 23 TRP C CH2 1 ATOM 3098 N N . SER C 1 24 ? 29.202 45.663 3.278 1.00 76.49 ? 24 SER C N 1 ATOM 3099 C CA . SER C 1 24 ? 29.442 45.035 4.584 1.00 76.72 ? 24 SER C CA 1 ATOM 3100 C C . SER C 1 24 ? 29.109 45.967 5.700 1.00 76.59 ? 24 SER C C 1 ATOM 3101 O O . SER C 1 24 ? 29.342 47.180 5.613 1.00 77.26 ? 24 SER C O 1 ATOM 3102 C CB . SER C 1 24 ? 30.899 44.678 4.780 1.00 76.19 ? 24 SER C CB 1 ATOM 3103 O OG . SER C 1 24 ? 31.173 43.520 4.073 1.00 78.23 ? 24 SER C OG 1 ATOM 3104 N N . ARG C 1 25 ? 28.562 45.390 6.749 1.00 76.30 ? 25 ARG C N 1 ATOM 3105 C CA . ARG C 1 25 ? 28.464 46.087 7.991 1.00 76.65 ? 25 ARG C CA 1 ATOM 3106 C C . ARG C 1 25 ? 28.998 45.151 9.083 1.00 76.54 ? 25 ARG C C 1 ATOM 3107 O O . ARG C 1 25 ? 28.897 43.923 8.977 1.00 75.84 ? 25 ARG C O 1 ATOM 3108 C CB . ARG C 1 25 ? 27.032 46.583 8.258 1.00 76.51 ? 25 ARG C CB 1 ATOM 3109 C CG . ARG C 1 25 ? 26.029 45.578 8.798 1.00 77.27 ? 25 ARG C CG 1 ATOM 3110 C CD . ARG C 1 25 ? 24.756 46.225 9.408 1.00 77.29 ? 25 ARG C CD 1 ATOM 3111 N NE . ARG C 1 25 ? 25.035 47.390 10.260 1.00 77.45 ? 25 ARG C NE 1 ATOM 3112 C CZ . ARG C 1 25 ? 24.644 48.634 9.990 1.00 77.66 ? 25 ARG C CZ 1 ATOM 3113 N NH1 . ARG C 1 25 ? 23.948 48.892 8.893 1.00 77.66 ? 25 ARG C NH1 1 ATOM 3114 N NH2 . ARG C 1 25 ? 24.943 49.627 10.819 1.00 77.81 ? 25 ARG C NH2 1 ATOM 3115 N N . THR C 1 26 ? 29.584 45.732 10.120 1.00 76.83 ? 26 THR C N 1 ATOM 3116 C CA . THR C 1 26 ? 29.950 44.935 11.285 1.00 77.54 ? 26 THR C CA 1 ATOM 3117 C C . THR C 1 26 ? 29.606 45.650 12.600 1.00 77.07 ? 26 THR C C 1 ATOM 3118 O O . THR C 1 26 ? 29.778 46.870 12.731 1.00 76.34 ? 26 THR C O 1 ATOM 3119 C CB . THR C 1 26 ? 31.364 44.185 11.150 1.00 77.47 ? 26 THR C CB 1 ATOM 3120 O OG1 . THR C 1 26 ? 32.018 44.085 12.416 1.00 79.30 ? 26 THR C OG1 1 ATOM 3121 C CG2 . THR C 1 26 ? 32.347 44.958 10.333 1.00 79.86 ? 26 THR C CG2 1 ATOM 3122 N N . ASP C 1 27 ? 29.085 44.877 13.550 1.00 76.68 ? 27 ASP C N 1 ATOM 3123 C CA . ASP C 1 27 ? 28.626 45.394 14.823 1.00 76.43 ? 27 ASP C CA 1 ATOM 3124 C C . ASP C 1 27 ? 29.044 44.493 15.959 1.00 76.19 ? 27 ASP C C 1 ATOM 3125 O O . ASP C 1 27 ? 29.061 43.269 15.821 1.00 76.91 ? 27 ASP C O 1 ATOM 3126 C CB . ASP C 1 27 ? 27.120 45.508 14.807 1.00 76.96 ? 27 ASP C CB 1 ATOM 3127 C CG . ASP C 1 27 ? 26.624 46.442 13.717 1.00 78.51 ? 27 ASP C CG 1 ATOM 3128 O OD1 . ASP C 1 27 ? 26.201 45.946 12.647 1.00 80.96 ? 27 ASP C OD1 1 ATOM 3129 O OD2 . ASP C 1 27 ? 26.626 47.680 13.835 1.00 78.98 ? 27 ASP C OD2 1 ATOM 3130 N N . SER C 1 28 ? 29.384 45.114 17.077 1.00 75.81 ? 28 SER C N 1 ATOM 3131 C CA . SER C 1 28 ? 29.801 44.419 18.276 1.00 75.61 ? 28 SER C CA 1 ATOM 3132 C C . SER C 1 28 ? 29.027 44.923 19.485 1.00 75.35 ? 28 SER C C 1 ATOM 3133 O O . SER C 1 28 ? 28.567 46.096 19.555 1.00 74.94 ? 28 SER C O 1 ATOM 3134 C CB . SER C 1 28 ? 31.299 44.615 18.554 1.00 76.19 ? 28 SER C CB 1 ATOM 3135 O OG . SER C 1 28 ? 32.122 44.383 17.413 1.00 80.37 ? 28 SER C OG 1 ATOM 3136 N N . VAL C 1 29 ? 28.910 44.009 20.435 1.00 74.33 ? 29 VAL C N 1 ATOM 3137 C CA . VAL C 1 29 ? 28.273 44.237 21.697 1.00 74.53 ? 29 VAL C CA 1 ATOM 3138 C C . VAL C 1 29 ? 29.158 43.540 22.747 1.00 74.65 ? 29 VAL C C 1 ATOM 3139 O O . VAL C 1 29 ? 29.696 42.451 22.507 1.00 75.05 ? 29 VAL C O 1 ATOM 3140 C CB . VAL C 1 29 ? 26.787 43.737 21.656 1.00 74.36 ? 29 VAL C CB 1 ATOM 3141 C CG1 . VAL C 1 29 ? 26.697 42.213 21.731 1.00 74.64 ? 29 VAL C CG1 1 ATOM 3142 C CG2 . VAL C 1 29 ? 26.037 44.304 22.737 1.00 74.50 ? 29 VAL C CG2 1 ATOM 3143 N N . VAL C 1 30 ? 29.336 44.171 23.905 1.00 74.97 ? 30 VAL C N 1 ATOM 3144 C CA . VAL C 1 30 ? 30.071 43.503 24.984 1.00 74.30 ? 30 VAL C CA 1 ATOM 3145 C C . VAL C 1 30 ? 29.241 43.363 26.271 1.00 73.39 ? 30 VAL C C 1 ATOM 3146 O O . VAL C 1 30 ? 28.494 44.281 26.645 1.00 73.23 ? 30 VAL C O 1 ATOM 3147 C CB . VAL C 1 30 ? 31.607 43.946 25.101 1.00 74.78 ? 30 VAL C CB 1 ATOM 3148 C CG1 . VAL C 1 30 ? 31.900 45.193 24.326 1.00 74.02 ? 30 VAL C CG1 1 ATOM 3149 C CG2 . VAL C 1 30 ? 32.115 44.027 26.533 1.00 74.76 ? 30 VAL C CG2 1 ATOM 3150 N N . TRP C 1 31 ? 29.390 42.196 26.906 1.00 71.92 ? 31 TRP C N 1 ATOM 3151 C CA . TRP C 1 31 ? 28.692 41.804 28.127 1.00 70.69 ? 31 TRP C CA 1 ATOM 3152 C C . TRP C 1 31 ? 29.658 41.409 29.230 1.00 70.50 ? 31 TRP C C 1 ATOM 3153 O O . TRP C 1 31 ? 30.649 40.747 28.974 1.00 70.57 ? 31 TRP C O 1 ATOM 3154 C CB . TRP C 1 31 ? 27.826 40.580 27.866 1.00 70.76 ? 31 TRP C CB 1 ATOM 3155 C CG . TRP C 1 31 ? 26.821 40.759 26.784 1.00 69.67 ? 31 TRP C CG 1 ATOM 3156 C CD1 . TRP C 1 31 ? 26.992 40.506 25.456 1.00 70.32 ? 31 TRP C CD1 1 ATOM 3157 C CD2 . TRP C 1 31 ? 25.491 41.226 26.933 1.00 68.59 ? 31 TRP C CD2 1 ATOM 3158 N NE1 . TRP C 1 31 ? 25.841 40.792 24.763 1.00 71.14 ? 31 TRP C NE1 1 ATOM 3159 C CE2 . TRP C 1 31 ? 24.900 41.238 25.652 1.00 69.67 ? 31 TRP C CE2 1 ATOM 3160 C CE3 . TRP C 1 31 ? 24.731 41.643 28.020 1.00 68.34 ? 31 TRP C CE3 1 ATOM 3161 C CZ2 . TRP C 1 31 ? 23.586 41.648 25.435 1.00 70.80 ? 31 TRP C CZ2 1 ATOM 3162 C CZ3 . TRP C 1 31 ? 23.419 42.054 27.802 1.00 70.94 ? 31 TRP C CZ3 1 ATOM 3163 C CH2 . TRP C 1 31 ? 22.861 42.054 26.525 1.00 70.27 ? 31 TRP C CH2 1 ATOM 3164 N N . LEU C 1 32 ? 29.356 41.822 30.454 1.00 70.00 ? 32 LEU C N 1 ATOM 3165 C CA . LEU C 1 32 ? 30.046 41.322 31.638 1.00 69.60 ? 32 LEU C CA 1 ATOM 3166 C C . LEU C 1 32 ? 28.983 40.636 32.451 1.00 69.18 ? 32 LEU C C 1 ATOM 3167 O O . LEU C 1 32 ? 28.038 41.268 32.845 1.00 69.06 ? 32 LEU C O 1 ATOM 3168 C CB . LEU C 1 32 ? 30.677 42.438 32.468 1.00 69.28 ? 32 LEU C CB 1 ATOM 3169 C CG . LEU C 1 32 ? 31.456 41.981 33.704 1.00 68.09 ? 32 LEU C CG 1 ATOM 3170 C CD1 . LEU C 1 32 ? 32.511 40.975 33.365 1.00 67.07 ? 32 LEU C CD1 1 ATOM 3171 C CD2 . LEU C 1 32 ? 32.099 43.172 34.329 1.00 66.51 ? 32 LEU C CD2 1 ATOM 3172 N N . GLY C 1 33 ? 29.136 39.342 32.703 1.00 69.62 ? 33 GLY C N 1 ATOM 3173 C CA . GLY C 1 33 ? 28.073 38.585 33.322 1.00 69.54 ? 33 GLY C CA 1 ATOM 3174 C C . GLY C 1 33 ? 26.899 38.874 32.417 1.00 69.57 ? 33 GLY C C 1 ATOM 3175 O O . GLY C 1 33 ? 26.988 38.771 31.198 1.00 69.30 ? 33 GLY C O 1 ATOM 3176 N N . ASP C 1 34 ? 25.785 39.262 33.001 1.00 70.06 ? 34 ASP C N 1 ATOM 3177 C CA . ASP C 1 34 ? 24.625 39.485 32.161 1.00 70.18 ? 34 ASP C CA 1 ATOM 3178 C C . ASP C 1 34 ? 24.298 40.965 31.971 1.00 69.21 ? 34 ASP C C 1 ATOM 3179 O O . ASP C 1 34 ? 23.148 41.325 31.765 1.00 68.59 ? 34 ASP C O 1 ATOM 3180 C CB . ASP C 1 34 ? 23.435 38.652 32.682 1.00 70.61 ? 34 ASP C CB 1 ATOM 3181 C CG . ASP C 1 34 ? 23.028 39.030 34.068 1.00 72.24 ? 34 ASP C CG 1 ATOM 3182 O OD1 . ASP C 1 34 ? 23.461 40.104 34.537 1.00 74.11 ? 34 ASP C OD1 1 ATOM 3183 O OD2 . ASP C 1 34 ? 22.273 38.318 34.771 1.00 73.75 ? 34 ASP C OD2 1 ATOM 3184 N N . LEU C 1 35 ? 25.314 41.826 32.046 1.00 68.65 ? 35 LEU C N 1 ATOM 3185 C CA . LEU C 1 35 ? 25.103 43.266 31.857 1.00 68.55 ? 35 LEU C CA 1 ATOM 3186 C C . LEU C 1 35 ? 25.884 43.760 30.677 1.00 68.70 ? 35 LEU C C 1 ATOM 3187 O O . LEU C 1 35 ? 27.064 43.399 30.530 1.00 68.64 ? 35 LEU C O 1 ATOM 3188 C CB . LEU C 1 35 ? 25.516 44.080 33.095 1.00 68.02 ? 35 LEU C CB 1 ATOM 3189 C CG . LEU C 1 35 ? 24.837 43.927 34.451 1.00 69.18 ? 35 LEU C CG 1 ATOM 3190 C CD1 . LEU C 1 35 ? 25.551 44.775 35.477 1.00 67.41 ? 35 LEU C CD1 1 ATOM 3191 C CD2 . LEU C 1 35 ? 23.352 44.312 34.422 1.00 69.92 ? 35 LEU C CD2 1 ATOM 3192 N N . GLN C 1 36 ? 25.243 44.587 29.842 1.00 69.09 ? 36 GLN C N 1 ATOM 3193 C CA . GLN C 1 36 ? 25.917 45.159 28.651 1.00 69.63 ? 36 GLN C CA 1 ATOM 3194 C C . GLN C 1 36 ? 26.846 46.299 28.987 1.00 69.13 ? 36 GLN C C 1 ATOM 3195 O O . GLN C 1 36 ? 26.413 47.298 29.539 1.00 69.28 ? 36 GLN C O 1 ATOM 3196 C CB . GLN C 1 36 ? 24.922 45.654 27.620 1.00 69.34 ? 36 GLN C CB 1 ATOM 3197 C CG . GLN C 1 36 ? 25.601 45.937 26.331 1.00 69.99 ? 36 GLN C CG 1 ATOM 3198 C CD . GLN C 1 36 ? 24.652 46.285 25.228 1.00 71.72 ? 36 GLN C CD 1 ATOM 3199 O OE1 . GLN C 1 36 ? 23.442 46.312 25.426 1.00 72.48 ? 36 GLN C OE1 1 ATOM 3200 N NE2 . GLN C 1 36 ? 25.197 46.554 24.047 1.00 70.86 ? 36 GLN C NE2 1 ATOM 3201 N N . THR C 1 37 ? 28.128 46.156 28.648 1.00 69.77 ? 37 THR C N 1 ATOM 3202 C CA . THR C 1 37 ? 29.086 47.200 28.966 1.00 68.69 ? 37 THR C CA 1 ATOM 3203 C C . THR C 1 37 ? 29.431 48.062 27.765 1.00 68.54 ? 37 THR C C 1 ATOM 3204 O O . THR C 1 37 ? 29.704 49.258 27.916 1.00 67.66 ? 37 THR C O 1 ATOM 3205 C CB . THR C 1 37 ? 30.379 46.653 29.715 1.00 69.54 ? 37 THR C CB 1 ATOM 3206 O OG1 . THR C 1 37 ? 31.135 45.756 28.875 1.00 68.31 ? 37 THR C OG1 1 ATOM 3207 C CG2 . THR C 1 37 ? 30.001 45.805 30.937 1.00 69.39 ? 37 THR C CG2 1 ATOM 3208 N N . HIS C 1 38 ? 29.428 47.473 26.570 1.00 67.94 ? 38 HIS C N 1 ATOM 3209 C CA . HIS C 1 38 ? 29.813 48.239 25.369 1.00 67.37 ? 38 HIS C CA 1 ATOM 3210 C C . HIS C 1 38 ? 28.959 47.971 24.129 1.00 67.41 ? 38 HIS C C 1 ATOM 3211 O O . HIS C 1 38 ? 28.287 46.949 24.014 1.00 65.85 ? 38 HIS C O 1 ATOM 3212 C CB . HIS C 1 38 ? 31.280 47.993 24.997 1.00 67.68 ? 38 HIS C CB 1 ATOM 3213 C CG . HIS C 1 38 ? 32.262 48.293 26.090 1.00 69.76 ? 38 HIS C CG 1 ATOM 3214 N ND1 . HIS C 1 38 ? 32.582 47.387 27.073 1.00 71.30 ? 38 HIS C ND1 1 ATOM 3215 C CD2 . HIS C 1 38 ? 32.995 49.399 26.351 1.00 71.73 ? 38 HIS C CD2 1 ATOM 3216 C CE1 . HIS C 1 38 ? 33.470 47.916 27.893 1.00 70.27 ? 38 HIS C CE1 1 ATOM 3217 N NE2 . HIS C 1 38 ? 33.739 49.139 27.477 1.00 73.19 ? 38 HIS C NE2 1 ATOM 3218 N N . ARG C 1 39 ? 29.018 48.904 23.196 1.00 67.45 ? 39 ARG C N 1 ATOM 3219 C CA . ARG C 1 39 ? 28.331 48.791 21.923 1.00 68.83 ? 39 ARG C CA 1 ATOM 3220 C C . ARG C 1 39 ? 29.197 49.485 20.844 1.00 69.23 ? 39 ARG C C 1 ATOM 3221 O O . ARG C 1 39 ? 29.693 50.630 21.043 1.00 69.40 ? 39 ARG C O 1 ATOM 3222 C CB . ARG C 1 39 ? 26.982 49.490 22.025 1.00 69.27 ? 39 ARG C CB 1 ATOM 3223 C CG . ARG C 1 39 ? 26.147 49.563 20.758 1.00 71.75 ? 39 ARG C CG 1 ATOM 3224 C CD . ARG C 1 39 ? 25.477 50.949 20.574 1.00 77.15 ? 39 ARG C CD 1 ATOM 3225 N NE . ARG C 1 39 ? 24.655 51.373 21.711 1.00 80.30 ? 39 ARG C NE 1 ATOM 3226 C CZ . ARG C 1 39 ? 24.356 52.654 22.021 1.00 83.48 ? 39 ARG C CZ 1 ATOM 3227 N NH1 . ARG C 1 39 ? 24.816 53.678 21.288 1.00 83.38 ? 39 ARG C NH1 1 ATOM 3228 N NH2 . ARG C 1 39 ? 23.593 52.916 23.082 1.00 81.77 ? 39 ARG C NH2 1 ATOM 3229 N N . TRP C 1 40 ? 29.365 48.806 19.712 1.00 68.50 ? 40 TRP C N 1 ATOM 3230 C CA . TRP C 1 40 ? 30.066 49.377 18.567 1.00 69.00 ? 40 TRP C CA 1 ATOM 3231 C C . TRP C 1 40 ? 29.317 49.158 17.242 1.00 69.59 ? 40 TRP C C 1 ATOM 3232 O O . TRP C 1 40 ? 29.412 48.088 16.638 1.00 70.07 ? 40 TRP C O 1 ATOM 3233 C CB . TRP C 1 40 ? 31.494 48.829 18.496 1.00 68.04 ? 40 TRP C CB 1 ATOM 3234 C CG . TRP C 1 40 ? 32.416 49.693 17.698 1.00 69.35 ? 40 TRP C CG 1 ATOM 3235 C CD1 . TRP C 1 40 ? 32.206 50.987 17.348 1.00 67.57 ? 40 TRP C CD1 1 ATOM 3236 C CD2 . TRP C 1 40 ? 33.704 49.340 17.171 1.00 67.29 ? 40 TRP C CD2 1 ATOM 3237 N NE1 . TRP C 1 40 ? 33.272 51.463 16.628 1.00 68.23 ? 40 TRP C NE1 1 ATOM 3238 C CE2 . TRP C 1 40 ? 34.203 50.470 16.502 1.00 65.67 ? 40 TRP C CE2 1 ATOM 3239 C CE3 . TRP C 1 40 ? 34.480 48.175 17.182 1.00 66.58 ? 40 TRP C CE3 1 ATOM 3240 C CZ2 . TRP C 1 40 ? 35.444 50.479 15.859 1.00 66.16 ? 40 TRP C CZ2 1 ATOM 3241 C CZ3 . TRP C 1 40 ? 35.711 48.182 16.541 1.00 66.51 ? 40 TRP C CZ3 1 ATOM 3242 C CH2 . TRP C 1 40 ? 36.177 49.334 15.890 1.00 68.47 ? 40 TRP C CH2 1 ATOM 3243 N N . SER C 1 41 ? 28.570 50.159 16.780 1.00 70.34 ? 41 SER C N 1 ATOM 3244 C CA . SER C 1 41 ? 27.836 49.985 15.524 1.00 71.32 ? 41 SER C CA 1 ATOM 3245 C C . SER C 1 41 ? 28.714 50.288 14.305 1.00 72.10 ? 41 SER C C 1 ATOM 3246 O O . SER C 1 41 ? 29.675 51.037 14.409 1.00 73.00 ? 41 SER C O 1 ATOM 3247 C CB . SER C 1 41 ? 26.555 50.819 15.501 1.00 71.16 ? 41 SER C CB 1 ATOM 3248 O OG . SER C 1 41 ? 26.852 52.186 15.660 1.00 71.21 ? 41 SER C OG 1 ATOM 3249 N N . ASN C 1 42 ? 28.386 49.711 13.151 1.00 72.82 ? 42 ASN C N 1 ATOM 3250 C CA . ASN C 1 42 ? 29.158 49.932 11.930 1.00 73.49 ? 42 ASN C CA 1 ATOM 3251 C C . ASN C 1 42 ? 29.408 51.387 11.632 1.00 73.76 ? 42 ASN C C 1 ATOM 3252 O O . ASN C 1 42 ? 30.474 51.739 11.152 1.00 73.80 ? 42 ASN C O 1 ATOM 3253 C CB . ASN C 1 42 ? 28.491 49.299 10.701 1.00 73.25 ? 42 ASN C CB 1 ATOM 3254 C CG . ASN C 1 42 ? 29.436 49.221 9.501 1.00 73.55 ? 42 ASN C CG 1 ATOM 3255 O OD1 . ASN C 1 42 ? 30.373 48.420 9.501 1.00 72.16 ? 42 ASN C OD1 1 ATOM 3256 N ND2 . ASN C 1 42 ? 29.194 50.050 8.481 1.00 73.24 ? 42 ASN C ND2 1 ATOM 3257 N N . ASP C 1 43 ? 28.418 52.223 11.916 1.00 74.79 ? 43 ASP C N 1 ATOM 3258 C CA . ASP C 1 43 ? 28.448 53.647 11.519 1.00 75.96 ? 43 ASP C CA 1 ATOM 3259 C C . ASP C 1 43 ? 29.122 54.606 12.501 1.00 75.74 ? 43 ASP C C 1 ATOM 3260 O O . ASP C 1 43 ? 29.295 55.798 12.207 1.00 75.42 ? 43 ASP C O 1 ATOM 3261 C CB . ASP C 1 43 ? 27.048 54.153 11.101 1.00 76.49 ? 43 ASP C CB 1 ATOM 3262 C CG . ASP C 1 43 ? 25.913 53.457 11.846 1.00 78.98 ? 43 ASP C CG 1 ATOM 3263 O OD1 . ASP C 1 43 ? 25.015 52.913 11.163 1.00 81.10 ? 43 ASP C OD1 1 ATOM 3264 O OD2 . ASP C 1 43 ? 25.827 53.394 13.099 1.00 82.18 ? 43 ASP C OD2 1 ATOM 3265 N N . SER C 1 44 ? 29.502 54.078 13.658 1.00 75.71 ? 44 SER C N 1 ATOM 3266 C CA . SER C 1 44 ? 30.258 54.848 14.624 1.00 75.41 ? 44 SER C CA 1 ATOM 3267 C C . SER C 1 44 ? 31.735 54.545 14.423 1.00 74.86 ? 44 SER C C 1 ATOM 3268 O O . SER C 1 44 ? 32.130 53.395 14.204 1.00 74.57 ? 44 SER C O 1 ATOM 3269 C CB . SER C 1 44 ? 29.839 54.501 16.053 1.00 75.70 ? 44 SER C CB 1 ATOM 3270 O OG . SER C 1 44 ? 30.598 55.274 16.968 1.00 77.17 ? 44 SER C OG 1 ATOM 3271 N N . ALA C 1 45 ? 32.536 55.594 14.501 1.00 74.40 ? 45 ALA C N 1 ATOM 3272 C CA . ALA C 1 45 ? 33.988 55.521 14.413 1.00 73.91 ? 45 ALA C CA 1 ATOM 3273 C C . ALA C 1 45 ? 34.545 55.041 15.749 1.00 73.60 ? 45 ALA C C 1 ATOM 3274 O O . ALA C 1 45 ? 35.624 54.448 15.797 1.00 73.47 ? 45 ALA C O 1 ATOM 3275 C CB . ALA C 1 45 ? 34.558 56.930 14.072 1.00 73.53 ? 45 ALA C CB 1 ATOM 3276 N N . THR C 1 46 ? 33.797 55.304 16.829 1.00 73.77 ? 46 THR C N 1 ATOM 3277 C CA . THR C 1 46 ? 34.189 54.913 18.194 1.00 74.04 ? 46 THR C CA 1 ATOM 3278 C C . THR C 1 46 ? 33.288 53.883 18.913 1.00 74.33 ? 46 THR C C 1 ATOM 3279 O O . THR C 1 46 ? 32.116 53.669 18.560 1.00 74.98 ? 46 THR C O 1 ATOM 3280 C CB . THR C 1 46 ? 34.395 56.183 19.088 1.00 74.65 ? 46 THR C CB 1 ATOM 3281 O OG1 . THR C 1 46 ? 33.300 57.095 18.916 1.00 74.77 ? 46 THR C OG1 1 ATOM 3282 C CG2 . THR C 1 46 ? 35.600 56.992 18.610 1.00 73.26 ? 46 THR C CG2 1 ATOM 3283 N N . ILE C 1 47 ? 33.862 53.238 19.930 1.00 74.03 ? 47 ILE C N 1 ATOM 3284 C CA . ILE C 1 47 ? 33.150 52.333 20.824 1.00 72.62 ? 47 ILE C CA 1 ATOM 3285 C C . ILE C 1 47 ? 32.395 53.194 21.820 1.00 72.76 ? 47 ILE C C 1 ATOM 3286 O O . ILE C 1 47 ? 32.947 54.181 22.347 1.00 72.13 ? 47 ILE C O 1 ATOM 3287 C CB . ILE C 1 47 ? 34.168 51.453 21.577 1.00 73.31 ? 47 ILE C CB 1 ATOM 3288 C CG1 . ILE C 1 47 ? 35.140 50.798 20.590 1.00 71.69 ? 47 ILE C CG1 1 ATOM 3289 C CG2 . ILE C 1 47 ? 33.455 50.429 22.507 1.00 71.97 ? 47 ILE C CG2 1 ATOM 3290 C CD1 . ILE C 1 47 ? 36.358 50.147 21.228 1.00 72.26 ? 47 ILE C CD1 1 ATOM 3291 N N . SER C 1 48 ? 31.134 52.828 22.070 1.00 72.53 ? 48 SER C N 1 ATOM 3292 C CA . SER C 1 48 ? 30.284 53.515 23.059 1.00 71.50 ? 48 SER C CA 1 ATOM 3293 C C . SER C 1 48 ? 30.218 52.683 24.334 1.00 71.64 ? 48 SER C C 1 ATOM 3294 O O . SER C 1 48 ? 29.983 51.458 24.275 1.00 71.47 ? 48 SER C O 1 ATOM 3295 C CB . SER C 1 48 ? 28.843 53.691 22.559 1.00 71.00 ? 48 SER C CB 1 ATOM 3296 O OG . SER C 1 48 ? 28.786 53.958 21.181 1.00 70.44 ? 48 SER C OG 1 ATOM 3297 N N . PHE C 1 49 ? 30.426 53.357 25.466 1.00 71.15 ? 49 PHE C N 1 ATOM 3298 C CA . PHE C 1 49 ? 30.198 52.797 26.802 1.00 71.39 ? 49 PHE C CA 1 ATOM 3299 C C . PHE C 1 49 ? 28.687 52.752 27.074 1.00 70.77 ? 49 PHE C C 1 ATOM 3300 O O . PHE C 1 49 ? 27.993 53.736 26.810 1.00 71.08 ? 49 PHE C O 1 ATOM 3301 C CB . PHE C 1 49 ? 30.846 53.682 27.895 1.00 71.14 ? 49 PHE C CB 1 ATOM 3302 C CG . PHE C 1 49 ? 32.326 53.924 27.717 1.00 72.37 ? 49 PHE C CG 1 ATOM 3303 C CD1 . PHE C 1 49 ? 33.199 52.875 27.396 1.00 72.58 ? 49 PHE C CD1 1 ATOM 3304 C CD2 . PHE C 1 49 ? 32.850 55.200 27.886 1.00 72.12 ? 49 PHE C CD2 1 ATOM 3305 C CE1 . PHE C 1 49 ? 34.570 53.102 27.241 1.00 73.47 ? 49 PHE C CE1 1 ATOM 3306 C CE2 . PHE C 1 49 ? 34.220 55.434 27.731 1.00 75.23 ? 49 PHE C CE2 1 ATOM 3307 C CZ . PHE C 1 49 ? 35.084 54.368 27.405 1.00 72.51 ? 49 PHE C CZ 1 ATOM 3308 N N . THR C 1 50 ? 28.178 51.637 27.603 1.00 70.59 ? 50 THR C N 1 ATOM 3309 C CA . THR C 1 50 ? 26.744 51.516 27.964 1.00 70.20 ? 50 THR C CA 1 ATOM 3310 C C . THR C 1 50 ? 26.541 51.493 29.472 1.00 70.24 ? 50 THR C C 1 ATOM 3311 O O . THR C 1 50 ? 25.445 51.242 29.958 1.00 71.00 ? 50 THR C O 1 ATOM 3312 C CB . THR C 1 50 ? 26.071 50.268 27.366 1.00 70.34 ? 50 THR C CB 1 ATOM 3313 O OG1 . THR C 1 50 ? 26.961 49.161 27.461 1.00 72.03 ? 50 THR C OG1 1 ATOM 3314 C CG2 . THR C 1 50 ? 25.851 50.409 25.876 1.00 70.01 ? 50 THR C CG2 1 ATOM 3315 N N . LYS C 1 51 ? 27.608 51.739 30.208 1.00 69.52 ? 51 LYS C N 1 ATOM 3316 C CA . LYS C 1 51 ? 27.557 51.833 31.651 1.00 68.94 ? 51 LYS C CA 1 ATOM 3317 C C . LYS C 1 51 ? 28.489 52.990 31.994 1.00 68.38 ? 51 LYS C C 1 ATOM 3318 O O . LYS C 1 51 ? 29.401 53.278 31.238 1.00 68.27 ? 51 LYS C O 1 ATOM 3319 C CB . LYS C 1 51 ? 28.074 50.550 32.300 1.00 68.49 ? 51 LYS C CB 1 ATOM 3320 C CG . LYS C 1 51 ? 27.188 49.340 32.113 1.00 69.37 ? 51 LYS C CG 1 ATOM 3321 C CD . LYS C 1 51 ? 25.955 49.415 32.995 1.00 68.22 ? 51 LYS C CD 1 ATOM 3322 C CE . LYS C 1 51 ? 25.077 48.187 32.830 1.00 69.40 ? 51 LYS C CE 1 ATOM 3323 N NZ . LYS C 1 51 ? 24.298 48.222 31.571 1.00 69.32 ? 51 LYS C NZ 1 ATOM 3324 N N . PRO C 1 52 ? 28.274 53.666 33.114 1.00 68.63 ? 52 PRO C N 1 ATOM 3325 C CA . PRO C 1 52 ? 29.264 54.641 33.575 1.00 68.22 ? 52 PRO C CA 1 ATOM 3326 C C . PRO C 1 52 ? 30.616 53.999 33.931 1.00 68.37 ? 52 PRO C C 1 ATOM 3327 O O . PRO C 1 52 ? 31.600 54.700 34.046 1.00 67.80 ? 52 PRO C O 1 ATOM 3328 C CB . PRO C 1 52 ? 28.607 55.264 34.810 1.00 68.12 ? 52 PRO C CB 1 ATOM 3329 C CG . PRO C 1 52 ? 27.563 54.287 35.224 1.00 69.05 ? 52 PRO C CG 1 ATOM 3330 C CD . PRO C 1 52 ? 27.092 53.586 34.001 1.00 68.24 ? 52 PRO C CD 1 ATOM 3331 N N . TRP C 1 53 ? 30.686 52.680 34.092 1.00 68.39 ? 53 TRP C N 1 ATOM 3332 C CA . TRP C 1 53 ? 31.956 52.072 34.525 1.00 68.77 ? 53 TRP C CA 1 ATOM 3333 C C . TRP C 1 53 ? 32.675 51.191 33.487 1.00 68.85 ? 53 TRP C C 1 ATOM 3334 O O . TRP C 1 53 ? 33.603 50.439 33.834 1.00 69.27 ? 53 TRP C O 1 ATOM 3335 C CB . TRP C 1 53 ? 31.767 51.325 35.850 1.00 68.31 ? 53 TRP C CB 1 ATOM 3336 C CG . TRP C 1 53 ? 30.559 50.470 35.813 1.00 67.50 ? 53 TRP C CG 1 ATOM 3337 C CD1 . TRP C 1 53 ? 29.318 50.804 36.257 1.00 65.89 ? 53 TRP C CD1 1 ATOM 3338 C CD2 . TRP C 1 53 ? 30.454 49.126 35.286 1.00 67.96 ? 53 TRP C CD2 1 ATOM 3339 N NE1 . TRP C 1 53 ? 28.448 49.762 36.050 1.00 67.63 ? 53 TRP C NE1 1 ATOM 3340 C CE2 . TRP C 1 53 ? 29.113 48.719 35.457 1.00 67.57 ? 53 TRP C CE2 1 ATOM 3341 C CE3 . TRP C 1 53 ? 31.363 48.223 34.691 1.00 66.26 ? 53 TRP C CE3 1 ATOM 3342 C CZ2 . TRP C 1 53 ? 28.648 47.451 35.058 1.00 68.39 ? 53 TRP C CZ2 1 ATOM 3343 C CZ3 . TRP C 1 53 ? 30.904 46.972 34.300 1.00 66.53 ? 53 TRP C CZ3 1 ATOM 3344 C CH2 . TRP C 1 53 ? 29.556 46.597 34.485 1.00 67.05 ? 53 TRP C CH2 1 ATOM 3345 N N . SER C 1 54 ? 32.250 51.298 32.225 1.00 68.81 ? 54 SER C N 1 ATOM 3346 C CA . SER C 1 54 ? 32.781 50.502 31.104 1.00 68.21 ? 54 SER C CA 1 ATOM 3347 C C . SER C 1 54 ? 34.284 50.660 30.813 1.00 68.22 ? 54 SER C C 1 ATOM 3348 O O . SER C 1 54 ? 34.930 49.724 30.372 1.00 67.46 ? 54 SER C O 1 ATOM 3349 C CB . SER C 1 54 ? 31.998 50.800 29.828 1.00 68.02 ? 54 SER C CB 1 ATOM 3350 O OG . SER C 1 54 ? 30.621 50.544 30.004 1.00 69.85 ? 54 SER C OG 1 ATOM 3351 N N . GLN C 1 55 ? 34.828 51.846 31.055 1.00 68.27 ? 55 GLN C N 1 ATOM 3352 C CA . GLN C 1 55 ? 36.250 52.079 30.854 1.00 68.83 ? 55 GLN C CA 1 ATOM 3353 C C . GLN C 1 55 ? 37.141 51.326 31.863 1.00 68.99 ? 55 GLN C C 1 ATOM 3354 O O . GLN C 1 55 ? 38.375 51.299 31.710 1.00 69.12 ? 55 GLN C O 1 ATOM 3355 C CB . GLN C 1 55 ? 36.556 53.578 30.862 1.00 68.63 ? 55 GLN C CB 1 ATOM 3356 C CG . GLN C 1 55 ? 37.882 53.892 30.171 1.00 69.75 ? 55 GLN C CG 1 ATOM 3357 C CD . GLN C 1 55 ? 38.320 55.348 30.268 1.00 68.72 ? 55 GLN C CD 1 ATOM 3358 O OE1 . GLN C 1 55 ? 37.568 56.260 29.948 1.00 68.69 ? 55 GLN C OE1 1 ATOM 3359 N NE2 . GLN C 1 55 ? 39.544 55.555 30.704 1.00 69.02 ? 55 GLN C NE2 1 ATOM 3360 N N . GLY C 1 56 ? 36.512 50.723 32.878 1.00 69.14 ? 56 GLY C N 1 ATOM 3361 C CA . GLY C 1 56 ? 37.207 49.998 33.937 1.00 69.85 ? 56 GLY C CA 1 ATOM 3362 C C . GLY C 1 56 ? 38.204 50.858 34.711 1.00 70.94 ? 56 GLY C C 1 ATOM 3363 O O . GLY C 1 56 ? 37.966 52.048 34.987 1.00 71.20 ? 56 GLY C O 1 ATOM 3364 N N . LYS C 1 57 ? 39.331 50.251 35.063 1.00 71.17 ? 57 LYS C N 1 ATOM 3365 C CA . LYS C 1 57 ? 40.372 50.932 35.820 1.00 71.88 ? 57 LYS C CA 1 ATOM 3366 C C . LYS C 1 57 ? 41.448 51.516 34.913 1.00 71.90 ? 57 LYS C C 1 ATOM 3367 O O . LYS C 1 57 ? 42.568 51.750 35.351 1.00 72.07 ? 57 LYS C O 1 ATOM 3368 C CB . LYS C 1 57 ? 40.989 49.966 36.845 1.00 71.86 ? 57 LYS C CB 1 ATOM 3369 C CG . LYS C 1 57 ? 40.186 49.787 38.151 1.00 72.97 ? 57 LYS C CG 1 ATOM 3370 C CD . LYS C 1 57 ? 40.524 50.866 39.189 1.00 74.52 ? 57 LYS C CD 1 ATOM 3371 C CE . LYS C 1 57 ? 39.578 52.066 39.145 1.00 75.90 ? 57 LYS C CE 1 ATOM 3372 N NZ . LYS C 1 57 ? 38.209 51.707 39.630 1.00 74.07 ? 57 LYS C NZ 1 ATOM 3373 N N . LEU C 1 58 ? 41.099 51.752 33.651 1.00 72.37 ? 58 LEU C N 1 ATOM 3374 C CA . LEU C 1 58 ? 42.052 52.229 32.656 1.00 72.36 ? 58 LEU C CA 1 ATOM 3375 C C . LEU C 1 58 ? 42.069 53.736 32.464 1.00 72.68 ? 58 LEU C C 1 ATOM 3376 O O . LEU C 1 58 ? 41.050 54.405 32.627 1.00 73.04 ? 58 LEU C O 1 ATOM 3377 C CB . LEU C 1 58 ? 41.786 51.574 31.307 1.00 72.72 ? 58 LEU C CB 1 ATOM 3378 C CG . LEU C 1 58 ? 41.955 50.068 31.128 1.00 72.71 ? 58 LEU C CG 1 ATOM 3379 C CD1 . LEU C 1 58 ? 42.049 49.811 29.647 1.00 73.81 ? 58 LEU C CD1 1 ATOM 3380 C CD2 . LEU C 1 58 ? 43.181 49.529 31.854 1.00 72.92 ? 58 LEU C CD2 1 ATOM 3381 N N . SER C 1 59 ? 43.244 54.258 32.116 1.00 72.45 ? 59 SER C N 1 ATOM 3382 C CA . SER C 1 59 ? 43.396 55.668 31.801 1.00 72.39 ? 59 SER C CA 1 ATOM 3383 C C . SER C 1 59 ? 42.720 56.001 30.473 1.00 72.47 ? 59 SER C C 1 ATOM 3384 O O . SER C 1 59 ? 42.401 55.105 29.692 1.00 72.51 ? 59 SER C O 1 ATOM 3385 C CB . SER C 1 59 ? 44.878 56.022 31.722 1.00 72.47 ? 59 SER C CB 1 ATOM 3386 O OG . SER C 1 59 ? 45.537 55.177 30.795 1.00 71.80 ? 59 SER C OG 1 ATOM 3387 N N . ASN C 1 60 ? 42.498 57.289 30.229 1.00 72.76 ? 60 ASN C N 1 ATOM 3388 C CA . ASN C 1 60 ? 41.958 57.748 28.962 1.00 72.96 ? 60 ASN C CA 1 ATOM 3389 C C . ASN C 1 60 ? 42.930 57.419 27.853 1.00 72.89 ? 60 ASN C C 1 ATOM 3390 O O . ASN C 1 60 ? 42.545 56.848 26.837 1.00 73.76 ? 60 ASN C O 1 ATOM 3391 C CB . ASN C 1 60 ? 41.652 59.246 28.998 1.00 73.29 ? 60 ASN C CB 1 ATOM 3392 C CG . ASN C 1 60 ? 40.454 59.577 29.888 1.00 74.18 ? 60 ASN C CG 1 ATOM 3393 O OD1 . ASN C 1 60 ? 39.888 58.694 30.534 1.00 76.03 ? 60 ASN C OD1 1 ATOM 3394 N ND2 . ASN C 1 60 ? 40.065 60.849 29.920 1.00 72.45 ? 60 ASN C ND2 1 ATOM 3395 N N . GLN C 1 61 ? 44.192 57.768 28.050 1.00 72.82 ? 61 GLN C N 1 ATOM 3396 C CA . GLN C 1 61 ? 45.233 57.455 27.079 1.00 72.48 ? 61 GLN C CA 1 ATOM 3397 C C . GLN C 1 61 ? 45.305 55.948 26.896 1.00 72.11 ? 61 GLN C C 1 ATOM 3398 O O . GLN C 1 61 ? 45.472 55.446 25.783 1.00 72.64 ? 61 GLN C O 1 ATOM 3399 C CB . GLN C 1 61 ? 46.671 57.734 27.887 0.00 40.00 ? 61 GLN C CB 1 ATOM 3400 C CG . GLN C 1 61 ? 46.735 59.217 28.213 0.00 40.00 ? 61 GLN C CG 1 ATOM 3401 C CD . GLN C 1 61 ? 48.110 59.652 28.682 0.00 40.00 ? 61 GLN C CD 1 ATOM 3402 O OE1 . GLN C 1 61 ? 49.032 58.841 28.768 0.00 40.00 ? 61 GLN C OE1 1 ATOM 3403 N NE2 . GLN C 1 61 ? 48.474 60.884 29.019 0.00 40.00 ? 61 GLN C NE2 1 ATOM 3404 N N . GLN C 1 62 ? 45.175 55.215 27.993 1.00 71.86 ? 62 GLN C N 1 ATOM 3405 C CA . GLN C 1 62 ? 45.162 53.754 27.922 1.00 70.88 ? 62 GLN C CA 1 ATOM 3406 C C . GLN C 1 62 ? 43.909 53.260 27.194 1.00 71.05 ? 62 GLN C C 1 ATOM 3407 O O . GLN C 1 62 ? 43.946 52.219 26.506 1.00 70.91 ? 62 GLN C O 1 ATOM 3408 C CB . GLN C 1 62 ? 45.521 52.605 29.035 0.00 40.00 ? 62 GLN C CB 1 ATOM 3409 C CG . GLN C 1 62 ? 47.009 52.485 29.526 0.00 40.00 ? 62 GLN C CG 1 ATOM 3410 C CD . GLN C 1 62 ? 47.953 51.722 28.566 0.00 40.00 ? 62 GLN C CD 1 ATOM 3411 O OE1 . GLN C 1 62 ? 49.074 52.190 28.281 0.00 40.00 ? 62 GLN C OE1 1 ATOM 3412 N NE2 . GLN C 1 62 ? 47.509 50.558 28.083 0.00 40.00 ? 62 GLN C NE2 1 ATOM 3413 N N . TRP C 1 63 ? 42.803 53.987 27.328 1.00 70.44 ? 63 TRP C N 1 ATOM 3414 C CA . TRP C 1 63 ? 41.566 53.551 26.658 1.00 71.00 ? 63 TRP C CA 1 ATOM 3415 C C . TRP C 1 63 ? 41.701 53.754 25.144 1.00 71.24 ? 63 TRP C C 1 ATOM 3416 O O . TRP C 1 63 ? 41.660 52.802 24.373 1.00 71.50 ? 63 TRP C O 1 ATOM 3417 C CB . TRP C 1 63 ? 40.302 54.243 27.232 1.00 70.35 ? 63 TRP C CB 1 ATOM 3418 C CG . TRP C 1 63 ? 39.111 53.982 26.371 1.00 68.96 ? 63 TRP C CG 1 ATOM 3419 C CD1 . TRP C 1 63 ? 38.443 54.880 25.585 1.00 68.35 ? 63 TRP C CD1 1 ATOM 3420 C CD2 . TRP C 1 63 ? 38.472 52.745 26.199 1.00 65.11 ? 63 TRP C CD2 1 ATOM 3421 N NE1 . TRP C 1 63 ? 37.413 54.254 24.932 1.00 64.74 ? 63 TRP C NE1 1 ATOM 3422 C CE2 . TRP C 1 63 ? 37.413 52.937 25.298 1.00 68.09 ? 63 TRP C CE2 1 ATOM 3423 C CE3 . TRP C 1 63 ? 38.678 51.461 26.725 1.00 66.76 ? 63 TRP C CE3 1 ATOM 3424 C CZ2 . TRP C 1 63 ? 36.560 51.888 24.908 1.00 67.09 ? 63 TRP C CZ2 1 ATOM 3425 C CZ3 . TRP C 1 63 ? 37.846 50.441 26.336 1.00 67.75 ? 63 TRP C CZ3 1 ATOM 3426 C CH2 . TRP C 1 63 ? 36.797 50.660 25.441 1.00 68.20 ? 63 TRP C CH2 1 ATOM 3427 N N . GLU C 1 64 ? 41.864 55.017 24.767 1.00 71.61 ? 64 GLU C N 1 ATOM 3428 C CA . GLU C 1 64 ? 42.112 55.505 23.417 1.00 71.91 ? 64 GLU C CA 1 ATOM 3429 C C . GLU C 1 64 ? 43.120 54.684 22.595 1.00 72.66 ? 64 GLU C C 1 ATOM 3430 O O . GLU C 1 64 ? 42.872 54.452 21.417 1.00 72.76 ? 64 GLU C O 1 ATOM 3431 C CB . GLU C 1 64 ? 42.600 56.954 23.553 1.00 71.40 ? 64 GLU C CB 1 ATOM 3432 C CG . GLU C 1 64 ? 42.538 57.836 22.316 1.00 71.31 ? 64 GLU C CG 1 ATOM 3433 C CD . GLU C 1 64 ? 43.172 59.228 22.558 1.00 71.62 ? 64 GLU C CD 1 ATOM 3434 O OE1 . GLU C 1 64 ? 44.241 59.503 21.980 1.00 67.82 ? 64 GLU C OE1 1 ATOM 3435 O OE2 . GLU C 1 64 ? 42.610 60.047 23.327 1.00 71.37 ? 64 GLU C OE2 1 ATOM 3436 N N . LYS C 1 65 ? 44.243 54.263 23.197 1.00 73.39 ? 65 LYS C N 1 ATOM 3437 C CA . LYS C 1 65 ? 45.211 53.355 22.540 1.00 74.38 ? 65 LYS C CA 1 ATOM 3438 C C . LYS C 1 65 ? 44.577 51.996 22.222 1.00 73.84 ? 65 LYS C C 1 ATOM 3439 O O . LYS C 1 65 ? 44.747 51.476 21.126 1.00 74.20 ? 65 LYS C O 1 ATOM 3440 C CB . LYS C 1 65 ? 46.481 53.133 23.394 1.00 74.51 ? 65 LYS C CB 1 ATOM 3441 C CG . LYS C 1 65 ? 47.561 54.208 23.241 1.00 76.40 ? 65 LYS C CG 1 ATOM 3442 C CD . LYS C 1 65 ? 48.663 54.245 24.371 1.00 76.50 ? 65 LYS C CD 1 ATOM 3443 C CE . LYS C 1 65 ? 49.810 53.212 24.213 1.00 80.46 ? 65 LYS C CE 1 ATOM 3444 N NZ . LYS C 1 65 ? 49.424 51.793 24.543 1.00 80.59 ? 65 LYS C NZ 1 ATOM 3445 N N . LEU C 1 66 ? 43.843 51.438 23.188 1.00 73.73 ? 66 LEU C N 1 ATOM 3446 C CA . LEU C 1 66 ? 43.144 50.147 23.032 1.00 73.23 ? 66 LEU C CA 1 ATOM 3447 C C . LEU C 1 66 ? 42.059 50.250 21.957 1.00 73.37 ? 66 LEU C C 1 ATOM 3448 O O . LEU C 1 66 ? 41.849 49.366 21.148 1.00 72.74 ? 66 LEU C O 1 ATOM 3449 C CB . LEU C 1 66 ? 42.503 49.757 24.360 1.00 72.97 ? 66 LEU C CB 1 ATOM 3450 C CG . LEU C 1 66 ? 41.925 48.350 24.489 1.00 71.65 ? 66 LEU C CG 1 ATOM 3451 C CD1 . LEU C 1 66 ? 43.049 47.317 24.376 1.00 72.70 ? 66 LEU C CD1 1 ATOM 3452 C CD2 . LEU C 1 66 ? 41.210 48.192 25.796 1.00 69.30 ? 66 LEU C CD2 1 ATOM 3453 N N . GLN C 1 67 ? 41.366 51.364 21.965 1.00 73.92 ? 67 GLN C N 1 ATOM 3454 C CA . GLN C 1 67 ? 40.362 51.606 20.985 1.00 74.67 ? 67 GLN C CA 1 ATOM 3455 C C . GLN C 1 67 ? 40.979 51.703 19.603 1.00 75.39 ? 67 GLN C C 1 ATOM 3456 O O . GLN C 1 67 ? 40.386 51.223 18.651 1.00 74.85 ? 67 GLN C O 1 ATOM 3457 C CB . GLN C 1 67 ? 39.635 52.876 21.380 1.00 75.03 ? 67 GLN C CB 1 ATOM 3458 C CG . GLN C 1 67 ? 39.148 53.717 20.255 1.00 75.80 ? 67 GLN C CG 1 ATOM 3459 C CD . GLN C 1 67 ? 37.914 54.439 20.653 1.00 76.63 ? 67 GLN C CD 1 ATOM 3460 O OE1 . GLN C 1 67 ? 36.890 53.794 20.931 1.00 75.98 ? 67 GLN C OE1 1 ATOM 3461 N NE2 . GLN C 1 67 ? 37.977 55.768 20.687 1.00 71.13 ? 67 GLN C NE2 1 ATOM 3462 N N . HIS C 1 68 ? 42.173 52.325 19.507 1.00 76.45 ? 68 HIS C N 1 ATOM 3463 C CA . HIS C 1 68 ? 42.882 52.497 18.233 1.00 76.83 ? 68 HIS C CA 1 ATOM 3464 C C . HIS C 1 68 ? 43.121 51.167 17.582 1.00 77.58 ? 68 HIS C C 1 ATOM 3465 O O . HIS C 1 68 ? 42.870 51.008 16.390 1.00 77.64 ? 68 HIS C O 1 ATOM 3466 C CB . HIS C 1 68 ? 44.221 53.160 18.434 1.00 77.37 ? 68 HIS C CB 1 ATOM 3467 C CG . HIS C 1 68 ? 44.963 53.431 17.157 1.00 78.47 ? 68 HIS C CG 1 ATOM 3468 N ND1 . HIS C 1 68 ? 46.085 52.723 16.785 1.00 78.30 ? 68 HIS C ND1 1 ATOM 3469 C CD2 . HIS C 1 68 ? 44.743 54.335 16.171 1.00 78.29 ? 68 HIS C CD2 1 ATOM 3470 C CE1 . HIS C 1 68 ? 46.525 53.180 15.626 1.00 79.25 ? 68 HIS C CE1 1 ATOM 3471 N NE2 . HIS C 1 68 ? 45.728 54.158 15.233 1.00 79.22 ? 68 HIS C NE2 1 ATOM 3472 N N . MET C 1 69 ? 43.612 50.223 18.382 1.00 77.70 ? 69 MET C N 1 ATOM 3473 C CA . MET C 1 69 ? 43.805 48.863 17.962 1.00 79.46 ? 69 MET C CA 1 ATOM 3474 C C . MET C 1 69 ? 42.562 48.269 17.315 1.00 77.93 ? 69 MET C C 1 ATOM 3475 O O . MET C 1 69 ? 42.648 47.549 16.317 1.00 77.97 ? 69 MET C O 1 ATOM 3476 C CB . MET C 1 69 ? 44.119 48.004 19.174 1.00 79.35 ? 69 MET C CB 1 ATOM 3477 C CG . MET C 1 69 ? 45.545 48.035 19.605 1.00 82.21 ? 69 MET C CG 1 ATOM 3478 S SD . MET C 1 69 ? 45.825 46.763 20.849 1.00 84.79 ? 69 MET C SD 1 ATOM 3479 C CE . MET C 1 69 ? 44.963 45.353 20.122 1.00 82.74 ? 69 MET C CE 1 ATOM 3480 N N . PHE C 1 70 ? 41.408 48.571 17.899 1.00 76.44 ? 70 PHE C N 1 ATOM 3481 C CA . PHE C 1 70 ? 40.175 47.993 17.418 1.00 74.87 ? 70 PHE C CA 1 ATOM 3482 C C . PHE C 1 70 ? 39.695 48.635 16.135 1.00 73.88 ? 70 PHE C C 1 ATOM 3483 O O . PHE C 1 70 ? 39.156 47.958 15.280 1.00 73.59 ? 70 PHE C O 1 ATOM 3484 C CB . PHE C 1 70 ? 39.099 47.933 18.517 1.00 74.71 ? 70 PHE C CB 1 ATOM 3485 C CG . PHE C 1 70 ? 39.253 46.747 19.450 1.00 74.32 ? 70 PHE C CG 1 ATOM 3486 C CD1 . PHE C 1 70 ? 38.995 45.448 19.003 1.00 77.45 ? 70 PHE C CD1 1 ATOM 3487 C CD2 . PHE C 1 70 ? 39.647 46.923 20.767 1.00 72.89 ? 70 PHE C CD2 1 ATOM 3488 C CE1 . PHE C 1 70 ? 39.134 44.335 19.873 1.00 77.17 ? 70 PHE C CE1 1 ATOM 3489 C CE2 . PHE C 1 70 ? 39.792 45.847 21.636 1.00 73.72 ? 70 PHE C CE2 1 ATOM 3490 C CZ . PHE C 1 70 ? 39.540 44.547 21.200 1.00 74.69 ? 70 PHE C CZ 1 ATOM 3491 N N . GLN C 1 71 ? 39.897 49.936 16.008 1.00 73.45 ? 71 GLN C N 1 ATOM 3492 C CA . GLN C 1 71 ? 39.508 50.666 14.798 1.00 73.53 ? 71 GLN C CA 1 ATOM 3493 C C . GLN C 1 71 ? 40.276 50.127 13.572 1.00 73.48 ? 71 GLN C C 1 ATOM 3494 O O . GLN C 1 71 ? 39.700 49.897 12.494 1.00 73.83 ? 71 GLN C O 1 ATOM 3495 C CB . GLN C 1 71 ? 39.734 52.174 14.981 1.00 73.25 ? 71 GLN C CB 1 ATOM 3496 C CG . GLN C 1 71 ? 38.932 52.866 16.086 1.00 71.91 ? 71 GLN C CG 1 ATOM 3497 C CD . GLN C 1 71 ? 39.374 54.340 16.288 1.00 73.75 ? 71 GLN C CD 1 ATOM 3498 O OE1 . GLN C 1 71 ? 40.422 54.760 15.796 1.00 75.57 ? 71 GLN C OE1 1 ATOM 3499 N NE2 . GLN C 1 71 ? 38.575 55.105 17.007 1.00 71.72 ? 71 GLN C NE2 1 ATOM 3500 N N . VAL C 1 72 ? 41.577 49.924 13.757 1.00 72.98 ? 72 VAL C N 1 ATOM 3501 C CA . VAL C 1 72 ? 42.448 49.384 12.730 1.00 72.57 ? 72 VAL C CA 1 ATOM 3502 C C . VAL C 1 72 ? 42.084 47.927 12.449 1.00 72.11 ? 72 VAL C C 1 ATOM 3503 O O . VAL C 1 72 ? 42.101 47.490 11.308 1.00 71.92 ? 72 VAL C O 1 ATOM 3504 C CB . VAL C 1 72 ? 43.946 49.524 13.149 1.00 72.39 ? 72 VAL C CB 1 ATOM 3505 C CG1 . VAL C 1 72 ? 44.849 48.467 12.460 1.00 73.83 ? 72 VAL C CG1 1 ATOM 3506 C CG2 . VAL C 1 72 ? 44.432 50.910 12.892 1.00 71.73 ? 72 VAL C CG2 1 ATOM 3507 N N . TYR C 1 73 ? 41.758 47.180 13.493 1.00 72.39 ? 73 TYR C N 1 ATOM 3508 C CA . TYR C 1 73 ? 41.348 45.770 13.334 1.00 72.56 ? 73 TYR C CA 1 ATOM 3509 C C . TYR C 1 73 ? 40.038 45.646 12.564 1.00 72.77 ? 73 TYR C C 1 ATOM 3510 O O . TYR C 1 73 ? 39.912 44.785 11.706 1.00 73.02 ? 73 TYR C O 1 ATOM 3511 C CB . TYR C 1 73 ? 41.252 45.071 14.686 1.00 72.61 ? 73 TYR C CB 1 ATOM 3512 C CG . TYR C 1 73 ? 40.236 43.929 14.696 1.00 74.23 ? 73 TYR C CG 1 ATOM 3513 C CD1 . TYR C 1 73 ? 40.539 42.688 14.096 1.00 73.53 ? 73 TYR C CD1 1 ATOM 3514 C CD2 . TYR C 1 73 ? 38.973 44.092 15.295 1.00 72.02 ? 73 TYR C CD2 1 ATOM 3515 C CE1 . TYR C 1 73 ? 39.606 41.657 14.095 1.00 73.66 ? 73 TYR C CE1 1 ATOM 3516 C CE2 . TYR C 1 73 ? 38.043 43.061 15.305 1.00 70.71 ? 73 TYR C CE2 1 ATOM 3517 C CZ . TYR C 1 73 ? 38.363 41.846 14.704 1.00 73.28 ? 73 TYR C CZ 1 ATOM 3518 O OH . TYR C 1 73 ? 37.453 40.805 14.700 1.00 73.72 ? 73 TYR C OH 1 ATOM 3519 N N . ARG C 1 74 ? 39.066 46.502 12.873 1.00 73.01 ? 74 ARG C N 1 ATOM 3520 C CA . ARG C 1 74 ? 37.767 46.494 12.193 1.00 73.24 ? 74 ARG C CA 1 ATOM 3521 C C . ARG C 1 74 ? 37.869 46.695 10.679 1.00 73.16 ? 74 ARG C C 1 ATOM 3522 O O . ARG C 1 74 ? 37.268 45.935 9.925 1.00 72.29 ? 74 ARG C O 1 ATOM 3523 C CB . ARG C 1 74 ? 36.801 47.513 12.799 1.00 73.43 ? 74 ARG C CB 1 ATOM 3524 C CG . ARG C 1 74 ? 35.360 47.264 12.390 1.00 73.43 ? 74 ARG C CG 1 ATOM 3525 C CD . ARG C 1 74 ? 34.310 48.254 12.915 1.00 73.79 ? 74 ARG C CD 1 ATOM 3526 N NE . ARG C 1 74 ? 34.779 49.628 12.876 1.00 74.44 ? 74 ARG C NE 1 ATOM 3527 C CZ . ARG C 1 74 ? 34.001 50.713 12.828 1.00 76.44 ? 74 ARG C CZ 1 ATOM 3528 N NH1 . ARG C 1 74 ? 32.677 50.612 12.805 1.00 76.87 ? 74 ARG C NH1 1 ATOM 3529 N NH2 . ARG C 1 74 ? 34.563 51.914 12.798 1.00 75.01 ? 74 ARG C NH2 1 ATOM 3530 N N . VAL C 1 75 ? 38.614 47.711 10.228 1.00 73.62 ? 75 VAL C N 1 ATOM 3531 C CA . VAL C 1 75 ? 38.870 47.835 8.772 1.00 73.61 ? 75 VAL C CA 1 ATOM 3532 C C . VAL C 1 75 ? 39.707 46.655 8.179 1.00 73.11 ? 75 VAL C C 1 ATOM 3533 O O . VAL C 1 75 ? 39.371 46.160 7.124 1.00 72.63 ? 75 VAL C O 1 ATOM 3534 C CB . VAL C 1 75 ? 39.221 49.296 8.233 1.00 74.09 ? 75 VAL C CB 1 ATOM 3535 C CG1 . VAL C 1 75 ? 39.487 50.328 9.348 1.00 74.41 ? 75 VAL C CG1 1 ATOM 3536 C CG2 . VAL C 1 75 ? 40.298 49.281 7.134 1.00 74.06 ? 75 VAL C CG2 1 ATOM 3537 N N . SER C 1 76 ? 40.763 46.222 8.864 1.00 72.71 ? 76 SER C N 1 ATOM 3538 C CA . SER C 1 76 ? 41.584 45.099 8.412 1.00 72.48 ? 76 SER C CA 1 ATOM 3539 C C . SER C 1 76 ? 40.807 43.771 8.284 1.00 72.78 ? 76 SER C C 1 ATOM 3540 O O . SER C 1 76 ? 41.019 43.013 7.330 1.00 72.11 ? 76 SER C O 1 ATOM 3541 C CB . SER C 1 76 ? 42.756 44.901 9.369 1.00 72.97 ? 76 SER C CB 1 ATOM 3542 O OG . SER C 1 76 ? 43.615 46.034 9.396 1.00 72.03 ? 76 SER C OG 1 ATOM 3543 N N . PHE C 1 77 ? 39.911 43.494 9.247 1.00 73.35 ? 77 PHE C N 1 ATOM 3544 C CA . PHE C 1 77 ? 39.083 42.269 9.274 1.00 72.71 ? 77 PHE C CA 1 ATOM 3545 C C . PHE C 1 77 ? 38.178 42.250 8.054 1.00 73.31 ? 77 PHE C C 1 ATOM 3546 O O . PHE C 1 77 ? 38.028 41.217 7.395 1.00 73.44 ? 77 PHE C O 1 ATOM 3547 C CB . PHE C 1 77 ? 38.246 42.198 10.574 1.00 72.31 ? 77 PHE C CB 1 ATOM 3548 C CG . PHE C 1 77 ? 37.188 41.129 10.567 1.00 71.75 ? 77 PHE C CG 1 ATOM 3549 C CD1 . PHE C 1 77 ? 35.910 41.392 10.064 1.00 71.29 ? 77 PHE C CD1 1 ATOM 3550 C CD2 . PHE C 1 77 ? 37.461 39.852 11.061 1.00 71.58 ? 77 PHE C CD2 1 ATOM 3551 C CE1 . PHE C 1 77 ? 34.913 40.388 10.049 1.00 72.36 ? 77 PHE C CE1 1 ATOM 3552 C CE2 . PHE C 1 77 ? 36.472 38.848 11.052 1.00 71.59 ? 77 PHE C CE2 1 ATOM 3553 C CZ . PHE C 1 77 ? 35.198 39.110 10.547 1.00 71.00 ? 77 PHE C CZ 1 ATOM 3554 N N . THR C 1 78 ? 37.575 43.401 7.759 1.00 73.37 ? 78 THR C N 1 ATOM 3555 C CA . THR C 1 78 ? 36.682 43.545 6.614 1.00 74.22 ? 78 THR C CA 1 ATOM 3556 C C . THR C 1 78 ? 37.413 43.278 5.279 1.00 74.82 ? 78 THR C C 1 ATOM 3557 O O . THR C 1 78 ? 36.906 42.532 4.436 1.00 75.12 ? 78 THR C O 1 ATOM 3558 C CB . THR C 1 78 ? 36.048 44.956 6.624 1.00 74.27 ? 78 THR C CB 1 ATOM 3559 O OG1 . THR C 1 78 ? 35.243 45.108 7.806 1.00 75.65 ? 78 THR C OG1 1 ATOM 3560 C CG2 . THR C 1 78 ? 35.081 45.133 5.465 1.00 73.00 ? 78 THR C CG2 1 ATOM 3561 N N . ARG C 1 79 ? 38.589 43.894 5.114 1.00 74.38 ? 79 ARG C N 1 ATOM 3562 C CA . ARG C 1 79 ? 39.450 43.695 3.965 1.00 74.69 ? 79 ARG C CA 1 ATOM 3563 C C . ARG C 1 79 ? 39.883 42.223 3.849 1.00 74.71 ? 79 ARG C C 1 ATOM 3564 O O . ARG C 1 79 ? 39.795 41.652 2.788 1.00 74.93 ? 79 ARG C O 1 ATOM 3565 C CB . ARG C 1 79 ? 40.445 44.470 3.426 0.00 40.00 ? 79 ARG C CB 1 ATOM 3566 C CG . ARG C 1 79 ? 41.559 44.569 4.481 0.00 40.00 ? 79 ARG C CG 1 ATOM 3567 C CD . ARG C 1 79 ? 43.006 44.642 3.933 0.00 40.00 ? 79 ARG C CD 1 ATOM 3568 N NE . ARG C 1 79 ? 43.907 43.767 4.706 0.00 40.00 ? 79 ARG C NE 1 ATOM 3569 C CZ . ARG C 1 79 ? 44.601 44.131 5.795 0.00 40.00 ? 79 ARG C CZ 1 ATOM 3570 N NH1 . ARG C 1 79 ? 44.526 45.367 6.262 0.00 40.00 ? 79 ARG C NH1 1 ATOM 3571 N NH2 . ARG C 1 79 ? 45.380 43.250 6.419 0.00 40.00 ? 79 ARG C NH2 1 ATOM 3572 N N . ASP C 1 80 ? 40.346 41.618 4.937 1.00 74.91 ? 80 ASP C N 1 ATOM 3573 C CA . ASP C 1 80 ? 40.803 40.209 4.907 1.00 75.41 ? 80 ASP C CA 1 ATOM 3574 C C . ASP C 1 80 ? 39.727 39.188 4.530 1.00 75.43 ? 80 ASP C C 1 ATOM 3575 O O . ASP C 1 80 ? 40.008 38.336 3.710 1.00 76.19 ? 80 ASP C O 1 ATOM 3576 C CB . ASP C 1 80 ? 41.526 39.803 6.195 1.00 75.52 ? 80 ASP C CB 1 ATOM 3577 C CG . ASP C 1 80 ? 42.909 40.463 6.343 1.00 78.63 ? 80 ASP C CG 1 ATOM 3578 O OD1 . ASP C 1 80 ? 43.471 40.972 5.350 1.00 80.55 ? 80 ASP C OD1 1 ATOM 3579 O OD2 . ASP C 1 80 ? 43.524 40.523 7.428 1.00 83.50 ? 80 ASP C OD2 1 ATOM 3580 N N . ILE C 1 81 ? 38.519 39.270 5.114 1.00 75.34 ? 81 ILE C N 1 ATOM 3581 C CA . ILE C 1 81 ? 37.386 38.376 4.753 1.00 75.05 ? 81 ILE C CA 1 ATOM 3582 C C . ILE C 1 81 ? 36.981 38.423 3.276 1.00 74.94 ? 81 ILE C C 1 ATOM 3583 O O . ILE C 1 81 ? 36.687 37.385 2.674 1.00 74.97 ? 81 ILE C O 1 ATOM 3584 C CB . ILE C 1 81 ? 36.110 38.617 5.643 1.00 75.62 ? 81 ILE C CB 1 ATOM 3585 C CG1 . ILE C 1 81 ? 36.400 38.439 7.138 1.00 75.90 ? 81 ILE C CG1 1 ATOM 3586 C CG2 . ILE C 1 81 ? 34.965 37.653 5.250 1.00 75.15 ? 81 ILE C CG2 1 ATOM 3587 C CD1 . ILE C 1 81 ? 36.912 37.070 7.533 1.00 76.74 ? 81 ILE C CD1 1 ATOM 3588 N N . GLN C 1 82 ? 36.960 39.620 2.693 1.00 75.29 ? 82 GLN C N 1 ATOM 3589 C CA . GLN C 1 82 ? 36.608 39.766 1.292 1.00 75.36 ? 82 GLN C CA 1 ATOM 3590 C C . GLN C 1 82 ? 37.624 39.022 0.410 1.00 75.34 ? 82 GLN C C 1 ATOM 3591 O O . GLN C 1 82 ? 37.253 38.424 -0.593 1.00 74.79 ? 82 GLN C O 1 ATOM 3592 C CB . GLN C 1 82 ? 36.462 41.239 0.911 1.00 75.75 ? 82 GLN C CB 1 ATOM 3593 C CG . GLN C 1 82 ? 35.606 42.042 1.901 1.00 77.84 ? 82 GLN C CG 1 ATOM 3594 C CD . GLN C 1 82 ? 34.586 42.977 1.239 1.00 81.85 ? 82 GLN C CD 1 ATOM 3595 O OE1 . GLN C 1 82 ? 34.769 44.205 1.224 1.00 83.21 ? 82 GLN C OE1 1 ATOM 3596 N NE2 . GLN C 1 82 ? 33.506 42.397 0.695 1.00 81.97 ? 82 GLN C NE2 1 ATOM 3597 N N . GLU C 1 83 ? 38.899 39.068 0.806 1.00 75.56 ? 83 GLU C N 1 ATOM 3598 C CA . GLU C 1 83 ? 39.982 38.334 0.154 1.00 75.63 ? 83 GLU C CA 1 ATOM 3599 C C . GLU C 1 83 ? 39.908 36.833 0.403 1.00 75.43 ? 83 GLU C C 1 ATOM 3600 O O . GLU C 1 83 ? 39.935 36.038 -0.525 1.00 75.59 ? 83 GLU C O 1 ATOM 3601 C CB . GLU C 1 83 ? 41.332 38.837 0.634 1.00 75.67 ? 83 GLU C CB 1 ATOM 3602 C CG . GLU C 1 83 ? 41.892 39.991 -0.168 1.00 79.70 ? 83 GLU C CG 1 ATOM 3603 C CD . GLU C 1 83 ? 43.374 40.205 0.101 1.00 83.79 ? 83 GLU C CD 1 ATOM 3604 O OE1 . GLU C 1 83 ? 44.189 40.049 -0.837 1.00 84.06 ? 83 GLU C OE1 1 ATOM 3605 O OE2 . GLU C 1 83 ? 43.723 40.524 1.262 1.00 86.16 ? 83 GLU C OE2 1 ATOM 3606 N N . LEU C 1 84 ? 39.814 36.439 1.660 1.00 75.39 ? 84 LEU C N 1 ATOM 3607 C CA . LEU C 1 84 ? 39.726 35.031 1.992 1.00 75.63 ? 84 LEU C CA 1 ATOM 3608 C C . LEU C 1 84 ? 38.449 34.339 1.457 1.00 75.82 ? 84 LEU C C 1 ATOM 3609 O O . LEU C 1 84 ? 38.460 33.145 1.118 1.00 76.28 ? 84 LEU C O 1 ATOM 3610 C CB . LEU C 1 84 ? 39.856 34.854 3.493 1.00 75.92 ? 84 LEU C CB 1 ATOM 3611 C CG . LEU C 1 84 ? 41.146 35.252 4.210 1.00 75.87 ? 84 LEU C CG 1 ATOM 3612 C CD1 . LEU C 1 84 ? 40.997 34.865 5.660 1.00 75.84 ? 84 LEU C CD1 1 ATOM 3613 C CD2 . LEU C 1 84 ? 42.392 34.574 3.608 1.00 77.68 ? 84 LEU C CD2 1 ATOM 3614 N N . VAL C 1 85 ? 37.357 35.088 1.380 1.00 75.44 ? 85 VAL C N 1 ATOM 3615 C CA . VAL C 1 85 ? 36.096 34.561 0.853 1.00 75.22 ? 85 VAL C CA 1 ATOM 3616 C C . VAL C 1 85 ? 36.196 34.008 -0.590 1.00 75.22 ? 85 VAL C C 1 ATOM 3617 O O . VAL C 1 85 ? 35.473 33.081 -0.943 1.00 74.87 ? 85 VAL C O 1 ATOM 3618 C CB . VAL C 1 85 ? 34.938 35.591 1.072 1.00 75.18 ? 85 VAL C CB 1 ATOM 3619 C CG1 . VAL C 1 85 ? 34.027 35.729 -0.143 1.00 76.12 ? 85 VAL C CG1 1 ATOM 3620 C CG2 . VAL C 1 85 ? 34.167 35.258 2.329 1.00 73.99 ? 85 VAL C CG2 1 ATOM 3621 N N . LYS C 1 86 ? 37.090 34.564 -1.409 1.00 75.23 ? 86 LYS C N 1 ATOM 3622 C CA . LYS C 1 86 ? 37.289 34.088 -2.790 1.00 75.87 ? 86 LYS C CA 1 ATOM 3623 C C . LYS C 1 86 ? 37.709 32.610 -2.864 1.00 76.54 ? 86 LYS C C 1 ATOM 3624 O O . LYS C 1 86 ? 37.425 31.917 -3.851 1.00 76.20 ? 86 LYS C O 1 ATOM 3625 C CB . LYS C 1 86 ? 38.297 34.964 -3.532 1.00 75.40 ? 86 LYS C CB 1 ATOM 3626 C CG . LYS C 1 86 ? 37.832 36.390 -3.704 1.00 75.68 ? 86 LYS C CG 1 ATOM 3627 C CD . LYS C 1 86 ? 38.882 37.227 -4.388 1.00 75.23 ? 86 LYS C CD 1 ATOM 3628 C CE . LYS C 1 86 ? 38.623 38.705 -4.185 1.00 75.20 ? 86 LYS C CE 1 ATOM 3629 N NZ . LYS C 1 86 ? 39.632 39.504 -4.922 1.00 75.91 ? 86 LYS C NZ 1 ATOM 3630 N N . MET C 1 87 ? 38.374 32.143 -1.805 1.00 77.73 ? 87 MET C N 1 ATOM 3631 C CA . MET C 1 87 ? 38.888 30.775 -1.712 1.00 78.92 ? 87 MET C CA 1 ATOM 3632 C C . MET C 1 87 ? 37.804 29.758 -1.359 1.00 79.85 ? 87 MET C C 1 ATOM 3633 O O . MET C 1 87 ? 38.096 28.580 -1.207 1.00 79.64 ? 87 MET C O 1 ATOM 3634 C CB . MET C 1 87 ? 40.029 30.706 -0.693 1.00 78.42 ? 87 MET C CB 1 ATOM 3635 C CG . MET C 1 87 ? 41.144 31.706 -0.934 1.00 78.66 ? 87 MET C CG 1 ATOM 3636 S SD . MET C 1 87 ? 42.272 31.757 0.469 1.00 79.22 ? 87 MET C SD 1 ATOM 3637 C CE . MET C 1 87 ? 43.342 33.135 0.079 1.00 79.15 ? 87 MET C CE 1 ATOM 3638 N N . MET C 1 88 ? 36.564 30.228 -1.241 1.00 81.57 ? 88 MET C N 1 ATOM 3639 C CA . MET C 1 88 ? 35.418 29.398 -0.861 1.00 83.71 ? 88 MET C CA 1 ATOM 3640 C C . MET C 1 88 ? 35.127 28.231 -1.822 1.00 84.41 ? 88 MET C C 1 ATOM 3641 O O . MET C 1 88 ? 35.349 28.342 -3.032 1.00 84.63 ? 88 MET C O 1 ATOM 3642 C CB . MET C 1 88 ? 34.187 30.272 -0.716 1.00 83.14 ? 88 MET C CB 1 ATOM 3643 C CG . MET C 1 88 ? 33.161 29.735 0.229 1.00 83.80 ? 88 MET C CG 1 ATOM 3644 S SD . MET C 1 88 ? 31.734 30.825 0.279 1.00 85.33 ? 88 MET C SD 1 ATOM 3645 C CE . MET C 1 88 ? 32.473 32.378 0.775 1.00 82.07 ? 88 MET C CE 1 ATOM 3646 N N . SER C 1 89 ? 34.630 27.126 -1.259 1.00 85.81 ? 89 SER C N 1 ATOM 3647 C CA . SER C 1 89 ? 34.335 25.885 -2.001 1.00 87.17 ? 89 SER C CA 1 ATOM 3648 C C . SER C 1 89 ? 33.263 26.155 -3.084 1.00 88.07 ? 89 SER C C 1 ATOM 3649 O O . SER C 1 89 ? 33.028 27.329 -3.387 1.00 88.85 ? 89 SER C O 1 ATOM 3650 C CB . SER C 1 89 ? 33.970 24.761 -1.037 1.00 87.07 ? 89 SER C CB 1 ATOM 3651 O OG . SER C 1 89 ? 34.558 23.548 -1.477 1.00 88.09 ? 89 SER C OG 1 ATOM 3652 N N . PRO C 1 90 ? 32.575 25.156 -3.656 1.00 88.38 ? 90 PRO C N 1 ATOM 3653 C CA . PRO C 1 90 ? 32.021 25.338 -4.985 1.00 88.31 ? 90 PRO C CA 1 ATOM 3654 C C . PRO C 1 90 ? 32.252 26.760 -5.502 1.00 87.94 ? 90 PRO C C 1 ATOM 3655 O O . PRO C 1 90 ? 33.297 27.021 -6.112 1.00 88.10 ? 90 PRO C O 1 ATOM 3656 C CB . PRO C 1 90 ? 30.563 24.940 -4.780 1.00 88.35 ? 90 PRO C CB 1 ATOM 3657 C CG . PRO C 1 90 ? 30.707 23.801 -3.696 1.00 88.69 ? 90 PRO C CG 1 ATOM 3658 C CD . PRO C 1 90 ? 32.168 23.835 -3.144 1.00 88.58 ? 90 PRO C CD 1 ATOM 3659 N N . LYS C 1 91 ? 31.318 27.669 -5.264 1.00 87.44 ? 91 LYS C N 1 ATOM 3660 C CA . LYS C 1 91 ? 31.522 29.044 -5.673 1.00 86.70 ? 91 LYS C CA 1 ATOM 3661 C C . LYS C 1 91 ? 31.646 29.907 -4.429 1.00 86.26 ? 91 LYS C C 1 ATOM 3662 O O . LYS C 1 91 ? 31.353 29.471 -3.314 1.00 86.09 ? 91 LYS C O 1 ATOM 3663 C CB . LYS C 1 91 ? 30.737 29.238 -6.295 0.00 40.00 ? 91 LYS C CB 1 ATOM 3664 C CG . LYS C 1 91 ? 30.046 28.056 -6.982 0.00 40.00 ? 91 LYS C CG 1 ATOM 3665 C CD . LYS C 1 91 ? 29.653 28.348 -8.432 0.00 40.00 ? 91 LYS C CD 1 ATOM 3666 C CE . LYS C 1 91 ? 29.879 27.108 -9.316 0.00 40.00 ? 91 LYS C CE 1 ATOM 3667 N NZ . LYS C 1 91 ? 29.511 27.351 -10.736 0.00 40.00 ? 91 LYS C NZ 1 ATOM 3668 N N . GLU C 1 92 ? 32.090 31.136 -4.638 1.00 85.69 ? 92 GLU C N 1 ATOM 3669 C CA . GLU C 1 92 ? 32.096 32.158 -3.615 1.00 85.23 ? 92 GLU C CA 1 ATOM 3670 C C . GLU C 1 92 ? 30.627 32.594 -3.467 1.00 85.02 ? 92 GLU C C 1 ATOM 3671 O O . GLU C 1 92 ? 30.258 33.690 -3.886 1.00 85.11 ? 92 GLU C O 1 ATOM 3672 C CB . GLU C 1 92 ? 32.989 33.289 -4.121 1.00 84.90 ? 92 GLU C CB 1 ATOM 3673 C CG . GLU C 1 92 ? 33.022 34.586 -3.340 1.00 84.72 ? 92 GLU C CG 1 ATOM 3674 C CD . GLU C 1 92 ? 33.670 35.701 -4.156 1.00 85.20 ? 92 GLU C CD 1 ATOM 3675 O OE1 . GLU C 1 92 ? 33.947 35.474 -5.346 1.00 83.67 ? 92 GLU C OE1 1 ATOM 3676 O OE2 . GLU C 1 92 ? 33.907 36.807 -3.626 1.00 86.64 ? 92 GLU C OE2 1 ATOM 3677 N N . ASP C 1 93 ? 29.792 31.730 -2.876 1.00 84.70 ? 93 ASP C N 1 ATOM 3678 C CA . ASP C 1 93 ? 28.327 31.963 -2.800 1.00 84.14 ? 93 ASP C CA 1 ATOM 3679 C C . ASP C 1 93 ? 27.915 32.953 -1.711 1.00 83.11 ? 93 ASP C C 1 ATOM 3680 O O . ASP C 1 93 ? 28.404 32.898 -0.579 1.00 82.72 ? 93 ASP C O 1 ATOM 3681 C CB . ASP C 1 93 ? 27.539 30.645 -2.677 1.00 84.62 ? 93 ASP C CB 1 ATOM 3682 C CG . ASP C 1 93 ? 27.538 29.821 -3.976 1.00 85.85 ? 93 ASP C CG 1 ATOM 3683 O OD1 . ASP C 1 93 ? 28.467 29.960 -4.809 1.00 86.56 ? 93 ASP C OD1 1 ATOM 3684 O OD2 . ASP C 1 93 ? 26.634 28.997 -4.248 1.00 86.92 ? 93 ASP C OD2 1 ATOM 3685 N N . TYR C 1 94 ? 27.002 33.858 -2.051 1.00 81.82 ? 94 TYR C N 1 ATOM 3686 C CA . TYR C 1 94 ? 26.767 34.941 -1.126 1.00 80.15 ? 94 TYR C CA 1 ATOM 3687 C C . TYR C 1 94 ? 25.910 34.830 0.118 1.00 79.34 ? 94 TYR C C 1 ATOM 3688 O O . TYR C 1 94 ? 25.951 33.772 0.744 1.00 80.42 ? 94 TYR C O 1 ATOM 3689 C CB . TYR C 1 94 ? 26.856 36.343 -1.735 1.00 80.15 ? 94 TYR C CB 1 ATOM 3690 C CG . TYR C 1 94 ? 28.264 36.870 -1.642 1.00 79.46 ? 94 TYR C CG 1 ATOM 3691 C CD1 . TYR C 1 94 ? 29.094 36.918 -2.759 1.00 79.07 ? 94 TYR C CD1 1 ATOM 3692 C CD2 . TYR C 1 94 ? 28.770 37.312 -0.427 1.00 80.12 ? 94 TYR C CD2 1 ATOM 3693 C CE1 . TYR C 1 94 ? 30.393 37.397 -2.669 1.00 78.61 ? 94 TYR C CE1 1 ATOM 3694 C CE2 . TYR C 1 94 ? 30.059 37.790 -0.324 1.00 80.62 ? 94 TYR C CE2 1 ATOM 3695 C CZ . TYR C 1 94 ? 30.868 37.829 -1.450 1.00 80.24 ? 94 TYR C CZ 1 ATOM 3696 O OH . TYR C 1 94 ? 32.148 38.307 -1.324 1.00 80.36 ? 94 TYR C OH 1 ATOM 3697 N N . PRO C 1 95 ? 25.103 35.832 0.463 1.00 77.40 ? 95 PRO C N 1 ATOM 3698 C CA . PRO C 1 95 ? 25.054 36.357 1.821 1.00 75.35 ? 95 PRO C CA 1 ATOM 3699 C C . PRO C 1 95 ? 26.009 35.655 2.759 1.00 73.54 ? 95 PRO C C 1 ATOM 3700 O O . PRO C 1 95 ? 25.973 34.452 2.892 1.00 73.37 ? 95 PRO C O 1 ATOM 3701 C CB . PRO C 1 95 ? 23.584 36.208 2.176 1.00 75.19 ? 95 PRO C CB 1 ATOM 3702 C CG . PRO C 1 95 ? 22.931 36.312 0.766 1.00 76.65 ? 95 PRO C CG 1 ATOM 3703 C CD . PRO C 1 95 ? 24.066 36.472 -0.343 1.00 77.43 ? 95 PRO C CD 1 ATOM 3704 N N . ILE C 1 96 ? 26.881 36.394 3.411 1.00 72.19 ? 96 ILE C N 1 ATOM 3705 C CA . ILE C 1 96 ? 27.790 35.743 4.333 1.00 71.01 ? 96 ILE C CA 1 ATOM 3706 C C . ILE C 1 96 ? 27.700 36.379 5.702 1.00 70.39 ? 96 ILE C C 1 ATOM 3707 O O . ILE C 1 96 ? 27.782 37.599 5.824 1.00 69.55 ? 96 ILE C O 1 ATOM 3708 C CB . ILE C 1 96 ? 29.226 35.697 3.774 1.00 70.97 ? 96 ILE C CB 1 ATOM 3709 C CG1 . ILE C 1 96 ? 29.301 34.602 2.717 1.00 71.20 ? 96 ILE C CG1 1 ATOM 3710 C CG2 . ILE C 1 96 ? 30.238 35.348 4.867 1.00 70.63 ? 96 ILE C CG2 1 ATOM 3711 C CD1 . ILE C 1 96 ? 30.402 34.799 1.726 1.00 71.76 ? 96 ILE C CD1 1 ATOM 3712 N N . GLU C 1 97 ? 27.528 35.524 6.711 1.00 69.81 ? 97 GLU C N 1 ATOM 3713 C CA . GLU C 1 97 ? 27.379 35.917 8.090 1.00 70.06 ? 97 GLU C CA 1 ATOM 3714 C C . GLU C 1 97 ? 28.538 35.389 8.913 1.00 70.57 ? 97 GLU C C 1 ATOM 3715 O O . GLU C 1 97 ? 28.780 34.178 8.953 1.00 69.97 ? 97 GLU C O 1 ATOM 3716 C CB . GLU C 1 97 ? 26.105 35.299 8.622 1.00 70.82 ? 97 GLU C CB 1 ATOM 3717 C CG . GLU C 1 97 ? 25.226 36.319 9.274 1.00 72.00 ? 97 GLU C CG 1 ATOM 3718 C CD . GLU C 1 97 ? 24.747 37.354 8.257 1.00 74.54 ? 97 GLU C CD 1 ATOM 3719 O OE1 . GLU C 1 97 ? 24.973 38.549 8.536 1.00 71.72 ? 97 GLU C OE1 1 ATOM 3720 O OE2 . GLU C 1 97 ? 24.162 36.970 7.189 1.00 72.32 ? 97 GLU C OE2 1 ATOM 3721 N N . ILE C 1 98 ? 29.263 36.284 9.574 1.00 71.36 ? 98 ILE C N 1 ATOM 3722 C CA . ILE C 1 98 ? 30.386 35.865 10.424 1.00 72.04 ? 98 ILE C CA 1 ATOM 3723 C C . ILE C 1 98 ? 30.210 36.373 11.840 1.00 72.47 ? 98 ILE C C 1 ATOM 3724 O O . ILE C 1 98 ? 29.890 37.538 12.061 1.00 72.72 ? 98 ILE C O 1 ATOM 3725 C CB . ILE C 1 98 ? 31.767 36.254 9.821 1.00 72.47 ? 98 ILE C CB 1 ATOM 3726 C CG1 . ILE C 1 98 ? 32.065 35.374 8.613 1.00 73.75 ? 98 ILE C CG1 1 ATOM 3727 C CG2 . ILE C 1 98 ? 32.900 36.129 10.862 1.00 71.92 ? 98 ILE C CG2 1 ATOM 3728 C CD1 . ILE C 1 98 ? 33.524 35.339 8.204 1.00 78.47 ? 98 ILE C CD1 1 ATOM 3729 N N . GLN C 1 99 ? 30.417 35.474 12.794 1.00 72.53 ? 99 GLN C N 1 ATOM 3730 C CA . GLN C 1 99 ? 30.265 35.795 14.190 1.00 73.03 ? 99 GLN C CA 1 ATOM 3731 C C . GLN C 1 99 ? 31.520 35.455 14.977 1.00 73.75 ? 99 GLN C C 1 ATOM 3732 O O . GLN C 1 99 ? 32.076 34.378 14.807 1.00 74.72 ? 99 GLN C O 1 ATOM 3733 C CB . GLN C 1 99 ? 29.098 35.015 14.767 1.00 72.72 ? 99 GLN C CB 1 ATOM 3734 C CG . GLN C 1 99 ? 27.749 35.530 14.406 1.00 71.39 ? 99 GLN C CG 1 ATOM 3735 C CD . GLN C 1 99 ? 26.688 34.478 14.585 1.00 73.44 ? 99 GLN C CD 1 ATOM 3736 O OE1 . GLN C 1 99 ? 26.467 33.659 13.702 1.00 75.06 ? 99 GLN C OE1 1 ATOM 3737 N NE2 . GLN C 1 99 ? 26.025 34.498 15.725 1.00 73.18 ? 99 GLN C NE2 1 ATOM 3738 N N . LEU C 1 100 ? 31.954 36.390 15.816 1.00 74.28 ? 100 LEU C N 1 ATOM 3739 C CA . LEU C 1 100 ? 33.068 36.204 16.736 1.00 75.20 ? 100 LEU C CA 1 ATOM 3740 C C . LEU C 1 100 ? 32.647 36.426 18.179 1.00 75.56 ? 100 LEU C C 1 ATOM 3741 O O . LEU C 1 100 ? 31.934 37.377 18.478 1.00 75.06 ? 100 LEU C O 1 ATOM 3742 C CB . LEU C 1 100 ? 34.221 37.167 16.448 1.00 75.56 ? 100 LEU C CB 1 ATOM 3743 C CG . LEU C 1 100 ? 35.195 36.810 15.363 1.00 75.95 ? 100 LEU C CG 1 ATOM 3744 C CD1 . LEU C 1 100 ? 34.489 36.749 14.047 1.00 78.75 ? 100 LEU C CD1 1 ATOM 3745 C CD2 . LEU C 1 100 ? 36.240 37.862 15.340 1.00 76.99 ? 100 LEU C CD2 1 ATOM 3746 N N . SER C 1 101 ? 33.100 35.527 19.059 1.00 75.75 ? 101 SER C N 1 ATOM 3747 C CA . SER C 1 101 ? 32.874 35.631 20.484 1.00 75.53 ? 101 SER C CA 1 ATOM 3748 C C . SER C 1 101 ? 34.242 35.489 21.161 1.00 76.03 ? 101 SER C C 1 ATOM 3749 O O . SER C 1 101 ? 34.845 34.422 21.120 1.00 75.81 ? 101 SER C O 1 ATOM 3750 C CB . SER C 1 101 ? 31.877 34.558 20.946 1.00 75.78 ? 101 SER C CB 1 ATOM 3751 O OG . SER C 1 101 ? 31.651 34.678 22.321 1.00 75.81 ? 101 SER C OG 1 ATOM 3752 N N . ALA C 1 102 ? 34.723 36.575 21.771 1.00 76.54 ? 102 ALA C N 1 ATOM 3753 C CA . ALA C 1 102 ? 36.048 36.614 22.402 1.00 77.27 ? 102 ALA C CA 1 ATOM 3754 C C . ALA C 1 102 ? 36.004 37.133 23.837 1.00 77.67 ? 102 ALA C C 1 ATOM 3755 O O . ALA C 1 102 ? 35.156 37.966 24.184 1.00 78.52 ? 102 ALA C O 1 ATOM 3756 C CB . ALA C 1 102 ? 37.019 37.438 21.575 1.00 76.72 ? 102 ALA C CB 1 ATOM 3757 N N . GLY C 1 103 ? 36.913 36.635 24.673 1.00 78.00 ? 103 GLY C N 1 ATOM 3758 C CA . GLY C 1 103 ? 36.979 37.099 26.053 1.00 78.53 ? 103 GLY C CA 1 ATOM 3759 C C . GLY C 1 103 ? 37.612 36.161 27.056 1.00 78.97 ? 103 GLY C C 1 ATOM 3760 O O . GLY C 1 103 ? 38.565 35.447 26.764 1.00 79.36 ? 103 GLY C O 1 ATOM 3761 N N . CYS C 1 104 ? 37.063 36.177 28.253 1.00 79.44 ? 104 CYS C N 1 ATOM 3762 C CA . CYS C 1 104 ? 37.605 35.449 29.369 1.00 80.53 ? 104 CYS C CA 1 ATOM 3763 C C . CYS C 1 104 ? 36.516 35.254 30.388 1.00 80.57 ? 104 CYS C C 1 ATOM 3764 O O . CYS C 1 104 ? 35.699 36.132 30.597 1.00 80.36 ? 104 CYS C O 1 ATOM 3765 C CB . CYS C 1 104 ? 38.831 36.187 29.974 1.00 80.57 ? 104 CYS C CB 1 ATOM 3766 S SG . CYS C 1 104 ? 38.805 38.020 30.056 1.00 83.14 ? 104 CYS C SG 1 ATOM 3767 N N . GLU C 1 105 ? 36.503 34.084 31.003 1.00 81.53 ? 105 GLU C N 1 ATOM 3768 C CA . GLU C 1 105 ? 35.617 33.808 32.122 1.00 82.56 ? 105 GLU C CA 1 ATOM 3769 C C . GLU C 1 105 ? 36.534 34.018 33.318 1.00 83.49 ? 105 GLU C C 1 ATOM 3770 O O . GLU C 1 105 ? 37.565 33.353 33.424 1.00 83.32 ? 105 GLU C O 1 ATOM 3771 C CB . GLU C 1 105 ? 35.389 32.337 32.152 0.00 40.00 ? 105 GLU C CB 1 ATOM 3772 C CG . GLU C 1 105 ? 34.663 31.990 30.861 0.00 40.00 ? 105 GLU C CG 1 ATOM 3773 C CD . GLU C 1 105 ? 34.411 30.497 30.673 0.00 40.00 ? 105 GLU C CD 1 ATOM 3774 O OE1 . GLU C 1 105 ? 34.820 29.688 31.544 0.00 40.00 ? 105 GLU C OE1 1 ATOM 3775 O OE2 . GLU C 1 105 ? 33.795 30.138 29.634 0.00 40.00 ? 105 GLU C OE2 1 ATOM 3776 N N . MET C 1 106 ? 36.179 34.940 34.209 1.00 84.38 ? 106 MET C N 1 ATOM 3777 C CA . MET C 1 106 ? 37.001 35.223 35.389 1.00 85.32 ? 106 MET C CA 1 ATOM 3778 C C . MET C 1 106 ? 36.694 34.264 36.529 1.00 85.75 ? 106 MET C C 1 ATOM 3779 O O . MET C 1 106 ? 35.539 33.880 36.731 1.00 85.90 ? 106 MET C O 1 ATOM 3780 C CB . MET C 1 106 ? 36.766 36.650 35.880 1.00 85.65 ? 106 MET C CB 1 ATOM 3781 C CG . MET C 1 106 ? 37.025 37.725 34.849 1.00 87.24 ? 106 MET C CG 1 ATOM 3782 S SD . MET C 1 106 ? 38.758 37.877 34.358 1.00 89.48 ? 106 MET C SD 1 ATOM 3783 C CE . MET C 1 106 ? 39.549 38.444 35.878 1.00 90.50 ? 106 MET C CE 1 ATOM 3784 N N . TYR C 1 107 ? 37.727 33.882 37.272 1.00 86.30 ? 107 TYR C N 1 ATOM 3785 C CA . TYR C 1 107 ? 37.539 33.041 38.449 1.00 86.92 ? 107 TYR C CA 1 ATOM 3786 C C . TYR C 1 107 ? 38.292 33.641 39.638 1.00 87.03 ? 107 TYR C C 1 ATOM 3787 O O . TYR C 1 107 ? 37.705 33.869 40.714 1.00 87.04 ? 107 TYR C O 1 ATOM 3788 C CB . TYR C 1 107 ? 37.993 31.591 38.199 1.00 87.38 ? 107 TYR C CB 1 ATOM 3789 C CG . TYR C 1 107 ? 37.552 30.968 36.876 1.00 88.07 ? 107 TYR C CG 1 ATOM 3790 C CD1 . TYR C 1 107 ? 36.227 30.579 36.656 1.00 88.19 ? 107 TYR C CD1 1 ATOM 3791 C CD2 . TYR C 1 107 ? 38.477 30.760 35.847 1.00 88.74 ? 107 TYR C CD2 1 ATOM 3792 C CE1 . TYR C 1 107 ? 35.840 30.006 35.435 1.00 88.79 ? 107 TYR C CE1 1 ATOM 3793 C CE2 . TYR C 1 107 ? 38.100 30.189 34.631 1.00 88.64 ? 107 TYR C CE2 1 ATOM 3794 C CZ . TYR C 1 107 ? 36.788 29.816 34.429 1.00 88.60 ? 107 TYR C CZ 1 ATOM 3795 O OH . TYR C 1 107 ? 36.441 29.257 33.215 1.00 88.23 ? 107 TYR C OH 1 ATOM 3796 N N . SER C 1 112 ? 41.530 33.128 35.282 1.00 75.88 ? 112 SER C N 1 ATOM 3797 C CA . SER C 1 112 ? 40.786 33.171 34.025 1.00 76.13 ? 112 SER C CA 1 ATOM 3798 C C . SER C 1 112 ? 41.291 32.228 32.922 1.00 76.25 ? 112 SER C C 1 ATOM 3799 O O . SER C 1 112 ? 42.422 31.720 32.963 1.00 76.12 ? 112 SER C O 1 ATOM 3800 C CB . SER C 1 112 ? 40.632 34.606 33.500 1.00 75.94 ? 112 SER C CB 1 ATOM 3801 O OG . SER C 1 112 ? 41.836 35.336 33.624 1.00 76.82 ? 112 SER C OG 1 ATOM 3802 N N . GLU C 1 113 ? 40.410 32.014 31.942 1.00 76.14 ? 113 GLU C N 1 ATOM 3803 C CA . GLU C 1 113 ? 40.632 31.157 30.792 1.00 75.29 ? 113 GLU C CA 1 ATOM 3804 C C . GLU C 1 113 ? 39.935 31.933 29.692 1.00 75.03 ? 113 GLU C C 1 ATOM 3805 O O . GLU C 1 113 ? 38.738 32.220 29.780 1.00 75.19 ? 113 GLU C O 1 ATOM 3806 C CB . GLU C 1 113 ? 39.893 29.764 31.193 0.00 40.00 ? 113 GLU C CB 1 ATOM 3807 C CG . GLU C 1 113 ? 40.794 28.842 32.044 0.00 40.00 ? 113 GLU C CG 1 ATOM 3808 C CD . GLU C 1 113 ? 40.065 27.865 32.997 0.00 40.00 ? 113 GLU C CD 1 ATOM 3809 O OE1 . GLU C 1 113 ? 38.808 27.859 33.070 0.00 40.00 ? 113 GLU C OE1 1 ATOM 3810 O OE2 . GLU C 1 113 ? 40.758 27.085 33.707 0.00 40.00 ? 113 GLU C OE2 1 ATOM 3811 N N . SER C 1 114 ? 40.698 32.264 28.666 1.00 74.33 ? 114 SER C N 1 ATOM 3812 C CA . SER C 1 114 ? 40.249 33.106 27.582 1.00 74.02 ? 114 SER C CA 1 ATOM 3813 C C . SER C 1 114 ? 39.775 32.287 26.395 1.00 73.78 ? 114 SER C C 1 ATOM 3814 O O . SER C 1 114 ? 40.060 31.086 26.290 1.00 74.01 ? 114 SER C O 1 ATOM 3815 C CB . SER C 1 114 ? 41.377 34.035 27.180 1.00 73.65 ? 114 SER C CB 1 ATOM 3816 O OG . SER C 1 114 ? 41.591 34.952 28.236 1.00 75.15 ? 114 SER C OG 1 ATOM 3817 N N . PHE C 1 115 ? 39.045 32.941 25.503 1.00 73.43 ? 115 PHE C N 1 ATOM 3818 C CA . PHE C 1 115 ? 38.457 32.261 24.368 1.00 73.49 ? 115 PHE C CA 1 ATOM 3819 C C . PHE C 1 115 ? 38.309 33.227 23.185 1.00 73.57 ? 115 PHE C C 1 ATOM 3820 O O . PHE C 1 115 ? 38.119 34.448 23.369 1.00 73.21 ? 115 PHE C O 1 ATOM 3821 C CB . PHE C 1 115 ? 37.118 31.583 24.758 1.00 73.46 ? 115 PHE C CB 1 ATOM 3822 C CG . PHE C 1 115 ? 36.026 32.557 25.116 1.00 73.98 ? 115 PHE C CG 1 ATOM 3823 C CD1 . PHE C 1 115 ? 35.905 33.056 26.433 1.00 75.33 ? 115 PHE C CD1 1 ATOM 3824 C CD2 . PHE C 1 115 ? 35.117 32.990 24.148 1.00 73.52 ? 115 PHE C CD2 1 ATOM 3825 C CE1 . PHE C 1 115 ? 34.883 33.987 26.780 1.00 74.18 ? 115 PHE C CE1 1 ATOM 3826 C CE2 . PHE C 1 115 ? 34.083 33.917 24.478 1.00 74.21 ? 115 PHE C CE2 1 ATOM 3827 C CZ . PHE C 1 115 ? 33.971 34.418 25.808 1.00 74.03 ? 115 PHE C CZ 1 ATOM 3828 N N . LEU C 1 116 ? 38.415 32.658 21.981 1.00 73.18 ? 116 LEU C N 1 ATOM 3829 C CA . LEU C 1 116 ? 38.194 33.365 20.751 1.00 73.63 ? 116 LEU C CA 1 ATOM 3830 C C . LEU C 1 116 ? 37.587 32.366 19.786 1.00 73.74 ? 116 LEU C C 1 ATOM 3831 O O . LEU C 1 116 ? 38.296 31.532 19.227 1.00 74.67 ? 116 LEU C O 1 ATOM 3832 C CB . LEU C 1 116 ? 39.506 33.940 20.174 1.00 73.55 ? 116 LEU C CB 1 ATOM 3833 C CG . LEU C 1 116 ? 39.368 35.184 19.274 1.00 73.31 ? 116 LEU C CG 1 ATOM 3834 C CD1 . LEU C 1 116 ? 40.723 35.644 18.735 1.00 73.86 ? 116 LEU C CD1 1 ATOM 3835 C CD2 . LEU C 1 116 ? 38.414 35.022 18.114 1.00 72.78 ? 116 LEU C CD2 1 ATOM 3836 N N . HIS C 1 117 ? 36.277 32.451 19.582 1.00 73.31 ? 117 HIS C N 1 ATOM 3837 C CA . HIS C 1 117 ? 35.587 31.497 18.722 1.00 72.99 ? 117 HIS C CA 1 ATOM 3838 C C . HIS C 1 117 ? 34.988 32.194 17.548 1.00 72.24 ? 117 HIS C C 1 ATOM 3839 O O . HIS C 1 117 ? 34.641 33.373 17.646 1.00 73.71 ? 117 HIS C O 1 ATOM 3840 C CB . HIS C 1 117 ? 34.512 30.725 19.502 1.00 73.97 ? 117 HIS C CB 1 ATOM 3841 C CG . HIS C 1 117 ? 35.075 29.762 20.486 1.00 75.60 ? 117 HIS C CG 1 ATOM 3842 N ND1 . HIS C 1 117 ? 34.555 29.604 21.747 1.00 78.81 ? 117 HIS C ND1 1 ATOM 3843 C CD2 . HIS C 1 117 ? 36.120 28.908 20.399 1.00 77.69 ? 117 HIS C CD2 1 ATOM 3844 C CE1 . HIS C 1 117 ? 35.249 28.684 22.394 1.00 80.50 ? 117 HIS C CE1 1 ATOM 3845 N NE2 . HIS C 1 117 ? 36.208 28.249 21.599 1.00 79.80 ? 117 HIS C NE2 1 ATOM 3846 N N . VAL C 1 118 ? 34.886 31.473 16.430 1.00 71.45 ? 118 VAL C N 1 ATOM 3847 C CA . VAL C 1 118 ? 34.363 32.038 15.199 1.00 70.75 ? 118 VAL C CA 1 ATOM 3848 C C . VAL C 1 118 ? 33.360 31.124 14.509 1.00 70.50 ? 118 VAL C C 1 ATOM 3849 O O . VAL C 1 118 ? 33.594 29.945 14.334 1.00 69.57 ? 118 VAL C O 1 ATOM 3850 C CB . VAL C 1 118 ? 35.519 32.423 14.181 1.00 71.56 ? 118 VAL C CB 1 ATOM 3851 C CG1 . VAL C 1 118 ? 34.968 33.064 12.908 1.00 69.49 ? 118 VAL C CG1 1 ATOM 3852 C CG2 . VAL C 1 118 ? 36.550 33.350 14.814 1.00 69.01 ? 118 VAL C CG2 1 ATOM 3853 N N . ALA C 1 119 ? 32.233 31.699 14.119 1.00 70.66 ? 119 ALA C N 1 ATOM 3854 C CA . ALA C 1 119 ? 31.277 30.981 13.295 1.00 70.30 ? 119 ALA C CA 1 ATOM 3855 C C . ALA C 1 119 ? 31.083 31.650 11.924 1.00 70.37 ? 119 ALA C C 1 ATOM 3856 O O . ALA C 1 119 ? 31.220 32.873 11.770 1.00 69.66 ? 119 ALA C O 1 ATOM 3857 C CB . ALA C 1 119 ? 29.957 30.786 14.014 1.00 70.28 ? 119 ALA C CB 1 ATOM 3858 N N . PHE C 1 120 ? 30.763 30.795 10.945 1.00 70.76 ? 120 PHE C N 1 ATOM 3859 C CA . PHE C 1 120 ? 30.502 31.116 9.541 1.00 70.64 ? 120 PHE C CA 1 ATOM 3860 C C . PHE C 1 120 ? 29.185 30.440 9.201 1.00 70.17 ? 120 PHE C C 1 ATOM 3861 O O . PHE C 1 120 ? 29.034 29.225 9.399 1.00 69.81 ? 120 PHE C O 1 ATOM 3862 C CB . PHE C 1 120 ? 31.636 30.533 8.682 1.00 71.78 ? 120 PHE C CB 1 ATOM 3863 C CG . PHE C 1 120 ? 31.535 30.853 7.220 1.00 72.20 ? 120 PHE C CG 1 ATOM 3864 C CD1 . PHE C 1 120 ? 31.986 32.073 6.730 1.00 76.13 ? 120 PHE C CD1 1 ATOM 3865 C CD2 . PHE C 1 120 ? 31.004 29.937 6.334 1.00 74.35 ? 120 PHE C CD2 1 ATOM 3866 C CE1 . PHE C 1 120 ? 31.895 32.371 5.380 1.00 75.78 ? 120 PHE C CE1 1 ATOM 3867 C CE2 . PHE C 1 120 ? 30.911 30.226 4.988 1.00 74.09 ? 120 PHE C CE2 1 ATOM 3868 C CZ . PHE C 1 120 ? 31.356 31.447 4.513 1.00 74.38 ? 120 PHE C CZ 1 ATOM 3869 N N . GLN C 1 121 ? 28.235 31.228 8.699 1.00 69.63 ? 121 GLN C N 1 ATOM 3870 C CA . GLN C 1 121 ? 26.868 30.776 8.365 1.00 70.30 ? 121 GLN C CA 1 ATOM 3871 C C . GLN C 1 121 ? 26.168 30.124 9.563 1.00 70.67 ? 121 GLN C C 1 ATOM 3872 O O . GLN C 1 121 ? 25.472 29.125 9.427 1.00 69.42 ? 121 GLN C O 1 ATOM 3873 C CB . GLN C 1 121 ? 26.827 29.841 7.140 1.00 69.67 ? 121 GLN C CB 1 ATOM 3874 C CG . GLN C 1 121 ? 27.524 30.361 5.877 1.00 68.89 ? 121 GLN C CG 1 ATOM 3875 C CD . GLN C 1 121 ? 26.929 31.641 5.288 1.00 70.37 ? 121 GLN C CD 1 ATOM 3876 O OE1 . GLN C 1 121 ? 26.702 32.645 5.983 1.00 70.33 ? 121 GLN C OE1 1 ATOM 3877 N NE2 . GLN C 1 121 ? 26.686 31.606 3.992 1.00 70.73 ? 121 GLN C NE2 1 ATOM 3878 N N . GLY C 1 122 ? 26.381 30.724 10.730 1.00 71.24 ? 122 GLY C N 1 ATOM 3879 C CA . GLY C 1 122 ? 25.815 30.254 11.993 1.00 72.02 ? 122 GLY C CA 1 ATOM 3880 C C . GLY C 1 122 ? 26.483 29.069 12.661 1.00 71.95 ? 122 GLY C C 1 ATOM 3881 O O . GLY C 1 122 ? 26.028 28.617 13.704 1.00 72.10 ? 122 GLY C O 1 ATOM 3882 N N . LYS C 1 123 ? 27.559 28.554 12.083 1.00 71.72 ? 123 LYS C N 1 ATOM 3883 C CA . LYS C 1 123 ? 28.191 27.372 12.656 1.00 71.74 ? 123 LYS C CA 1 ATOM 3884 C C . LYS C 1 123 ? 29.628 27.631 13.062 1.00 70.82 ? 123 LYS C C 1 ATOM 3885 O O . LYS C 1 123 ? 30.367 28.306 12.344 1.00 69.90 ? 123 LYS C O 1 ATOM 3886 C CB . LYS C 1 123 ? 28.142 26.214 11.675 1.00 71.23 ? 123 LYS C CB 1 ATOM 3887 C CG . LYS C 1 123 ? 28.171 24.867 12.359 1.00 75.72 ? 123 LYS C CG 1 ATOM 3888 C CD . LYS C 1 123 ? 28.119 23.710 11.352 1.00 78.05 ? 123 LYS C CD 1 ATOM 3889 C CE . LYS C 1 123 ? 28.283 22.363 12.027 1.00 79.10 ? 123 LYS C CE 1 ATOM 3890 N NZ . LYS C 1 123 ? 28.488 21.303 10.996 1.00 81.47 ? 123 LYS C NZ 1 ATOM 3891 N N . TYR C 1 124 ? 29.999 27.079 14.212 1.00 70.47 ? 124 TYR C N 1 ATOM 3892 C CA . TYR C 1 124 ? 31.335 27.197 14.797 1.00 70.22 ? 124 TYR C CA 1 ATOM 3893 C C . TYR C 1 124 ? 32.325 26.419 13.938 1.00 70.37 ? 124 TYR C C 1 ATOM 3894 O O . TYR C 1 124 ? 32.228 25.191 13.803 1.00 70.40 ? 124 TYR C O 1 ATOM 3895 C CB . TYR C 1 124 ? 31.287 26.696 16.253 1.00 71.12 ? 124 TYR C CB 1 ATOM 3896 C CG . TYR C 1 124 ? 32.594 26.583 17.038 1.00 70.37 ? 124 TYR C CG 1 ATOM 3897 C CD1 . TYR C 1 124 ? 33.539 27.585 17.007 1.00 67.67 ? 124 TYR C CD1 1 ATOM 3898 C CD2 . TYR C 1 124 ? 32.860 25.451 17.832 1.00 70.62 ? 124 TYR C CD2 1 ATOM 3899 C CE1 . TYR C 1 124 ? 34.700 27.490 17.705 1.00 67.09 ? 124 TYR C CE1 1 ATOM 3900 C CE2 . TYR C 1 124 ? 34.052 25.350 18.552 1.00 69.80 ? 124 TYR C CE2 1 ATOM 3901 C CZ . TYR C 1 124 ? 34.961 26.393 18.473 1.00 69.76 ? 124 TYR C CZ 1 ATOM 3902 O OH . TYR C 1 124 ? 36.147 26.354 19.161 1.00 71.69 ? 124 TYR C OH 1 ATOM 3903 N N . VAL C 1 125 ? 33.278 27.155 13.361 1.00 70.41 ? 125 VAL C N 1 ATOM 3904 C CA . VAL C 1 125 ? 34.264 26.621 12.420 1.00 69.88 ? 125 VAL C CA 1 ATOM 3905 C C . VAL C 1 125 ? 35.726 26.870 12.826 1.00 70.26 ? 125 VAL C C 1 ATOM 3906 O O . VAL C 1 125 ? 36.618 26.105 12.473 1.00 70.83 ? 125 VAL C O 1 ATOM 3907 C CB . VAL C 1 125 ? 34.021 27.208 11.006 1.00 70.26 ? 125 VAL C CB 1 ATOM 3908 C CG1 . VAL C 1 125 ? 32.692 26.716 10.412 1.00 68.37 ? 125 VAL C CG1 1 ATOM 3909 C CG2 . VAL C 1 125 ? 34.067 28.724 11.036 1.00 68.66 ? 125 VAL C CG2 1 ATOM 3910 N N . VAL C 1 126 ? 35.978 27.935 13.571 1.00 70.88 ? 126 VAL C N 1 ATOM 3911 C CA . VAL C 1 126 ? 37.351 28.362 13.860 1.00 70.83 ? 126 VAL C CA 1 ATOM 3912 C C . VAL C 1 126 ? 37.483 28.852 15.299 1.00 71.14 ? 126 VAL C C 1 ATOM 3913 O O . VAL C 1 126 ? 36.547 29.407 15.869 1.00 72.31 ? 126 VAL C O 1 ATOM 3914 C CB . VAL C 1 126 ? 37.855 29.461 12.788 1.00 71.15 ? 126 VAL C CB 1 ATOM 3915 C CG1 . VAL C 1 126 ? 39.070 30.259 13.252 1.00 70.29 ? 126 VAL C CG1 1 ATOM 3916 C CG2 . VAL C 1 126 ? 38.186 28.834 11.440 1.00 70.23 ? 126 VAL C CG2 1 ATOM 3917 N N . ARG C 1 127 ? 38.665 28.626 15.865 1.00 71.30 ? 127 ARG C N 1 ATOM 3918 C CA . ARG C 1 127 ? 39.084 29.087 17.189 1.00 70.93 ? 127 ARG C CA 1 ATOM 3919 C C . ARG C 1 127 ? 40.558 29.607 17.099 1.00 70.20 ? 127 ARG C C 1 ATOM 3920 O O . ARG C 1 127 ? 41.336 29.129 16.284 1.00 69.75 ? 127 ARG C O 1 ATOM 3921 C CB . ARG C 1 127 ? 39.032 27.893 18.159 1.00 70.77 ? 127 ARG C CB 1 ATOM 3922 C CG . ARG C 1 127 ? 40.360 27.181 18.267 1.00 72.14 ? 127 ARG C CG 1 ATOM 3923 C CD . ARG C 1 127 ? 40.352 25.691 18.667 1.00 71.71 ? 127 ARG C CD 1 ATOM 3924 N NE . ARG C 1 127 ? 40.026 25.433 20.055 1.00 73.71 ? 127 ARG C NE 1 ATOM 3925 C CZ . ARG C 1 127 ? 40.374 24.302 20.718 1.00 74.42 ? 127 ARG C CZ 1 ATOM 3926 N NH1 . ARG C 1 127 ? 41.068 23.345 20.122 1.00 73.41 ? 127 ARG C NH1 1 ATOM 3927 N NH2 . ARG C 1 127 ? 40.036 24.140 21.984 1.00 73.63 ? 127 ARG C NH2 1 ATOM 3928 N N . PHE C 1 128 ? 40.940 30.577 17.913 1.00 69.99 ? 128 PHE C N 1 ATOM 3929 C CA . PHE C 1 128 ? 42.354 30.818 18.127 1.00 70.30 ? 128 PHE C CA 1 ATOM 3930 C C . PHE C 1 128 ? 42.668 29.902 19.316 1.00 70.55 ? 128 PHE C C 1 ATOM 3931 O O . PHE C 1 128 ? 41.898 29.848 20.261 1.00 71.02 ? 128 PHE C O 1 ATOM 3932 C CB . PHE C 1 128 ? 42.619 32.267 18.486 1.00 70.38 ? 128 PHE C CB 1 ATOM 3933 C CG . PHE C 1 128 ? 44.075 32.631 18.503 1.00 71.14 ? 128 PHE C CG 1 ATOM 3934 C CD1 . PHE C 1 128 ? 44.698 33.097 17.357 1.00 72.51 ? 128 PHE C CD1 1 ATOM 3935 C CD2 . PHE C 1 128 ? 44.813 32.513 19.666 1.00 71.19 ? 128 PHE C CD2 1 ATOM 3936 C CE1 . PHE C 1 128 ? 46.050 33.438 17.369 1.00 72.94 ? 128 PHE C CE1 1 ATOM 3937 C CE2 . PHE C 1 128 ? 46.156 32.842 19.704 1.00 70.99 ? 128 PHE C CE2 1 ATOM 3938 C CZ . PHE C 1 128 ? 46.785 33.308 18.555 1.00 72.42 ? 128 PHE C CZ 1 ATOM 3939 N N . TRP C 1 129 ? 43.773 29.170 19.293 1.00 70.25 ? 129 TRP C N 1 ATOM 3940 C CA . TRP C 1 129 ? 44.047 28.257 20.386 1.00 69.84 ? 129 TRP C CA 1 ATOM 3941 C C . TRP C 1 129 ? 45.542 28.272 20.716 1.00 70.49 ? 129 TRP C C 1 ATOM 3942 O O . TRP C 1 129 ? 46.359 27.768 19.950 1.00 70.46 ? 129 TRP C O 1 ATOM 3943 C CB . TRP C 1 129 ? 43.525 26.835 20.043 1.00 70.29 ? 129 TRP C CB 1 ATOM 3944 C CG . TRP C 1 129 ? 43.785 25.780 21.098 1.00 68.29 ? 129 TRP C CG 1 ATOM 3945 C CD1 . TRP C 1 129 ? 44.600 24.695 20.986 1.00 67.91 ? 129 TRP C CD1 1 ATOM 3946 C CD2 . TRP C 1 129 ? 43.231 25.730 22.410 1.00 67.62 ? 129 TRP C CD2 1 ATOM 3947 N NE1 . TRP C 1 129 ? 44.586 23.970 22.151 1.00 68.38 ? 129 TRP C NE1 1 ATOM 3948 C CE2 . TRP C 1 129 ? 43.750 24.584 23.043 1.00 67.48 ? 129 TRP C CE2 1 ATOM 3949 C CE3 . TRP C 1 129 ? 42.336 26.541 23.124 1.00 69.42 ? 129 TRP C CE3 1 ATOM 3950 C CZ2 . TRP C 1 129 ? 43.411 24.228 24.343 1.00 68.70 ? 129 TRP C CZ2 1 ATOM 3951 C CZ3 . TRP C 1 129 ? 41.993 26.187 24.426 1.00 70.14 ? 129 TRP C CZ3 1 ATOM 3952 C CH2 . TRP C 1 129 ? 42.533 25.034 25.021 1.00 69.24 ? 129 TRP C CH2 1 ATOM 3953 N N . GLY C 1 130 ? 45.888 28.864 21.863 1.00 70.54 ? 130 GLY C N 1 ATOM 3954 C CA . GLY C 1 130 ? 47.281 28.961 22.292 1.00 70.50 ? 130 GLY C CA 1 ATOM 3955 C C . GLY C 1 130 ? 48.097 30.020 21.570 1.00 70.55 ? 130 GLY C C 1 ATOM 3956 O O . GLY C 1 130 ? 48.199 31.170 22.039 1.00 69.64 ? 130 GLY C O 1 ATOM 3957 N N . THR C 1 131 ? 48.674 29.620 20.432 1.00 70.75 ? 131 THR C N 1 ATOM 3958 C CA . THR C 1 131 ? 49.492 30.521 19.592 1.00 71.02 ? 131 THR C CA 1 ATOM 3959 C C . THR C 1 131 ? 49.090 30.620 18.101 1.00 70.70 ? 131 THR C C 1 ATOM 3960 O O . THR C 1 131 ? 49.754 31.336 17.341 1.00 70.35 ? 131 THR C O 1 ATOM 3961 C CB . THR C 1 131 ? 51.000 30.172 19.657 1.00 71.32 ? 131 THR C CB 1 ATOM 3962 O OG1 . THR C 1 131 ? 51.315 29.218 18.637 1.00 71.49 ? 131 THR C OG1 1 ATOM 3963 C CG2 . THR C 1 131 ? 51.404 29.518 21.012 1.00 71.57 ? 131 THR C CG2 1 ATOM 3964 N N . SER C 1 132 ? 48.030 29.917 17.683 1.00 70.28 ? 132 SER C N 1 ATOM 3965 C CA . SER C 1 132 ? 47.565 29.994 16.290 1.00 69.68 ? 132 SER C CA 1 ATOM 3966 C C . SER C 1 132 ? 46.079 29.742 16.116 1.00 69.27 ? 132 SER C C 1 ATOM 3967 O O . SER C 1 132 ? 45.434 29.219 17.022 1.00 69.69 ? 132 SER C O 1 ATOM 3968 C CB . SER C 1 132 ? 48.367 29.026 15.384 1.00 70.31 ? 132 SER C CB 1 ATOM 3969 O OG . SER C 1 132 ? 48.238 27.669 15.785 1.00 69.73 ? 132 SER C OG 1 ATOM 3970 N N . TRP C 1 133 ? 45.553 30.126 14.948 1.00 68.18 ? 133 TRP C N 1 ATOM 3971 C CA . TRP C 1 133 ? 44.220 29.768 14.518 1.00 67.34 ? 133 TRP C CA 1 ATOM 3972 C C . TRP C 1 133 ? 44.159 28.285 14.103 1.00 67.20 ? 133 TRP C C 1 ATOM 3973 O O . TRP C 1 133 ? 45.113 27.688 13.563 1.00 66.78 ? 133 TRP C O 1 ATOM 3974 C CB . TRP C 1 133 ? 43.786 30.614 13.312 1.00 67.49 ? 133 TRP C CB 1 ATOM 3975 C CG . TRP C 1 133 ? 43.938 32.114 13.502 1.00 68.32 ? 133 TRP C CG 1 ATOM 3976 C CD1 . TRP C 1 133 ? 44.992 32.873 13.122 1.00 68.67 ? 133 TRP C CD1 1 ATOM 3977 C CD2 . TRP C 1 133 ? 43.002 33.010 14.127 1.00 67.06 ? 133 TRP C CD2 1 ATOM 3978 N NE1 . TRP C 1 133 ? 44.782 34.192 13.462 1.00 71.47 ? 133 TRP C NE1 1 ATOM 3979 C CE2 . TRP C 1 133 ? 43.563 34.305 14.080 1.00 70.81 ? 133 TRP C CE2 1 ATOM 3980 C CE3 . TRP C 1 133 ? 41.742 32.852 14.714 1.00 70.67 ? 133 TRP C CE3 1 ATOM 3981 C CZ2 . TRP C 1 133 ? 42.911 35.432 14.604 1.00 68.88 ? 133 TRP C CZ2 1 ATOM 3982 C CZ3 . TRP C 1 133 ? 41.089 33.976 15.239 1.00 68.89 ? 133 TRP C CZ3 1 ATOM 3983 C CH2 . TRP C 1 133 ? 41.674 35.243 15.179 1.00 68.62 ? 133 TRP C CH2 1 ATOM 3984 N N . GLN C 1 134 ? 43.016 27.692 14.349 1.00 67.08 ? 134 GLN C N 1 ATOM 3985 C CA . GLN C 1 134 ? 42.788 26.326 13.906 1.00 68.89 ? 134 GLN C CA 1 ATOM 3986 C C . GLN C 1 134 ? 41.340 26.028 13.607 1.00 68.90 ? 134 GLN C C 1 ATOM 3987 O O . GLN C 1 134 ? 40.442 26.520 14.274 1.00 69.21 ? 134 GLN C O 1 ATOM 3988 C CB . GLN C 1 134 ? 43.362 25.312 14.893 1.00 68.84 ? 134 GLN C CB 1 ATOM 3989 C CG . GLN C 1 134 ? 43.076 25.564 16.329 1.00 69.24 ? 134 GLN C CG 1 ATOM 3990 C CD . GLN C 1 134 ? 43.534 24.390 17.233 1.00 69.45 ? 134 GLN C CD 1 ATOM 3991 O OE1 . GLN C 1 134 ? 42.714 23.823 17.957 1.00 72.81 ? 134 GLN C OE1 1 ATOM 3992 N NE2 . GLN C 1 134 ? 44.823 24.039 17.183 1.00 63.24 ? 134 GLN C NE2 1 ATOM 3993 N N . THR C 1 135 ? 41.121 25.219 12.584 1.00 69.60 ? 135 THR C N 1 ATOM 3994 C CA . THR C 1 135 ? 39.775 24.768 12.273 1.00 70.49 ? 135 THR C CA 1 ATOM 3995 C C . THR C 1 135 ? 39.292 23.788 13.324 1.00 70.65 ? 135 THR C C 1 ATOM 3996 O O . THR C 1 135 ? 40.080 23.129 13.995 1.00 70.98 ? 135 THR C O 1 ATOM 3997 C CB . THR C 1 135 ? 39.728 24.068 10.917 1.00 70.82 ? 135 THR C CB 1 ATOM 3998 O OG1 . THR C 1 135 ? 40.706 23.008 10.893 1.00 72.38 ? 135 THR C OG1 1 ATOM 3999 C CG2 . THR C 1 135 ? 40.121 25.022 9.813 1.00 70.00 ? 135 THR C CG2 1 ATOM 4000 N N . VAL C 1 136 ? 37.979 23.705 13.438 1.00 71.02 ? 136 VAL C N 1 ATOM 4001 C CA . VAL C 1 136 ? 37.303 22.814 14.358 1.00 71.56 ? 136 VAL C CA 1 ATOM 4002 C C . VAL C 1 136 ? 36.795 21.547 13.608 1.00 71.76 ? 136 VAL C C 1 ATOM 4003 O O . VAL C 1 136 ? 36.539 21.630 12.413 1.00 72.21 ? 136 VAL C O 1 ATOM 4004 C CB . VAL C 1 136 ? 36.186 23.620 15.053 1.00 70.91 ? 136 VAL C CB 1 ATOM 4005 C CG1 . VAL C 1 136 ? 34.939 22.819 15.261 1.00 73.11 ? 136 VAL C CG1 1 ATOM 4006 C CG2 . VAL C 1 136 ? 36.718 24.227 16.327 1.00 71.04 ? 136 VAL C CG2 1 ATOM 4007 N N . PRO C 1 137 ? 36.654 20.386 14.270 1.00 72.17 ? 137 PRO C N 1 ATOM 4008 C CA . PRO C 1 137 ? 36.189 19.167 13.576 1.00 72.47 ? 137 PRO C CA 1 ATOM 4009 C C . PRO C 1 137 ? 34.864 19.375 12.815 1.00 72.86 ? 137 PRO C C 1 ATOM 4010 O O . PRO C 1 137 ? 33.901 19.916 13.379 1.00 72.62 ? 137 PRO C O 1 ATOM 4011 C CB . PRO C 1 137 ? 35.977 18.189 14.728 1.00 72.13 ? 137 PRO C CB 1 ATOM 4012 C CG . PRO C 1 137 ? 36.937 18.611 15.731 1.00 71.74 ? 137 PRO C CG 1 ATOM 4013 C CD . PRO C 1 137 ? 36.915 20.105 15.696 1.00 72.04 ? 137 PRO C CD 1 ATOM 4014 N N . GLY C 1 138 ? 34.817 18.953 11.555 1.00 73.28 ? 138 GLY C N 1 ATOM 4015 C CA . GLY C 1 138 ? 33.611 19.148 10.759 1.00 73.86 ? 138 GLY C CA 1 ATOM 4016 C C . GLY C 1 138 ? 33.516 20.513 10.084 1.00 74.00 ? 138 GLY C C 1 ATOM 4017 O O . GLY C 1 138 ? 32.600 20.757 9.300 1.00 74.52 ? 138 GLY C O 1 ATOM 4018 N N . ALA C 1 139 ? 34.446 21.412 10.382 1.00 73.82 ? 139 ALA C N 1 ATOM 4019 C CA . ALA C 1 139 ? 34.539 22.665 9.624 1.00 73.68 ? 139 ALA C CA 1 ATOM 4020 C C . ALA C 1 139 ? 34.796 22.309 8.142 1.00 74.21 ? 139 ALA C C 1 ATOM 4021 O O . ALA C 1 139 ? 35.484 21.304 7.846 1.00 73.61 ? 139 ALA C O 1 ATOM 4022 C CB . ALA C 1 139 ? 35.657 23.548 10.166 1.00 73.22 ? 139 ALA C CB 1 ATOM 4023 N N . PRO C 1 140 ? 34.255 23.116 7.218 1.00 74.48 ? 140 PRO C N 1 ATOM 4024 C CA . PRO C 1 140 ? 34.465 22.895 5.785 1.00 74.27 ? 140 PRO C CA 1 ATOM 4025 C C . PRO C 1 140 ? 35.959 22.898 5.462 1.00 74.20 ? 140 PRO C C 1 ATOM 4026 O O . PRO C 1 140 ? 36.699 23.759 5.932 1.00 73.77 ? 140 PRO C O 1 ATOM 4027 C CB . PRO C 1 140 ? 33.794 24.111 5.150 1.00 74.50 ? 140 PRO C CB 1 ATOM 4028 C CG . PRO C 1 140 ? 32.798 24.571 6.140 1.00 74.42 ? 140 PRO C CG 1 ATOM 4029 C CD . PRO C 1 140 ? 33.417 24.303 7.470 1.00 74.53 ? 140 PRO C CD 1 ATOM 4030 N N . SER C 1 141 ? 36.396 21.934 4.663 1.00 74.66 ? 141 SER C N 1 ATOM 4031 C CA . SER C 1 141 ? 37.814 21.806 4.335 1.00 75.17 ? 141 SER C CA 1 ATOM 4032 C C . SER C 1 141 ? 38.393 22.956 3.502 1.00 75.14 ? 141 SER C C 1 ATOM 4033 O O . SER C 1 141 ? 39.604 23.122 3.438 1.00 75.60 ? 141 SER C O 1 ATOM 4034 C CB . SER C 1 141 ? 38.119 20.434 3.730 1.00 75.38 ? 141 SER C CB 1 ATOM 4035 O OG . SER C 1 141 ? 36.975 19.906 3.082 1.00 76.36 ? 141 SER C OG 1 ATOM 4036 N N . TRP C 1 142 ? 37.533 23.750 2.876 1.00 75.06 ? 142 TRP C N 1 ATOM 4037 C CA . TRP C 1 142 ? 37.990 24.892 2.113 1.00 75.08 ? 142 TRP C CA 1 ATOM 4038 C C . TRP C 1 142 ? 38.540 25.988 3.037 1.00 75.00 ? 142 TRP C C 1 ATOM 4039 O O . TRP C 1 142 ? 39.121 26.965 2.565 1.00 75.27 ? 142 TRP C O 1 ATOM 4040 C CB . TRP C 1 142 ? 36.858 25.444 1.240 1.00 75.42 ? 142 TRP C CB 1 ATOM 4041 C CG . TRP C 1 142 ? 35.800 26.172 2.000 1.00 75.44 ? 142 TRP C CG 1 ATOM 4042 C CD1 . TRP C 1 142 ? 34.649 25.648 2.499 1.00 76.03 ? 142 TRP C CD1 1 ATOM 4043 C CD2 . TRP C 1 142 ? 35.791 27.563 2.355 1.00 75.90 ? 142 TRP C CD2 1 ATOM 4044 N NE1 . TRP C 1 142 ? 33.920 26.619 3.145 1.00 76.54 ? 142 TRP C NE1 1 ATOM 4045 C CE2 . TRP C 1 142 ? 34.596 27.805 3.072 1.00 75.19 ? 142 TRP C CE2 1 ATOM 4046 C CE3 . TRP C 1 142 ? 36.675 28.637 2.139 1.00 76.41 ? 142 TRP C CE3 1 ATOM 4047 C CZ2 . TRP C 1 142 ? 34.259 29.061 3.569 1.00 76.22 ? 142 TRP C CZ2 1 ATOM 4048 C CZ3 . TRP C 1 142 ? 36.344 29.888 2.635 1.00 76.33 ? 142 TRP C CZ3 1 ATOM 4049 C CH2 . TRP C 1 142 ? 35.144 30.092 3.343 1.00 76.55 ? 142 TRP C CH2 1 ATOM 4050 N N . LEU C 1 143 ? 38.345 25.822 4.346 1.00 74.69 ? 143 LEU C N 1 ATOM 4051 C CA . LEU C 1 143 ? 38.811 26.782 5.350 1.00 74.04 ? 143 LEU C CA 1 ATOM 4052 C C . LEU C 1 143 ? 40.269 26.606 5.726 1.00 73.87 ? 143 LEU C C 1 ATOM 4053 O O . LEU C 1 143 ? 40.899 27.552 6.219 1.00 73.90 ? 143 LEU C O 1 ATOM 4054 C CB . LEU C 1 143 ? 37.937 26.743 6.602 1.00 74.13 ? 143 LEU C CB 1 ATOM 4055 C CG . LEU C 1 143 ? 36.754 27.717 6.641 1.00 73.61 ? 143 LEU C CG 1 ATOM 4056 C CD1 . LEU C 1 143 ? 35.755 27.310 7.689 1.00 72.73 ? 143 LEU C CD1 1 ATOM 4057 C CD2 . LEU C 1 143 ? 37.194 29.172 6.857 1.00 75.06 ? 143 LEU C CD2 1 ATOM 4058 N N . ASP C 1 144 ? 40.795 25.404 5.486 1.00 73.61 ? 144 ASP C N 1 ATOM 4059 C CA . ASP C 1 144 ? 42.190 25.067 5.798 1.00 73.74 ? 144 ASP C CA 1 ATOM 4060 C C . ASP C 1 144 ? 43.243 26.005 5.183 1.00 72.74 ? 144 ASP C C 1 ATOM 4061 O O . ASP C 1 144 ? 44.173 26.404 5.866 1.00 72.83 ? 144 ASP C O 1 ATOM 4062 C CB . ASP C 1 144 ? 42.513 23.628 5.396 1.00 74.05 ? 144 ASP C CB 1 ATOM 4063 C CG . ASP C 1 144 ? 41.667 22.596 6.132 1.00 77.00 ? 144 ASP C CG 1 ATOM 4064 O OD1 . ASP C 1 144 ? 41.134 22.887 7.224 1.00 80.76 ? 144 ASP C OD1 1 ATOM 4065 O OD2 . ASP C 1 144 ? 41.477 21.440 5.685 1.00 81.13 ? 144 ASP C OD2 1 ATOM 4066 N N . LEU C 1 145 ? 43.096 26.342 3.904 1.00 71.65 ? 145 LEU C N 1 ATOM 4067 C CA . LEU C 1 145 ? 44.044 27.231 3.237 1.00 71.20 ? 145 LEU C CA 1 ATOM 4068 C C . LEU C 1 145 ? 43.969 28.685 3.766 1.00 70.98 ? 145 LEU C C 1 ATOM 4069 O O . LEU C 1 145 ? 45.009 29.237 4.114 1.00 70.30 ? 145 LEU C O 1 ATOM 4070 C CB . LEU C 1 145 ? 43.907 27.179 1.726 1.00 70.89 ? 145 LEU C CB 1 ATOM 4071 C CG . LEU C 1 145 ? 44.998 27.898 0.952 1.00 71.98 ? 145 LEU C CG 1 ATOM 4072 C CD1 . LEU C 1 145 ? 46.382 27.320 1.256 1.00 72.49 ? 145 LEU C CD1 1 ATOM 4073 C CD2 . LEU C 1 145 ? 44.691 27.798 -0.509 1.00 72.47 ? 145 LEU C CD2 1 ATOM 4074 N N . PRO C 1 146 ? 42.770 29.295 3.817 1.00 70.55 ? 146 PRO C N 1 ATOM 4075 C CA . PRO C 1 146 ? 42.590 30.544 4.527 1.00 70.21 ? 146 PRO C CA 1 ATOM 4076 C C . PRO C 1 146 ? 43.266 30.551 5.895 1.00 70.35 ? 146 PRO C C 1 ATOM 4077 O O . PRO C 1 146 ? 43.980 31.505 6.197 1.00 69.09 ? 146 PRO C O 1 ATOM 4078 C CB . PRO C 1 146 ? 41.072 30.647 4.696 1.00 70.87 ? 146 PRO C CB 1 ATOM 4079 C CG . PRO C 1 146 ? 40.463 29.784 3.670 1.00 70.85 ? 146 PRO C CG 1 ATOM 4080 C CD . PRO C 1 146 ? 41.515 28.855 3.180 1.00 70.70 ? 146 PRO C CD 1 ATOM 4081 N N . ILE C 1 147 ? 43.065 29.509 6.721 1.00 70.81 ? 147 ILE C N 1 ATOM 4082 C CA . ILE C 1 147 ? 43.670 29.560 8.053 1.00 71.16 ? 147 ILE C CA 1 ATOM 4083 C C . ILE C 1 147 ? 45.206 29.326 8.085 1.00 71.64 ? 147 ILE C C 1 ATOM 4084 O O . ILE C 1 147 ? 45.853 29.729 9.049 1.00 71.20 ? 147 ILE C O 1 ATOM 4085 C CB . ILE C 1 147 ? 42.814 28.852 9.200 1.00 71.85 ? 147 ILE C CB 1 ATOM 4086 C CG1 . ILE C 1 147 ? 42.985 27.349 9.244 1.00 73.20 ? 147 ILE C CG1 1 ATOM 4087 C CG2 . ILE C 1 147 ? 41.307 29.267 9.181 1.00 69.33 ? 147 ILE C CG2 1 ATOM 4088 C CD1 . ILE C 1 147 ? 44.011 26.938 10.255 1.00 78.65 ? 147 ILE C CD1 1 ATOM 4089 N N . LYS C 1 148 ? 45.767 28.694 7.036 1.00 71.43 ? 148 LYS C N 1 ATOM 4090 C CA . LYS C 1 148 ? 47.219 28.611 6.845 1.00 72.12 ? 148 LYS C CA 1 ATOM 4091 C C . LYS C 1 148 ? 47.757 30.011 6.504 1.00 72.16 ? 148 LYS C C 1 ATOM 4092 O O . LYS C 1 148 ? 48.820 30.415 6.950 1.00 72.54 ? 148 LYS C O 1 ATOM 4093 C CB . LYS C 1 148 ? 47.564 27.690 5.669 1.00 72.92 ? 148 LYS C CB 1 ATOM 4094 C CG . LYS C 1 148 ? 49.054 27.368 5.509 1.00 75.46 ? 148 LYS C CG 1 ATOM 4095 C CD . LYS C 1 148 ? 49.522 27.292 4.021 1.00 78.46 ? 148 LYS C CD 1 ATOM 4096 C CE . LYS C 1 148 ? 49.887 28.699 3.479 1.00 79.70 ? 148 LYS C CE 1 ATOM 4097 N NZ . LYS C 1 148 ? 50.275 28.787 2.031 1.00 78.25 ? 148 LYS C NZ 1 ATOM 4098 N N . VAL C 1 149 ? 47.013 30.747 5.703 1.00 71.79 ? 149 VAL C N 1 ATOM 4099 C CA . VAL C 1 149 ? 47.431 32.062 5.277 1.00 72.31 ? 149 VAL C CA 1 ATOM 4100 C C . VAL C 1 149 ? 47.460 33.038 6.430 1.00 72.23 ? 149 VAL C C 1 ATOM 4101 O O . VAL C 1 149 ? 48.357 33.867 6.530 1.00 72.87 ? 149 VAL C O 1 ATOM 4102 C CB . VAL C 1 149 ? 46.498 32.591 4.162 1.00 72.76 ? 149 VAL C CB 1 ATOM 4103 C CG1 . VAL C 1 149 ? 46.814 34.039 3.807 1.00 72.03 ? 149 VAL C CG1 1 ATOM 4104 C CG2 . VAL C 1 149 ? 46.603 31.715 2.911 1.00 72.91 ? 149 VAL C CG2 1 ATOM 4105 N N . LEU C 1 150 ? 46.464 32.921 7.293 1.00 72.64 ? 150 LEU C N 1 ATOM 4106 C CA . LEU C 1 150 ? 46.264 33.765 8.456 1.00 72.69 ? 150 LEU C CA 1 ATOM 4107 C C . LEU C 1 150 ? 47.325 33.492 9.541 1.00 72.59 ? 150 LEU C C 1 ATOM 4108 O O . LEU C 1 150 ? 47.800 34.415 10.210 1.00 72.72 ? 150 LEU C O 1 ATOM 4109 C CB . LEU C 1 150 ? 44.853 33.482 8.944 1.00 72.71 ? 150 LEU C CB 1 ATOM 4110 C CG . LEU C 1 150 ? 43.823 34.449 9.515 1.00 73.91 ? 150 LEU C CG 1 ATOM 4111 C CD1 . LEU C 1 150 ? 43.782 35.879 8.875 1.00 71.26 ? 150 LEU C CD1 1 ATOM 4112 C CD2 . LEU C 1 150 ? 42.474 33.775 9.374 1.00 73.22 ? 150 LEU C CD2 1 ATOM 4113 N N . ASN C 1 151 ? 47.695 32.225 9.695 1.00 72.36 ? 151 ASN C N 1 ATOM 4114 C CA . ASN C 1 151 ? 48.764 31.794 10.598 1.00 72.36 ? 151 ASN C CA 1 ATOM 4115 C C . ASN C 1 151 ? 50.171 32.140 10.123 1.00 72.44 ? 151 ASN C C 1 ATOM 4116 O O . ASN C 1 151 ? 51.143 31.955 10.869 1.00 72.45 ? 151 ASN C O 1 ATOM 4117 C CB . ASN C 1 151 ? 48.710 30.289 10.809 1.00 72.01 ? 151 ASN C CB 1 ATOM 4118 C CG . ASN C 1 151 ? 47.590 29.880 11.733 1.00 73.68 ? 151 ASN C CG 1 ATOM 4119 O OD1 . ASN C 1 151 ? 47.135 30.680 12.551 1.00 73.11 ? 151 ASN C OD1 1 ATOM 4120 N ND2 . ASN C 1 151 ? 47.142 28.620 11.619 1.00 73.61 ? 151 ASN C ND2 1 ATOM 4121 N N . ALA C 1 152 ? 50.284 32.630 8.895 1.00 71.74 ? 152 ALA C N 1 ATOM 4122 C CA . ALA C 1 152 ? 51.565 33.065 8.383 1.00 72.03 ? 152 ALA C CA 1 ATOM 4123 C C . ALA C 1 152 ? 51.870 34.430 8.979 1.00 71.94 ? 152 ALA C C 1 ATOM 4124 O O . ALA C 1 152 ? 53.007 34.830 9.021 1.00 72.43 ? 152 ALA C O 1 ATOM 4125 C CB . ALA C 1 152 ? 51.548 33.125 6.879 1.00 71.83 ? 152 ALA C CB 1 ATOM 4126 N N . ASP C 1 153 ? 50.840 35.133 9.443 1.00 72.50 ? 153 ASP C N 1 ATOM 4127 C CA . ASP C 1 153 ? 50.971 36.464 10.045 1.00 72.08 ? 153 ASP C CA 1 ATOM 4128 C C . ASP C 1 153 ? 51.389 36.412 11.531 1.00 71.96 ? 153 ASP C C 1 ATOM 4129 O O . ASP C 1 153 ? 50.570 36.266 12.434 1.00 71.79 ? 153 ASP C O 1 ATOM 4130 C CB . ASP C 1 153 ? 49.681 37.260 9.864 1.00 72.03 ? 153 ASP C CB 1 ATOM 4131 C CG . ASP C 1 153 ? 49.828 38.719 10.282 1.00 73.75 ? 153 ASP C CG 1 ATOM 4132 O OD1 . ASP C 1 153 ? 50.897 39.104 10.760 1.00 74.99 ? 153 ASP C OD1 1 ATOM 4133 O OD2 . ASP C 1 153 ? 48.927 39.569 10.171 1.00 77.25 ? 153 ASP C OD2 1 ATOM 4134 N N . GLN C 1 154 ? 52.692 36.544 11.752 1.00 71.99 ? 154 GLN C N 1 ATOM 4135 C CA . GLN C 1 154 ? 53.311 36.450 13.066 1.00 71.60 ? 154 GLN C CA 1 ATOM 4136 C C . GLN C 1 154 ? 52.984 37.626 13.994 1.00 70.77 ? 154 GLN C C 1 ATOM 4137 O O . GLN C 1 154 ? 52.873 37.431 15.188 1.00 70.38 ? 154 GLN C O 1 ATOM 4138 C CB . GLN C 1 154 ? 54.826 36.290 12.895 1.00 71.85 ? 154 GLN C CB 1 ATOM 4139 C CG . GLN C 1 154 ? 55.544 35.751 14.124 1.00 73.17 ? 154 GLN C CG 1 ATOM 4140 C CD . GLN C 1 154 ? 57.060 35.973 14.105 1.00 73.21 ? 154 GLN C CD 1 ATOM 4141 O OE1 . GLN C 1 154 ? 57.649 36.363 13.074 1.00 73.74 ? 154 GLN C OE1 1 ATOM 4142 N NE2 . GLN C 1 154 ? 57.698 35.721 15.256 1.00 73.63 ? 154 GLN C NE2 1 ATOM 4143 N N . GLY C 1 155 ? 52.832 38.838 13.455 1.00 70.25 ? 155 GLY C N 1 ATOM 4144 C CA . GLY C 1 155 ? 52.489 40.007 14.271 1.00 69.66 ? 155 GLY C CA 1 ATOM 4145 C C . GLY C 1 155 ? 51.081 39.974 14.854 1.00 69.91 ? 155 GLY C C 1 ATOM 4146 O O . GLY C 1 155 ? 50.833 40.379 15.999 1.00 70.17 ? 155 GLY C O 1 ATOM 4147 N N . THR C 1 156 ? 50.145 39.496 14.057 1.00 69.56 ? 156 THR C N 1 ATOM 4148 C CA . THR C 1 156 ? 48.783 39.315 14.508 1.00 69.82 ? 156 THR C CA 1 ATOM 4149 C C . THR C 1 156 ? 48.690 38.215 15.565 1.00 69.40 ? 156 THR C C 1 ATOM 4150 O O . THR C 1 156 ? 47.901 38.329 16.483 1.00 70.20 ? 156 THR C O 1 ATOM 4151 C CB . THR C 1 156 ? 47.863 39.013 13.298 1.00 69.61 ? 156 THR C CB 1 ATOM 4152 O OG1 . THR C 1 156 ? 47.656 40.227 12.563 1.00 71.55 ? 156 THR C OG1 1 ATOM 4153 C CG2 . THR C 1 156 ? 46.457 38.630 13.729 1.00 70.39 ? 156 THR C CG2 1 ATOM 4154 N N . SER C 1 157 ? 49.484 37.156 15.441 1.00 69.29 ? 157 SER C N 1 ATOM 4155 C CA . SER C 1 157 ? 49.399 36.048 16.381 1.00 68.86 ? 157 SER C CA 1 ATOM 4156 C C . SER C 1 157 ? 49.821 36.539 17.774 1.00 68.75 ? 157 SER C C 1 ATOM 4157 O O . SER C 1 157 ? 49.191 36.222 18.777 1.00 68.42 ? 157 SER C O 1 ATOM 4158 C CB . SER C 1 157 ? 50.248 34.854 15.913 1.00 69.05 ? 157 SER C CB 1 ATOM 4159 O OG . SER C 1 157 ? 50.298 33.831 16.910 1.00 68.94 ? 157 SER C OG 1 ATOM 4160 N N . ALA C 1 158 ? 50.887 37.331 17.808 1.00 68.53 ? 158 ALA C N 1 ATOM 4161 C CA . ALA C 1 158 ? 51.435 37.867 19.044 1.00 68.18 ? 158 ALA C CA 1 ATOM 4162 C C . ALA C 1 158 ? 50.473 38.840 19.661 1.00 68.08 ? 158 ALA C C 1 ATOM 4163 O O . ALA C 1 158 ? 50.334 38.890 20.875 1.00 67.76 ? 158 ALA C O 1 ATOM 4164 C CB . ALA C 1 158 ? 52.762 38.543 18.785 1.00 68.31 ? 158 ALA C CB 1 ATOM 4165 N N . THR C 1 159 ? 49.796 39.607 18.816 1.00 68.31 ? 159 THR C N 1 ATOM 4166 C CA . THR C 1 159 ? 48.844 40.572 19.294 1.00 67.96 ? 159 THR C CA 1 ATOM 4167 C C . THR C 1 159 ? 47.649 39.876 19.905 1.00 67.99 ? 159 THR C C 1 ATOM 4168 O O . THR C 1 159 ? 47.208 40.271 20.954 1.00 68.10 ? 159 THR C O 1 ATOM 4169 C CB . THR C 1 159 ? 48.430 41.505 18.176 1.00 68.32 ? 159 THR C CB 1 ATOM 4170 O OG1 . THR C 1 159 ? 49.588 42.160 17.682 1.00 67.18 ? 159 THR C OG1 1 ATOM 4171 C CG2 . THR C 1 159 ? 47.583 42.663 18.724 1.00 68.40 ? 159 THR C CG2 1 ATOM 4172 N N . VAL C 1 160 ? 47.136 38.842 19.249 1.00 68.06 ? 160 VAL C N 1 ATOM 4173 C CA . VAL C 1 160 ? 46.004 38.087 19.766 1.00 67.57 ? 160 VAL C CA 1 ATOM 4174 C C . VAL C 1 160 ? 46.376 37.387 21.108 1.00 68.12 ? 160 VAL C C 1 ATOM 4175 O O . VAL C 1 160 ? 45.602 37.459 22.076 1.00 67.87 ? 160 VAL C O 1 ATOM 4176 C CB . VAL C 1 160 ? 45.454 37.100 18.690 1.00 68.14 ? 160 VAL C CB 1 ATOM 4177 C CG1 . VAL C 1 160 ? 44.441 36.123 19.265 1.00 66.07 ? 160 VAL C CG1 1 ATOM 4178 C CG2 . VAL C 1 160 ? 44.817 37.871 17.561 1.00 68.34 ? 160 VAL C CG2 1 ATOM 4179 N N . GLN C 1 161 ? 47.544 36.722 21.167 1.00 67.37 ? 161 GLN C N 1 ATOM 4180 C CA . GLN C 1 161 ? 48.011 36.109 22.419 1.00 66.77 ? 161 GLN C CA 1 ATOM 4181 C C . GLN C 1 161 ? 48.130 37.136 23.551 1.00 68.04 ? 161 GLN C C 1 ATOM 4182 O O . GLN C 1 161 ? 47.902 36.810 24.699 1.00 68.63 ? 161 GLN C O 1 ATOM 4183 C CB . GLN C 1 161 ? 49.343 35.424 22.246 1.00 66.10 ? 161 GLN C CB 1 ATOM 4184 C CG . GLN C 1 161 ? 49.392 34.293 21.277 1.00 64.50 ? 161 GLN C CG 1 ATOM 4185 C CD . GLN C 1 161 ? 50.828 33.897 20.968 1.00 62.65 ? 161 GLN C CD 1 ATOM 4186 O OE1 . GLN C 1 161 ? 51.564 33.493 21.852 1.00 61.52 ? 161 GLN C OE1 1 ATOM 4187 N NE2 . GLN C 1 161 ? 51.222 34.013 19.713 1.00 63.40 ? 161 GLN C NE2 1 ATOM 4188 N N . MET C 1 162 ? 48.487 38.378 23.224 1.00 68.91 ? 162 MET C N 1 ATOM 4189 C CA . MET C 1 162 ? 48.548 39.444 24.193 1.00 69.71 ? 162 MET C CA 1 ATOM 4190 C C . MET C 1 162 ? 47.151 39.790 24.660 1.00 69.48 ? 162 MET C C 1 ATOM 4191 O O . MET C 1 162 ? 46.909 39.898 25.841 1.00 69.46 ? 162 MET C O 1 ATOM 4192 C CB . MET C 1 162 ? 49.178 40.681 23.575 1.00 69.32 ? 162 MET C CB 1 ATOM 4193 C CG . MET C 1 162 ? 49.519 41.782 24.579 1.00 69.21 ? 162 MET C CG 1 ATOM 4194 S SD . MET C 1 162 ? 50.000 43.292 23.714 1.00 74.08 ? 162 MET C SD 1 ATOM 4195 C CE . MET C 1 162 ? 48.486 43.753 22.837 1.00 71.48 ? 162 MET C CE 1 ATOM 4196 N N . LEU C 1 163 ? 46.233 39.963 23.724 1.00 69.70 ? 163 LEU C N 1 ATOM 4197 C CA . LEU C 1 163 ? 44.876 40.316 24.069 1.00 70.63 ? 163 LEU C CA 1 ATOM 4198 C C . LEU C 1 163 ? 44.152 39.288 24.945 1.00 70.90 ? 163 LEU C C 1 ATOM 4199 O O . LEU C 1 163 ? 43.396 39.668 25.839 1.00 71.62 ? 163 LEU C O 1 ATOM 4200 C CB . LEU C 1 163 ? 44.053 40.632 22.812 1.00 70.89 ? 163 LEU C CB 1 ATOM 4201 C CG . LEU C 1 163 ? 44.459 41.882 22.026 1.00 71.58 ? 163 LEU C CG 1 ATOM 4202 C CD1 . LEU C 1 163 ? 43.456 42.068 20.909 1.00 72.39 ? 163 LEU C CD1 1 ATOM 4203 C CD2 . LEU C 1 163 ? 44.512 43.129 22.921 1.00 69.77 ? 163 LEU C CD2 1 ATOM 4204 N N . LEU C 1 164 ? 44.391 38.006 24.688 1.00 70.78 ? 164 LEU C N 1 ATOM 4205 C CA . LEU C 1 164 ? 43.726 36.911 25.386 1.00 70.66 ? 164 LEU C CA 1 ATOM 4206 C C . LEU C 1 164 ? 44.368 36.584 26.702 1.00 71.14 ? 164 LEU C C 1 ATOM 4207 O O . LEU C 1 164 ? 43.683 36.523 27.728 1.00 71.28 ? 164 LEU C O 1 ATOM 4208 C CB . LEU C 1 164 ? 43.709 35.663 24.499 1.00 70.66 ? 164 LEU C CB 1 ATOM 4209 C CG . LEU C 1 164 ? 42.519 35.488 23.558 1.00 71.40 ? 164 LEU C CG 1 ATOM 4210 C CD1 . LEU C 1 164 ? 41.820 36.804 23.148 1.00 73.48 ? 164 LEU C CD1 1 ATOM 4211 C CD2 . LEU C 1 164 ? 42.847 34.586 22.362 1.00 70.86 ? 164 LEU C CD2 1 ATOM 4212 N N . ASN C 1 165 ? 45.686 36.376 26.674 1.00 71.21 ? 165 ASN C N 1 ATOM 4213 C CA . ASN C 1 165 ? 46.435 36.051 27.891 1.00 71.49 ? 165 ASN C CA 1 ATOM 4214 C C . ASN C 1 165 ? 46.580 37.187 28.906 1.00 72.08 ? 165 ASN C C 1 ATOM 4215 O O . ASN C 1 165 ? 46.656 36.927 30.087 1.00 72.84 ? 165 ASN C O 1 ATOM 4216 C CB . ASN C 1 165 ? 47.828 35.522 27.567 1.00 70.72 ? 165 ASN C CB 1 ATOM 4217 C CG . ASN C 1 165 ? 47.822 34.302 26.644 1.00 70.65 ? 165 ASN C CG 1 ATOM 4218 O OD1 . ASN C 1 165 ? 46.785 33.879 26.111 1.00 72.17 ? 165 ASN C OD1 1 ATOM 4219 N ND2 . ASN C 1 165 ? 49.011 33.736 26.455 1.00 69.67 ? 165 ASN C ND2 1 ATOM 4220 N N . ASP C 1 166 ? 46.618 38.438 28.465 1.00 73.01 ? 166 ASP C N 1 ATOM 4221 C CA . ASP C 1 166 ? 46.960 39.547 29.373 1.00 74.10 ? 166 ASP C CA 1 ATOM 4222 C C . ASP C 1 166 ? 46.018 40.724 29.405 1.00 74.65 ? 166 ASP C C 1 ATOM 4223 O O . ASP C 1 166 ? 45.547 41.113 30.463 1.00 74.76 ? 166 ASP C O 1 ATOM 4224 C CB . ASP C 1 166 ? 48.350 40.090 29.045 1.00 74.22 ? 166 ASP C CB 1 ATOM 4225 C CG . ASP C 1 166 ? 49.370 39.002 28.908 1.00 75.72 ? 166 ASP C CG 1 ATOM 4226 O OD1 . ASP C 1 166 ? 49.581 38.252 29.884 1.00 78.53 ? 166 ASP C OD1 1 ATOM 4227 O OD2 . ASP C 1 166 ? 50.012 38.812 27.856 1.00 78.80 ? 166 ASP C OD2 1 ATOM 4228 N N . THR C 1 167 ? 45.759 41.294 28.240 1.00 75.83 ? 167 THR C N 1 ATOM 4229 C CA . THR C 1 167 ? 44.893 42.451 28.121 1.00 76.84 ? 167 THR C CA 1 ATOM 4230 C C . THR C 1 167 ? 43.494 42.184 28.661 1.00 77.28 ? 167 THR C C 1 ATOM 4231 O O . THR C 1 167 ? 43.010 42.954 29.486 1.00 77.46 ? 167 THR C O 1 ATOM 4232 C CB . THR C 1 167 ? 44.801 42.905 26.659 1.00 76.71 ? 167 THR C CB 1 ATOM 4233 O OG1 . THR C 1 167 ? 46.108 42.913 26.065 1.00 76.56 ? 167 THR C OG1 1 ATOM 4234 C CG2 . THR C 1 167 ? 44.290 44.354 26.584 1.00 76.42 ? 167 THR C CG2 1 ATOM 4235 N N . CYS C 1 168 ? 42.864 41.103 28.196 1.00 78.68 ? 168 CYS C N 1 ATOM 4236 C CA . CYS C 1 168 ? 41.487 40.740 28.614 1.00 78.96 ? 168 CYS C CA 1 ATOM 4237 C C . CYS C 1 168 ? 41.369 40.605 30.133 1.00 78.31 ? 168 CYS C C 1 ATOM 4238 O O . CYS C 1 168 ? 40.603 41.357 30.722 1.00 78.77 ? 168 CYS C O 1 ATOM 4239 C CB . CYS C 1 168 ? 40.925 39.482 27.903 1.00 79.10 ? 168 CYS C CB 1 ATOM 4240 S SG . CYS C 1 168 ? 39.168 39.094 28.274 1.00 81.28 ? 168 CYS C SG 1 ATOM 4241 N N . PRO C 1 169 ? 42.105 39.685 30.775 1.00 77.58 ? 169 PRO C N 1 ATOM 4242 C CA . PRO C 1 169 ? 41.968 39.519 32.236 1.00 76.56 ? 169 PRO C CA 1 ATOM 4243 C C . PRO C 1 169 ? 42.194 40.798 33.033 1.00 76.00 ? 169 PRO C C 1 ATOM 4244 O O . PRO C 1 169 ? 41.375 41.097 33.908 1.00 76.64 ? 169 PRO C O 1 ATOM 4245 C CB . PRO C 1 169 ? 42.984 38.426 32.600 1.00 76.41 ? 169 PRO C CB 1 ATOM 4246 C CG . PRO C 1 169 ? 43.358 37.748 31.304 1.00 77.03 ? 169 PRO C CG 1 ATOM 4247 C CD . PRO C 1 169 ? 43.098 38.753 30.199 1.00 77.58 ? 169 PRO C CD 1 ATOM 4248 N N . LEU C 1 170 ? 43.265 41.546 32.743 1.00 74.98 ? 170 LEU C N 1 ATOM 4249 C CA . LEU C 1 170 ? 43.558 42.798 33.455 1.00 73.97 ? 170 LEU C CA 1 ATOM 4250 C C . LEU C 1 170 ? 42.432 43.794 33.307 1.00 73.12 ? 170 LEU C C 1 ATOM 4251 O O . LEU C 1 170 ? 41.988 44.348 34.303 1.00 73.15 ? 170 LEU C O 1 ATOM 4252 C CB . LEU C 1 170 ? 44.914 43.430 33.046 1.00 74.70 ? 170 LEU C CB 1 ATOM 4253 C CG . LEU C 1 170 ? 45.188 44.877 33.547 1.00 75.31 ? 170 LEU C CG 1 ATOM 4254 C CD1 . LEU C 1 170 ? 46.645 45.118 33.963 1.00 76.99 ? 170 LEU C CD1 1 ATOM 4255 C CD2 . LEU C 1 170 ? 44.712 45.968 32.561 1.00 75.21 ? 170 LEU C CD2 1 ATOM 4256 N N . PHE C 1 171 ? 41.972 44.021 32.077 1.00 72.23 ? 171 PHE C N 1 ATOM 4257 C CA . PHE C 1 171 ? 40.819 44.906 31.843 1.00 71.64 ? 171 PHE C CA 1 ATOM 4258 C C . PHE C 1 171 ? 39.607 44.445 32.653 1.00 71.39 ? 171 PHE C C 1 ATOM 4259 O O . PHE C 1 171 ? 38.925 45.236 33.309 1.00 71.86 ? 171 PHE C O 1 ATOM 4260 C CB . PHE C 1 171 ? 40.458 45.010 30.346 1.00 71.31 ? 171 PHE C CB 1 ATOM 4261 C CG . PHE C 1 171 ? 39.329 45.991 30.042 1.00 70.84 ? 171 PHE C CG 1 ATOM 4262 C CD1 . PHE C 1 171 ? 39.478 47.357 30.274 1.00 71.46 ? 171 PHE C CD1 1 ATOM 4263 C CD2 . PHE C 1 171 ? 38.119 45.545 29.521 1.00 71.22 ? 171 PHE C CD2 1 ATOM 4264 C CE1 . PHE C 1 171 ? 38.439 48.262 29.997 1.00 69.71 ? 171 PHE C CE1 1 ATOM 4265 C CE2 . PHE C 1 171 ? 37.075 46.436 29.239 1.00 69.39 ? 171 PHE C CE2 1 ATOM 4266 C CZ . PHE C 1 171 ? 37.242 47.799 29.478 1.00 71.22 ? 171 PHE C CZ 1 ATOM 4267 N N . VAL C 1 172 ? 39.342 43.154 32.614 1.00 70.97 ? 172 VAL C N 1 ATOM 4268 C CA . VAL C 1 172 ? 38.182 42.617 33.303 1.00 70.90 ? 172 VAL C CA 1 ATOM 4269 C C . VAL C 1 172 ? 38.361 42.636 34.821 1.00 70.08 ? 172 VAL C C 1 ATOM 4270 O O . VAL C 1 172 ? 37.384 42.768 35.542 1.00 70.69 ? 172 VAL C O 1 ATOM 4271 C CB . VAL C 1 172 ? 37.825 41.216 32.778 1.00 70.31 ? 172 VAL C CB 1 ATOM 4272 C CG1 . VAL C 1 172 ? 36.572 40.725 33.416 1.00 72.07 ? 172 VAL C CG1 1 ATOM 4273 C CG2 . VAL C 1 172 ? 37.639 41.286 31.308 1.00 71.26 ? 172 VAL C CG2 1 ATOM 4274 N N . ARG C 1 173 ? 39.598 42.502 35.298 1.00 69.83 ? 173 ARG C N 1 ATOM 4275 C CA . ARG C 1 173 ? 39.903 42.704 36.710 1.00 68.74 ? 173 ARG C CA 1 ATOM 4276 C C . ARG C 1 173 ? 39.407 44.112 37.065 1.00 68.31 ? 173 ARG C C 1 ATOM 4277 O O . ARG C 1 173 ? 38.813 44.332 38.121 1.00 68.12 ? 173 ARG C O 1 ATOM 4278 C CB . ARG C 1 173 ? 41.071 42.279 37.129 0.00 40.00 ? 173 ARG C CB 1 ATOM 4279 C CG . ARG C 1 173 ? 41.348 40.815 36.830 0.00 40.00 ? 173 ARG C CG 1 ATOM 4280 C CD . ARG C 1 173 ? 42.657 40.362 37.456 0.00 40.00 ? 173 ARG C CD 1 ATOM 4281 N NE . ARG C 1 173 ? 42.939 38.957 37.178 0.00 40.00 ? 173 ARG C NE 1 ATOM 4282 C CZ . ARG C 1 173 ? 44.018 38.311 37.608 0.00 40.00 ? 173 ARG C CZ 1 ATOM 4283 N NH1 . ARG C 1 173 ? 44.922 38.947 38.341 0.00 40.00 ? 173 ARG C NH1 1 ATOM 4284 N NH2 . ARG C 1 173 ? 44.190 37.032 37.306 0.00 40.00 ? 173 ARG C NH2 1 ATOM 4285 N N . GLY C 1 174 ? 39.650 45.054 36.160 1.00 67.97 ? 174 GLY C N 1 ATOM 4286 C CA . GLY C 1 174 ? 39.290 46.455 36.354 1.00 67.87 ? 174 GLY C CA 1 ATOM 4287 C C . GLY C 1 174 ? 37.819 46.785 36.319 1.00 68.04 ? 174 GLY C C 1 ATOM 4288 O O . GLY C 1 174 ? 37.355 47.587 37.112 1.00 68.27 ? 174 GLY C O 1 ATOM 4289 N N . LEU C 1 175 ? 37.076 46.177 35.399 1.00 68.25 ? 175 LEU C N 1 ATOM 4290 C CA . LEU C 1 175 ? 35.627 46.385 35.338 1.00 68.23 ? 175 LEU C CA 1 ATOM 4291 C C . LEU C 1 175 ? 34.912 45.912 36.579 1.00 67.78 ? 175 LEU C C 1 ATOM 4292 O O . LEU C 1 175 ? 34.008 46.586 37.040 1.00 68.42 ? 175 LEU C O 1 ATOM 4293 C CB . LEU C 1 175 ? 35.014 45.644 34.150 1.00 68.75 ? 175 LEU C CB 1 ATOM 4294 C CG . LEU C 1 175 ? 35.108 46.200 32.741 1.00 69.20 ? 175 LEU C CG 1 ATOM 4295 C CD1 . LEU C 1 175 ? 34.445 45.192 31.840 1.00 68.57 ? 175 LEU C CD1 1 ATOM 4296 C CD2 . LEU C 1 175 ? 34.430 47.557 32.638 1.00 69.14 ? 175 LEU C CD2 1 ATOM 4297 N N . LEU C 1 176 ? 35.317 44.754 37.108 1.00 67.44 ? 176 LEU C N 1 ATOM 4298 C CA . LEU C 1 176 ? 34.721 44.152 38.314 1.00 67.30 ? 176 LEU C CA 1 ATOM 4299 C C . LEU C 1 176 ? 34.842 45.030 39.549 1.00 67.66 ? 176 LEU C C 1 ATOM 4300 O O . LEU C 1 176 ? 33.962 45.008 40.424 1.00 67.54 ? 176 LEU C O 1 ATOM 4301 C CB . LEU C 1 176 ? 35.351 42.797 38.605 1.00 66.71 ? 176 LEU C CB 1 ATOM 4302 C CG . LEU C 1 176 ? 34.980 41.689 37.622 1.00 68.55 ? 176 LEU C CG 1 ATOM 4303 C CD1 . LEU C 1 176 ? 35.967 40.516 37.727 1.00 69.72 ? 176 LEU C CD1 1 ATOM 4304 C CD2 . LEU C 1 176 ? 33.534 41.220 37.803 1.00 68.92 ? 176 LEU C CD2 1 ATOM 4305 N N . GLU C 1 177 ? 35.935 45.794 39.624 1.00 67.94 ? 177 GLU C N 1 ATOM 4306 C CA . GLU C 1 177 ? 36.128 46.747 40.711 1.00 68.31 ? 177 GLU C CA 1 ATOM 4307 C C . GLU C 1 177 ? 35.184 47.901 40.438 1.00 67.93 ? 177 GLU C C 1 ATOM 4308 O O . GLU C 1 177 ? 34.350 48.243 41.276 1.00 68.56 ? 177 GLU C O 1 ATOM 4309 C CB . GLU C 1 177 ? 37.567 47.272 40.768 1.00 68.36 ? 177 GLU C CB 1 ATOM 4310 C CG . GLU C 1 177 ? 38.675 46.234 40.671 1.00 68.82 ? 177 GLU C CG 1 ATOM 4311 C CD . GLU C 1 177 ? 40.057 46.818 41.002 1.00 69.36 ? 177 GLU C CD 1 ATOM 4312 O OE1 . GLU C 1 177 ? 41.067 46.425 40.347 1.00 70.14 ? 177 GLU C OE1 1 ATOM 4313 O OE2 . GLU C 1 177 ? 40.131 47.671 41.919 1.00 68.98 ? 177 GLU C OE2 1 ATOM 4314 N N . ALA C 1 178 ? 35.326 48.480 39.248 1.00 67.65 ? 178 ALA C N 1 ATOM 4315 C CA . ALA C 1 178 ? 34.563 49.642 38.803 1.00 67.88 ? 178 ALA C CA 1 ATOM 4316 C C . ALA C 1 178 ? 33.038 49.461 38.835 1.00 68.10 ? 178 ALA C C 1 ATOM 4317 O O . ALA C 1 178 ? 32.319 50.340 39.294 1.00 67.48 ? 178 ALA C O 1 ATOM 4318 C CB . ALA C 1 178 ? 35.036 50.087 37.408 1.00 67.70 ? 178 ALA C CB 1 ATOM 4319 N N . GLY C 1 179 ? 32.541 48.321 38.356 1.00 68.52 ? 179 GLY C N 1 ATOM 4320 C CA . GLY C 1 179 ? 31.104 48.105 38.348 1.00 68.48 ? 179 GLY C CA 1 ATOM 4321 C C . GLY C 1 179 ? 30.557 47.281 39.483 1.00 69.23 ? 179 GLY C C 1 ATOM 4322 O O . GLY C 1 179 ? 29.460 46.741 39.356 1.00 68.95 ? 179 GLY C O 1 ATOM 4323 N N . LYS C 1 180 ? 31.310 47.184 40.583 1.00 69.81 ? 180 LYS C N 1 ATOM 4324 C CA . LYS C 1 180 ? 30.920 46.369 41.741 1.00 71.05 ? 180 LYS C CA 1 ATOM 4325 C C . LYS C 1 180 ? 29.510 46.722 42.224 1.00 71.52 ? 180 LYS C C 1 ATOM 4326 O O . LYS C 1 180 ? 28.658 45.832 42.372 1.00 72.15 ? 180 LYS C O 1 ATOM 4327 C CB . LYS C 1 180 ? 31.935 46.478 42.903 1.00 70.65 ? 180 LYS C CB 1 ATOM 4328 C CG . LYS C 1 180 ? 31.620 45.503 44.044 1.00 71.32 ? 180 LYS C CG 1 ATOM 4329 C CD . LYS C 1 180 ? 32.180 45.889 45.428 1.00 72.38 ? 180 LYS C CD 1 ATOM 4330 C CE . LYS C 1 180 ? 33.555 45.279 45.664 1.00 74.40 ? 180 LYS C CE 1 ATOM 4331 N NZ . LYS C 1 180 ? 33.536 43.796 45.460 1.00 74.00 ? 180 LYS C NZ 1 ATOM 4332 N N . SER C 1 181 ? 29.265 48.012 42.459 1.00 71.82 ? 181 SER C N 1 ATOM 4333 C CA . SER C 1 181 ? 27.955 48.473 42.907 1.00 72.53 ? 181 SER C CA 1 ATOM 4334 C C . SER C 1 181 ? 26.820 47.937 42.028 1.00 72.41 ? 181 SER C C 1 ATOM 4335 O O . SER C 1 181 ? 25.860 47.367 42.555 1.00 73.01 ? 181 SER C O 1 ATOM 4336 C CB . SER C 1 181 ? 27.891 50.000 42.974 1.00 72.77 ? 181 SER C CB 1 ATOM 4337 O OG . SER C 1 181 ? 27.662 50.542 41.686 1.00 75.15 ? 181 SER C OG 1 ATOM 4338 N N . ASP C 1 182 ? 26.921 48.114 40.707 1.00 72.21 ? 182 ASP C N 1 ATOM 4339 C CA . ASP C 1 182 ? 25.897 47.585 39.794 1.00 72.44 ? 182 ASP C CA 1 ATOM 4340 C C . ASP C 1 182 ? 25.883 46.082 39.791 1.00 72.30 ? 182 ASP C C 1 ATOM 4341 O O . ASP C 1 182 ? 24.826 45.494 39.686 1.00 73.26 ? 182 ASP C O 1 ATOM 4342 C CB . ASP C 1 182 ? 26.096 48.038 38.345 1.00 72.52 ? 182 ASP C CB 1 ATOM 4343 C CG . ASP C 1 182 ? 25.522 49.415 38.058 1.00 73.52 ? 182 ASP C CG 1 ATOM 4344 O OD1 . ASP C 1 182 ? 25.544 50.306 38.968 1.00 74.46 ? 182 ASP C OD1 1 ATOM 4345 O OD2 . ASP C 1 182 ? 25.039 49.688 36.924 1.00 71.32 ? 182 ASP C OD2 1 ATOM 4346 N N . LEU C 1 183 ? 27.053 45.460 39.900 1.00 72.41 ? 183 LEU C N 1 ATOM 4347 C CA . LEU C 1 183 ? 27.163 44.002 39.789 1.00 72.31 ? 183 LEU C CA 1 ATOM 4348 C C . LEU C 1 183 ? 26.443 43.235 40.868 1.00 72.43 ? 183 LEU C C 1 ATOM 4349 O O . LEU C 1 183 ? 25.828 42.198 40.597 1.00 72.22 ? 183 LEU C O 1 ATOM 4350 C CB . LEU C 1 183 ? 28.616 43.549 39.732 1.00 72.06 ? 183 LEU C CB 1 ATOM 4351 C CG . LEU C 1 183 ? 29.298 43.742 38.380 1.00 71.59 ? 183 LEU C CG 1 ATOM 4352 C CD1 . LEU C 1 183 ? 30.679 43.146 38.446 1.00 70.83 ? 183 LEU C CD1 1 ATOM 4353 C CD2 . LEU C 1 183 ? 28.482 43.092 37.306 1.00 69.74 ? 183 LEU C CD2 1 ATOM 4354 N N . GLU C 1 184 ? 26.530 43.744 42.088 1.00 72.68 ? 184 GLU C N 1 ATOM 4355 C CA . GLU C 1 184 ? 25.834 43.134 43.221 1.00 72.94 ? 184 GLU C CA 1 ATOM 4356 C C . GLU C 1 184 ? 24.599 43.906 43.675 1.00 72.67 ? 184 GLU C C 1 ATOM 4357 O O . GLU C 1 184 ? 24.152 43.744 44.805 1.00 72.26 ? 184 GLU C O 1 ATOM 4358 C CB . GLU C 1 184 ? 26.795 42.881 44.375 1.00 73.02 ? 184 GLU C CB 1 ATOM 4359 C CG . GLU C 1 184 ? 27.777 41.765 44.074 1.00 73.19 ? 184 GLU C CG 1 ATOM 4360 C CD . GLU C 1 184 ? 29.106 41.966 44.766 1.00 73.65 ? 184 GLU C CD 1 ATOM 4361 O OE1 . GLU C 1 184 ? 29.144 42.612 45.838 1.00 70.93 ? 184 GLU C OE1 1 ATOM 4362 O OE2 . GLU C 1 184 ? 30.112 41.471 44.216 1.00 74.57 ? 184 GLU C OE2 1 ATOM 4363 N N . LYS C 1 185 ? 24.063 44.740 42.778 1.00 72.88 ? 185 LYS C N 1 ATOM 4364 C CA . LYS C 1 185 ? 22.810 45.446 43.000 1.00 73.50 ? 185 LYS C CA 1 ATOM 4365 C C . LYS C 1 185 ? 21.797 44.311 43.195 1.00 73.02 ? 185 LYS C C 1 ATOM 4366 O O . LYS C 1 185 ? 21.932 43.247 42.583 1.00 72.87 ? 185 LYS C O 1 ATOM 4367 C CB . LYS C 1 185 ? 22.471 46.363 41.795 1.00 73.62 ? 185 LYS C CB 1 ATOM 4368 C CG . LYS C 1 185 ? 21.498 45.750 40.717 1.00 75.46 ? 185 LYS C CG 1 ATOM 4369 C CD . LYS C 1 185 ? 21.951 45.872 39.209 1.00 75.15 ? 185 LYS C CD 1 ATOM 4370 C CE . LYS C 1 185 ? 22.089 47.311 38.678 1.00 77.10 ? 185 LYS C CE 1 ATOM 4371 N NZ . LYS C 1 185 ? 22.783 47.282 37.348 1.00 75.47 ? 185 LYS C NZ 1 ATOM 4372 N N . GLN C 1 186 ? 20.807 44.528 44.052 1.00 72.79 ? 186 GLN C N 1 ATOM 4373 C CA . GLN C 1 186 ? 19.782 43.529 44.334 1.00 72.97 ? 186 GLN C CA 1 ATOM 4374 C C . GLN C 1 186 ? 18.405 44.128 44.110 1.00 73.54 ? 186 GLN C C 1 ATOM 4375 O O . GLN C 1 186 ? 18.071 45.170 44.693 1.00 72.66 ? 186 GLN C O 1 ATOM 4376 C CB . GLN C 1 186 ? 19.884 42.995 45.770 1.00 72.78 ? 186 GLN C CB 1 ATOM 4377 C CG . GLN C 1 186 ? 21.148 42.187 46.072 1.00 70.88 ? 186 GLN C CG 1 ATOM 4378 C CD . GLN C 1 186 ? 20.970 40.701 45.872 1.00 70.73 ? 186 GLN C CD 1 ATOM 4379 O OE1 . GLN C 1 186 ? 19.834 40.183 45.906 1.00 69.74 ? 186 GLN C OE1 1 ATOM 4380 N NE2 . GLN C 1 186 ? 22.085 39.997 45.662 1.00 66.65 ? 186 GLN C NE2 1 ATOM 4381 N N . GLU C 1 187 ? 17.638 43.435 43.261 1.00 73.83 ? 187 GLU C N 1 ATOM 4382 C CA . GLU C 1 187 ? 16.281 43.796 42.823 1.00 74.55 ? 187 GLU C CA 1 ATOM 4383 C C . GLU C 1 187 ? 15.243 42.752 43.258 1.00 74.11 ? 187 GLU C C 1 ATOM 4384 O O . GLU C 1 187 ? 15.381 41.554 42.979 1.00 73.77 ? 187 GLU C O 1 ATOM 4385 C CB . GLU C 1 187 ? 16.273 43.897 41.285 1.00 74.91 ? 187 GLU C CB 1 ATOM 4386 C CG . GLU C 1 187 ? 16.291 45.270 40.600 1.00 76.71 ? 187 GLU C CG 1 ATOM 4387 C CD . GLU C 1 187 ? 16.677 46.432 41.487 1.00 79.20 ? 187 GLU C CD 1 ATOM 4388 O OE1 . GLU C 1 187 ? 17.587 47.202 41.118 1.00 78.75 ? 187 GLU C OE1 1 ATOM 4389 O OE2 . GLU C 1 187 ? 16.053 46.580 42.557 1.00 80.52 ? 187 GLU C OE2 1 ATOM 4390 N N . LYS C 1 188 ? 14.202 43.209 43.937 1.00 74.51 ? 188 LYS C N 1 ATOM 4391 C CA . LYS C 1 188 ? 13.129 42.318 44.438 1.00 74.24 ? 188 LYS C CA 1 ATOM 4392 C C . LYS C 1 188 ? 12.156 41.889 43.338 1.00 74.28 ? 188 LYS C C 1 ATOM 4393 O O . LYS C 1 188 ? 11.670 42.723 42.584 1.00 73.52 ? 188 LYS C O 1 ATOM 4394 C CB . LYS C 1 188 ? 12.337 42.841 45.469 0.00 40.00 ? 188 LYS C CB 1 ATOM 4395 C CG . LYS C 1 188 ? 13.158 43.481 46.573 0.00 40.00 ? 188 LYS C CG 1 ATOM 4396 C CD . LYS C 1 188 ? 12.258 44.015 47.679 0.00 40.00 ? 188 LYS C CD 1 ATOM 4397 C CE . LYS C 1 188 ? 13.056 44.277 48.936 0.00 40.00 ? 188 LYS C CE 1 ATOM 4398 N NZ . LYS C 1 188 ? 12.282 43.831 50.130 0.00 40.00 ? 188 LYS C NZ 1 ATOM 4399 N N . PRO C 1 189 ? 11.866 40.588 43.246 1.00 74.60 ? 189 PRO C N 1 ATOM 4400 C CA . PRO C 1 189 ? 10.904 40.106 42.273 1.00 74.65 ? 189 PRO C CA 1 ATOM 4401 C C . PRO C 1 189 ? 9.538 40.580 42.733 1.00 75.41 ? 189 PRO C C 1 ATOM 4402 O O . PRO C 1 189 ? 9.393 40.991 43.897 1.00 75.56 ? 189 PRO C O 1 ATOM 4403 C CB . PRO C 1 189 ? 10.967 38.591 42.448 1.00 74.25 ? 189 PRO C CB 1 ATOM 4404 C CG . PRO C 1 189 ? 11.375 38.403 43.866 1.00 74.91 ? 189 PRO C CG 1 ATOM 4405 C CD . PRO C 1 189 ? 12.409 39.484 44.064 1.00 74.57 ? 189 PRO C CD 1 ATOM 4406 N N . VAL C 1 190 ? 8.551 40.524 41.835 1.00 75.05 ? 190 VAL C N 1 ATOM 4407 C CA . VAL C 1 190 ? 7.167 40.847 42.152 1.00 74.42 ? 190 VAL C CA 1 ATOM 4408 C C . VAL C 1 190 ? 6.449 39.727 41.468 1.00 73.85 ? 190 VAL C C 1 ATOM 4409 O O . VAL C 1 190 ? 6.742 39.403 40.327 1.00 73.50 ? 190 VAL C O 1 ATOM 4410 C CB . VAL C 1 190 ? 6.734 42.235 41.596 1.00 74.84 ? 190 VAL C CB 1 ATOM 4411 C CG1 . VAL C 1 190 ? 5.222 42.407 41.640 1.00 75.39 ? 190 VAL C CG1 1 ATOM 4412 C CG2 . VAL C 1 190 ? 7.439 43.417 42.375 1.00 75.32 ? 190 VAL C CG2 1 ATOM 4413 N N . ALA C 1 191 ? 5.510 39.119 42.163 1.00 73.37 ? 191 ALA C N 1 ATOM 4414 C CA . ALA C 1 191 ? 4.803 37.978 41.601 1.00 73.02 ? 191 ALA C CA 1 ATOM 4415 C C . ALA C 1 191 ? 3.316 38.229 41.383 1.00 72.32 ? 191 ALA C C 1 ATOM 4416 O O . ALA C 1 191 ? 2.728 39.110 42.011 1.00 72.36 ? 191 ALA C O 1 ATOM 4417 C CB . ALA C 1 191 ? 5.042 36.762 42.466 1.00 73.13 ? 191 ALA C CB 1 ATOM 4418 N N . TRP C 1 192 ? 2.713 37.463 40.480 1.00 71.99 ? 192 TRP C N 1 ATOM 4419 C CA . TRP C 1 192 ? 1.271 37.509 40.307 1.00 71.50 ? 192 TRP C CA 1 ATOM 4420 C C . TRP C 1 192 ? 0.817 36.249 39.623 1.00 71.51 ? 192 TRP C C 1 ATOM 4421 O O . TRP C 1 192 ? 1.580 35.667 38.864 1.00 72.20 ? 192 TRP C O 1 ATOM 4422 C CB . TRP C 1 192 ? 0.818 38.750 39.551 1.00 71.89 ? 192 TRP C CB 1 ATOM 4423 C CG . TRP C 1 192 ? 1.182 38.811 38.103 1.00 72.43 ? 192 TRP C CG 1 ATOM 4424 C CD1 . TRP C 1 192 ? 0.405 38.418 37.048 1.00 70.93 ? 192 TRP C CD1 1 ATOM 4425 C CD2 . TRP C 1 192 ? 2.408 39.306 37.538 1.00 71.86 ? 192 TRP C CD2 1 ATOM 4426 N NE1 . TRP C 1 192 ? 1.076 38.629 35.865 1.00 72.93 ? 192 TRP C NE1 1 ATOM 4427 C CE2 . TRP C 1 192 ? 2.307 39.175 36.136 1.00 73.13 ? 192 TRP C CE2 1 ATOM 4428 C CE3 . TRP C 1 192 ? 3.589 39.833 38.074 1.00 72.28 ? 192 TRP C CE3 1 ATOM 4429 C CZ2 . TRP C 1 192 ? 3.338 39.560 35.270 1.00 72.72 ? 192 TRP C CZ2 1 ATOM 4430 C CZ3 . TRP C 1 192 ? 4.604 40.213 37.216 1.00 71.47 ? 192 TRP C CZ3 1 ATOM 4431 C CH2 . TRP C 1 192 ? 4.474 40.074 35.836 1.00 71.71 ? 192 TRP C CH2 1 ATOM 4432 N N . LEU C 1 193 ? -0.425 35.842 39.893 1.00 70.52 ? 193 LEU C N 1 ATOM 4433 C CA . LEU C 1 193 ? -0.952 34.553 39.433 1.00 70.04 ? 193 LEU C CA 1 ATOM 4434 C C . LEU C 1 193 ? -2.021 34.699 38.361 1.00 69.74 ? 193 LEU C C 1 ATOM 4435 O O . LEU C 1 193 ? -2.694 35.727 38.250 1.00 69.26 ? 193 LEU C O 1 ATOM 4436 C CB . LEU C 1 193 ? -1.527 33.746 40.614 1.00 69.24 ? 193 LEU C CB 1 ATOM 4437 C CG . LEU C 1 193 ? -0.690 33.565 41.888 1.00 68.13 ? 193 LEU C CG 1 ATOM 4438 C CD1 . LEU C 1 193 ? -1.439 32.897 43.006 1.00 65.98 ? 193 LEU C CD1 1 ATOM 4439 C CD2 . LEU C 1 193 ? 0.590 32.788 41.617 1.00 70.58 ? 193 LEU C CD2 1 ATOM 4440 N N . SER C 1 194 ? -2.166 33.648 37.569 1.00 69.64 ? 194 SER C N 1 ATOM 4441 C CA . SER C 1 194 ? -3.202 33.582 36.567 1.00 69.97 ? 194 SER C CA 1 ATOM 4442 C C . SER C 1 194 ? -3.372 32.115 36.219 1.00 70.64 ? 194 SER C C 1 ATOM 4443 O O . SER C 1 194 ? -2.626 31.260 36.706 1.00 70.54 ? 194 SER C O 1 ATOM 4444 C CB . SER C 1 194 ? -2.832 34.395 35.330 1.00 70.16 ? 194 SER C CB 1 ATOM 4445 O OG . SER C 1 194 ? -1.649 33.900 34.730 1.00 71.68 ? 194 SER C OG 1 ATOM 4446 N N . SER C 1 195 ? -4.350 31.823 35.387 1.00 70.22 ? 195 SER C N 1 ATOM 4447 C CA . SER C 1 195 ? -4.585 30.456 35.017 1.00 71.72 ? 195 SER C CA 1 ATOM 4448 C C . SER C 1 195 ? -4.993 30.441 33.593 1.00 72.26 ? 195 SER C C 1 ATOM 4449 O O . SER C 1 195 ? -5.446 31.454 33.043 1.00 71.60 ? 195 SER C O 1 ATOM 4450 C CB . SER C 1 195 ? -5.711 29.836 35.831 1.00 71.24 ? 195 SER C CB 1 ATOM 4451 O OG . SER C 1 195 ? -6.951 30.320 35.347 1.00 72.15 ? 195 SER C OG 1 ATOM 4452 N N . VAL C 1 196 ? -4.841 29.254 33.019 1.00 73.99 ? 196 VAL C N 1 ATOM 4453 C CA . VAL C 1 196 ? -5.050 29.028 31.626 1.00 75.10 ? 196 VAL C CA 1 ATOM 4454 C C . VAL C 1 196 ? -5.897 27.753 31.453 1.00 75.73 ? 196 VAL C C 1 ATOM 4455 O O . VAL C 1 196 ? -5.526 26.683 31.952 1.00 76.10 ? 196 VAL C O 1 ATOM 4456 C CB . VAL C 1 196 ? -3.664 28.912 30.920 1.00 74.92 ? 196 VAL C CB 1 ATOM 4457 C CG1 . VAL C 1 196 ? -3.812 28.647 29.433 1.00 76.60 ? 196 VAL C CG1 1 ATOM 4458 C CG2 . VAL C 1 196 ? -2.830 30.169 31.145 1.00 75.99 ? 196 VAL C CG2 1 ATOM 4459 N N . PRO C 1 197 ? -7.037 27.889 30.768 1.00 75.78 ? 197 PRO C N 1 ATOM 4460 C CA . PRO C 1 197 ? -7.901 26.757 30.341 1.00 76.37 ? 197 PRO C CA 1 ATOM 4461 C C . PRO C 1 197 ? -7.199 25.557 29.680 1.00 76.30 ? 197 PRO C C 1 ATOM 4462 O O . PRO C 1 197 ? -6.078 25.694 29.182 1.00 76.76 ? 197 PRO C O 1 ATOM 4463 C CB . PRO C 1 197 ? -8.835 27.407 29.313 1.00 76.64 ? 197 PRO C CB 1 ATOM 4464 C CG . PRO C 1 197 ? -8.269 28.850 29.113 1.00 75.72 ? 197 PRO C CG 1 ATOM 4465 C CD . PRO C 1 197 ? -7.604 29.189 30.376 1.00 75.75 ? 197 PRO C CD 1 ATOM 4466 N N . HIS C 1 201 ? -11.825 18.800 28.329 1.00 81.33 ? 201 HIS C N 1 ATOM 4467 C CA . HIS C 1 201 ? -11.559 18.293 29.673 1.00 81.28 ? 201 HIS C CA 1 ATOM 4468 C C . HIS C 1 201 ? -11.497 19.366 30.744 1.00 80.81 ? 201 HIS C C 1 ATOM 4469 O O . HIS C 1 201 ? -11.595 20.554 30.448 1.00 80.45 ? 201 HIS C O 1 ATOM 4470 C CB . HIS C 1 201 ? -10.312 17.399 29.698 1.00 81.63 ? 201 HIS C CB 1 ATOM 4471 C CG . HIS C 1 201 ? -10.564 16.027 29.152 1.00 82.49 ? 201 HIS C CG 1 ATOM 4472 N ND1 . HIS C 1 201 ? -11.282 15.073 29.845 1.00 82.92 ? 201 HIS C ND1 1 ATOM 4473 C CD2 . HIS C 1 201 ? -10.201 15.449 27.982 1.00 83.18 ? 201 HIS C CD2 1 ATOM 4474 C CE1 . HIS C 1 201 ? -11.349 13.966 29.126 1.00 83.80 ? 201 HIS C CE1 1 ATOM 4475 N NE2 . HIS C 1 201 ? -10.703 14.166 27.990 1.00 84.13 ? 201 HIS C NE2 1 ATOM 4476 N N . GLY C 1 202 ? -11.336 18.932 31.989 1.00 80.34 ? 202 GLY C N 1 ATOM 4477 C CA . GLY C 1 202 ? -11.370 19.833 33.127 1.00 79.81 ? 202 GLY C CA 1 ATOM 4478 C C . GLY C 1 202 ? -10.016 20.217 33.678 1.00 79.72 ? 202 GLY C C 1 ATOM 4479 O O . GLY C 1 202 ? -9.936 20.679 34.813 1.00 79.93 ? 202 GLY C O 1 ATOM 4480 N N . HIS C 1 203 ? -8.957 20.033 32.886 1.00 79.15 ? 203 HIS C N 1 ATOM 4481 C CA . HIS C 1 203 ? -7.600 20.395 33.302 1.00 78.68 ? 203 HIS C CA 1 ATOM 4482 C C . HIS C 1 203 ? -7.290 21.846 32.981 1.00 78.05 ? 203 HIS C C 1 ATOM 4483 O O . HIS C 1 203 ? -7.621 22.330 31.907 1.00 77.99 ? 203 HIS C O 1 ATOM 4484 C CB . HIS C 1 203 ? -6.542 19.502 32.633 1.00 79.02 ? 203 HIS C CB 1 ATOM 4485 C CG . HIS C 1 203 ? -6.612 18.061 33.041 1.00 80.50 ? 203 HIS C CG 1 ATOM 4486 N ND1 . HIS C 1 203 ? -7.204 17.091 32.258 1.00 83.15 ? 203 HIS C ND1 1 ATOM 4487 C CD2 . HIS C 1 203 ? -6.164 17.425 34.150 1.00 81.37 ? 203 HIS C CD2 1 ATOM 4488 C CE1 . HIS C 1 203 ? -7.120 15.920 32.867 1.00 83.20 ? 203 HIS C CE1 1 ATOM 4489 N NE2 . HIS C 1 203 ? -6.493 16.097 34.018 1.00 83.11 ? 203 HIS C NE2 1 ATOM 4490 N N . ARG C 1 204 ? -6.655 22.536 33.918 1.00 77.16 ? 204 ARG C N 1 ATOM 4491 C CA . ARG C 1 204 ? -6.150 23.892 33.670 1.00 77.19 ? 204 ARG C CA 1 ATOM 4492 C C . ARG C 1 204 ? -4.738 24.084 34.153 1.00 76.13 ? 204 ARG C C 1 ATOM 4493 O O . ARG C 1 204 ? -4.245 23.332 34.981 1.00 76.60 ? 204 ARG C O 1 ATOM 4494 C CB . ARG C 1 204 ? -7.031 25.005 34.232 1.00 77.01 ? 204 ARG C CB 1 ATOM 4495 C CG . ARG C 1 204 ? -8.052 24.613 35.237 1.00 79.91 ? 204 ARG C CG 1 ATOM 4496 C CD . ARG C 1 204 ? -8.779 25.811 35.779 1.00 84.31 ? 204 ARG C CD 1 ATOM 4497 N NE . ARG C 1 204 ? -8.756 26.933 34.840 1.00 86.05 ? 204 ARG C NE 1 ATOM 4498 C CZ . ARG C 1 204 ? -8.874 28.208 35.197 1.00 87.20 ? 204 ARG C CZ 1 ATOM 4499 N NH1 . ARG C 1 204 ? -9.025 28.542 36.476 1.00 87.84 ? 204 ARG C NH1 1 ATOM 4500 N NH2 . ARG C 1 204 ? -8.838 29.158 34.274 1.00 88.05 ? 204 ARG C NH2 1 ATOM 4501 N N . GLN C 1 205 ? -4.077 25.093 33.630 1.00 74.83 ? 205 GLN C N 1 ATOM 4502 C CA . GLN C 1 205 ? -2.724 25.305 34.071 1.00 74.42 ? 205 GLN C CA 1 ATOM 4503 C C . GLN C 1 205 ? -2.609 26.630 34.805 1.00 73.11 ? 205 GLN C C 1 ATOM 4504 O O . GLN C 1 205 ? -3.121 27.656 34.375 1.00 72.91 ? 205 GLN C O 1 ATOM 4505 C CB . GLN C 1 205 ? -1.697 25.113 32.945 1.00 74.58 ? 205 GLN C CB 1 ATOM 4506 C CG . GLN C 1 205 ? -1.311 26.343 32.173 1.00 76.14 ? 205 GLN C CG 1 ATOM 4507 C CD . GLN C 1 205 ? 0.095 26.233 31.648 1.00 79.26 ? 205 GLN C CD 1 ATOM 4508 O OE1 . GLN C 1 205 ? 0.571 25.125 31.386 1.00 83.25 ? 205 GLN C OE1 1 ATOM 4509 N NE2 . GLN C 1 205 ? 0.767 27.364 31.489 1.00 80.25 ? 205 GLN C NE2 1 ATOM 4510 N N . LEU C 1 206 ? -1.935 26.577 35.938 1.00 72.48 ? 206 LEU C N 1 ATOM 4511 C CA . LEU C 1 206 ? -1.769 27.737 36.765 1.00 71.21 ? 206 LEU C CA 1 ATOM 4512 C C . LEU C 1 206 ? -0.400 28.340 36.443 1.00 71.97 ? 206 LEU C C 1 ATOM 4513 O O . LEU C 1 206 ? 0.566 27.606 36.265 1.00 70.84 ? 206 LEU C O 1 ATOM 4514 C CB . LEU C 1 206 ? -1.910 27.328 38.232 1.00 71.24 ? 206 LEU C CB 1 ATOM 4515 C CG . LEU C 1 206 ? -3.280 27.360 38.939 1.00 69.58 ? 206 LEU C CG 1 ATOM 4516 C CD1 . LEU C 1 206 ? -4.488 26.934 38.120 1.00 68.79 ? 206 LEU C CD1 1 ATOM 4517 C CD2 . LEU C 1 206 ? -3.183 26.596 40.220 1.00 69.87 ? 206 LEU C CD2 1 ATOM 4518 N N . VAL C 1 207 ? -0.333 29.670 36.359 1.00 72.01 ? 207 VAL C N 1 ATOM 4519 C CA . VAL C 1 207 ? 0.891 30.346 36.010 1.00 73.22 ? 207 VAL C CA 1 ATOM 4520 C C . VAL C 1 207 ? 1.308 31.363 37.086 1.00 73.52 ? 207 VAL C C 1 ATOM 4521 O O . VAL C 1 207 ? 0.581 32.285 37.450 1.00 73.72 ? 207 VAL C O 1 ATOM 4522 C CB . VAL C 1 207 ? 0.813 31.067 34.644 1.00 72.62 ? 207 VAL C CB 1 ATOM 4523 C CG1 . VAL C 1 207 ? 2.221 31.447 34.160 1.00 73.77 ? 207 VAL C CG1 1 ATOM 4524 C CG2 . VAL C 1 207 ? 0.134 30.239 33.609 1.00 73.54 ? 207 VAL C CG2 1 ATOM 4525 N N . CYS C 1 208 ? 2.504 31.180 37.597 1.00 74.71 ? 208 CYS C N 1 ATOM 4526 C CA . CYS C 1 208 ? 3.037 32.117 38.539 1.00 74.77 ? 208 CYS C CA 1 ATOM 4527 C C . CYS C 1 208 ? 4.096 32.919 37.813 1.00 75.49 ? 208 CYS C C 1 ATOM 4528 O O . CYS C 1 208 ? 5.059 32.346 37.317 1.00 74.53 ? 208 CYS C O 1 ATOM 4529 C CB . CYS C 1 208 ? 3.665 31.363 39.679 1.00 75.24 ? 208 CYS C CB 1 ATOM 4530 S SG . CYS C 1 208 ? 4.296 32.480 40.917 1.00 75.95 ? 208 CYS C SG 1 ATOM 4531 N N . HIS C 1 209 ? 3.894 34.236 37.763 1.00 75.95 ? 209 HIS C N 1 ATOM 4532 C CA . HIS C 1 209 ? 4.769 35.158 37.064 1.00 76.13 ? 209 HIS C CA 1 ATOM 4533 C C . HIS C 1 209 ? 5.658 35.907 38.066 1.00 76.89 ? 209 HIS C C 1 ATOM 4534 O O . HIS C 1 209 ? 5.175 36.457 39.052 1.00 76.78 ? 209 HIS C O 1 ATOM 4535 C CB . HIS C 1 209 ? 3.961 36.225 36.318 1.00 76.03 ? 209 HIS C CB 1 ATOM 4536 C CG . HIS C 1 209 ? 2.827 35.700 35.480 1.00 74.66 ? 209 HIS C CG 1 ATOM 4537 N ND1 . HIS C 1 209 ? 2.894 35.618 34.109 1.00 75.37 ? 209 HIS C ND1 1 ATOM 4538 C CD2 . HIS C 1 209 ? 1.593 35.257 35.819 1.00 75.01 ? 209 HIS C CD2 1 ATOM 4539 C CE1 . HIS C 1 209 ? 1.755 35.133 33.633 1.00 76.50 ? 209 HIS C CE1 1 ATOM 4540 N NE2 . HIS C 1 209 ? 0.945 34.907 34.652 1.00 76.79 ? 209 HIS C NE2 1 ATOM 4541 N N . VAL C 1 210 ? 6.957 35.931 37.805 1.00 76.65 ? 210 VAL C N 1 ATOM 4542 C CA . VAL C 1 210 ? 7.892 36.610 38.691 1.00 77.18 ? 210 VAL C CA 1 ATOM 4543 C C . VAL C 1 210 ? 8.733 37.525 37.810 1.00 76.64 ? 210 VAL C C 1 ATOM 4544 O O . VAL C 1 210 ? 9.477 37.048 36.934 1.00 76.23 ? 210 VAL C O 1 ATOM 4545 C CB . VAL C 1 210 ? 8.764 35.594 39.467 1.00 77.63 ? 210 VAL C CB 1 ATOM 4546 C CG1 . VAL C 1 210 ? 9.525 36.274 40.569 1.00 76.73 ? 210 VAL C CG1 1 ATOM 4547 C CG2 . VAL C 1 210 ? 7.876 34.468 40.046 1.00 78.75 ? 210 VAL C CG2 1 ATOM 4548 N N . SER C 1 211 ? 8.593 38.827 38.034 1.00 75.73 ? 211 SER C N 1 ATOM 4549 C CA . SER C 1 211 ? 9.256 39.824 37.213 1.00 75.68 ? 211 SER C CA 1 ATOM 4550 C C . SER C 1 211 ? 9.991 40.856 38.026 1.00 75.51 ? 211 SER C C 1 ATOM 4551 O O . SER C 1 211 ? 9.527 41.230 39.091 1.00 77.10 ? 211 SER C O 1 ATOM 4552 C CB . SER C 1 211 ? 8.236 40.575 36.376 1.00 75.67 ? 211 SER C CB 1 ATOM 4553 O OG . SER C 1 211 ? 8.892 41.535 35.557 1.00 75.26 ? 211 SER C OG 1 ATOM 4554 N N . GLY C 1 212 ? 11.132 41.319 37.522 1.00 75.07 ? 212 GLY C N 1 ATOM 4555 C CA . GLY C 1 212 ? 11.875 42.397 38.152 1.00 73.43 ? 212 GLY C CA 1 ATOM 4556 C C . GLY C 1 212 ? 12.983 42.013 39.092 1.00 73.22 ? 212 GLY C C 1 ATOM 4557 O O . GLY C 1 212 ? 13.527 42.869 39.770 1.00 72.35 ? 212 GLY C O 1 ATOM 4558 N N . PHE C 1 213 ? 13.339 40.739 39.155 1.00 72.79 ? 213 PHE C N 1 ATOM 4559 C CA . PHE C 1 213 ? 14.414 40.376 40.064 1.00 72.54 ? 213 PHE C CA 1 ATOM 4560 C C . PHE C 1 213 ? 15.814 40.538 39.434 1.00 73.17 ? 213 PHE C C 1 ATOM 4561 O O . PHE C 1 213 ? 15.956 40.463 38.210 1.00 73.27 ? 213 PHE C O 1 ATOM 4562 C CB . PHE C 1 213 ? 14.205 38.965 40.655 1.00 71.85 ? 213 PHE C CB 1 ATOM 4563 C CG . PHE C 1 213 ? 14.079 37.881 39.620 1.00 70.53 ? 213 PHE C CG 1 ATOM 4564 C CD1 . PHE C 1 213 ? 12.896 37.677 38.967 1.00 67.87 ? 213 PHE C CD1 1 ATOM 4565 C CD2 . PHE C 1 213 ? 15.164 37.069 39.307 1.00 70.75 ? 213 PHE C CD2 1 ATOM 4566 C CE1 . PHE C 1 213 ? 12.776 36.675 38.006 1.00 68.34 ? 213 PHE C CE1 1 ATOM 4567 C CE2 . PHE C 1 213 ? 15.045 36.069 38.344 1.00 71.89 ? 213 PHE C CE2 1 ATOM 4568 C CZ . PHE C 1 213 ? 13.842 35.877 37.693 1.00 68.50 ? 213 PHE C CZ 1 ATOM 4569 N N . TYR C 1 214 ? 16.813 40.768 40.297 1.00 72.79 ? 214 TYR C N 1 ATOM 4570 C CA . TYR C 1 214 ? 18.240 40.745 39.958 1.00 72.72 ? 214 TYR C CA 1 ATOM 4571 C C . TYR C 1 214 ? 19.000 40.454 41.236 1.00 72.04 ? 214 TYR C C 1 ATOM 4572 O O . TYR C 1 214 ? 18.614 40.968 42.246 1.00 72.13 ? 214 TYR C O 1 ATOM 4573 C CB . TYR C 1 214 ? 18.759 42.081 39.403 1.00 72.89 ? 214 TYR C CB 1 ATOM 4574 C CG . TYR C 1 214 ? 20.152 41.953 38.783 1.00 72.71 ? 214 TYR C CG 1 ATOM 4575 C CD1 . TYR C 1 214 ? 21.295 42.249 39.515 1.00 73.37 ? 214 TYR C CD1 1 ATOM 4576 C CD2 . TYR C 1 214 ? 20.310 41.523 37.464 1.00 72.76 ? 214 TYR C CD2 1 ATOM 4577 C CE1 . TYR C 1 214 ? 22.547 42.128 38.954 1.00 72.65 ? 214 TYR C CE1 1 ATOM 4578 C CE2 . TYR C 1 214 ? 21.548 41.396 36.889 1.00 72.01 ? 214 TYR C CE2 1 ATOM 4579 C CZ . TYR C 1 214 ? 22.671 41.704 37.643 1.00 74.65 ? 214 TYR C CZ 1 ATOM 4580 O OH . TYR C 1 214 ? 23.928 41.583 37.079 1.00 73.68 ? 214 TYR C OH 1 ATOM 4581 N N . PRO C 1 215 ? 20.067 39.650 41.215 1.00 72.44 ? 215 PRO C N 1 ATOM 4582 C CA . PRO C 1 215 ? 20.521 38.887 40.036 1.00 72.62 ? 215 PRO C CA 1 ATOM 4583 C C . PRO C 1 215 ? 19.699 37.641 39.692 1.00 72.78 ? 215 PRO C C 1 ATOM 4584 O O . PRO C 1 215 ? 18.831 37.204 40.467 1.00 72.52 ? 215 PRO C O 1 ATOM 4585 C CB . PRO C 1 215 ? 21.966 38.513 40.389 1.00 72.52 ? 215 PRO C CB 1 ATOM 4586 C CG . PRO C 1 215 ? 22.016 38.522 41.882 1.00 72.66 ? 215 PRO C CG 1 ATOM 4587 C CD . PRO C 1 215 ? 20.958 39.451 42.372 1.00 72.30 ? 215 PRO C CD 1 ATOM 4588 N N . LYS C 1 216 ? 20.007 37.094 38.524 1.00 73.01 ? 216 LYS C N 1 ATOM 4589 C CA . LYS C 1 216 ? 19.292 35.975 37.902 1.00 73.61 ? 216 LYS C CA 1 ATOM 4590 C C . LYS C 1 216 ? 18.860 34.813 38.825 1.00 73.44 ? 216 LYS C C 1 ATOM 4591 O O . LYS C 1 216 ? 17.707 34.399 38.768 1.00 73.72 ? 216 LYS C O 1 ATOM 4592 C CB . LYS C 1 216 ? 20.090 35.482 36.683 1.00 73.80 ? 216 LYS C CB 1 ATOM 4593 C CG . LYS C 1 216 ? 19.310 34.599 35.736 1.00 75.57 ? 216 LYS C CG 1 ATOM 4594 C CD . LYS C 1 216 ? 19.677 34.797 34.270 1.00 77.75 ? 216 LYS C CD 1 ATOM 4595 C CE . LYS C 1 216 ? 21.114 34.514 33.981 1.00 81.14 ? 216 LYS C CE 1 ATOM 4596 N NZ . LYS C 1 216 ? 21.345 34.631 32.513 1.00 83.51 ? 216 LYS C NZ 1 ATOM 4597 N N . PRO C 1 217 ? 19.750 34.282 39.664 1.00 72.74 ? 217 PRO C N 1 ATOM 4598 C CA . PRO C 1 217 ? 19.381 33.171 40.549 1.00 72.50 ? 217 PRO C CA 1 ATOM 4599 C C . PRO C 1 217 ? 18.091 33.339 41.373 1.00 72.29 ? 217 PRO C C 1 ATOM 4600 O O . PRO C 1 217 ? 17.982 34.216 42.232 1.00 72.01 ? 217 PRO C O 1 ATOM 4601 C CB . PRO C 1 217 ? 20.615 33.026 41.447 1.00 72.47 ? 217 PRO C CB 1 ATOM 4602 C CG . PRO C 1 217 ? 21.742 33.516 40.590 1.00 72.08 ? 217 PRO C CG 1 ATOM 4603 C CD . PRO C 1 217 ? 21.163 34.667 39.843 1.00 72.38 ? 217 PRO C CD 1 ATOM 4604 N N . VAL C 1 218 ? 17.120 32.475 41.097 1.00 72.25 ? 218 VAL C N 1 ATOM 4605 C CA . VAL C 1 218 ? 15.821 32.531 41.759 1.00 72.05 ? 218 VAL C CA 1 ATOM 4606 C C . VAL C 1 218 ? 15.218 31.132 41.952 1.00 72.99 ? 218 VAL C C 1 ATOM 4607 O O . VAL C 1 218 ? 15.504 30.188 41.200 1.00 73.37 ? 218 VAL C O 1 ATOM 4608 C CB . VAL C 1 218 ? 14.864 33.429 40.984 1.00 71.41 ? 218 VAL C CB 1 ATOM 4609 C CG1 . VAL C 1 218 ? 14.350 32.686 39.748 1.00 73.06 ? 218 VAL C CG1 1 ATOM 4610 C CG2 . VAL C 1 218 ? 13.707 33.917 41.853 1.00 70.11 ? 218 VAL C CG2 1 ATOM 4611 N N . TRP C 1 219 ? 14.381 31.021 42.975 1.00 73.55 ? 219 TRP C N 1 ATOM 4612 C CA . TRP C 1 219 ? 13.689 29.788 43.323 1.00 73.88 ? 219 TRP C CA 1 ATOM 4613 C C . TRP C 1 219 ? 12.206 30.123 43.296 1.00 73.23 ? 219 TRP C C 1 ATOM 4614 O O . TRP C 1 219 ? 11.769 31.078 43.919 1.00 73.08 ? 219 TRP C O 1 ATOM 4615 C CB . TRP C 1 219 ? 14.117 29.350 44.721 1.00 74.09 ? 219 TRP C CB 1 ATOM 4616 C CG . TRP C 1 219 ? 13.725 27.969 45.189 1.00 74.77 ? 219 TRP C CG 1 ATOM 4617 C CD1 . TRP C 1 219 ? 14.498 26.847 45.152 1.00 76.26 ? 219 TRP C CD1 1 ATOM 4618 C CD2 . TRP C 1 219 ? 12.475 27.568 45.783 1.00 75.51 ? 219 TRP C CD2 1 ATOM 4619 N NE1 . TRP C 1 219 ? 13.810 25.775 45.676 1.00 76.98 ? 219 TRP C NE1 1 ATOM 4620 C CE2 . TRP C 1 219 ? 12.568 26.189 46.071 1.00 75.33 ? 219 TRP C CE2 1 ATOM 4621 C CE3 . TRP C 1 219 ? 11.283 28.236 46.100 1.00 75.22 ? 219 TRP C CE3 1 ATOM 4622 C CZ2 . TRP C 1 219 ? 11.523 25.467 46.656 1.00 75.70 ? 219 TRP C CZ2 1 ATOM 4623 C CZ3 . TRP C 1 219 ? 10.241 27.515 46.683 1.00 75.20 ? 219 TRP C CZ3 1 ATOM 4624 C CH2 . TRP C 1 219 ? 10.372 26.146 46.955 1.00 75.08 ? 219 TRP C CH2 1 ATOM 4625 N N . VAL C 1 220 ? 11.445 29.325 42.559 1.00 72.93 ? 220 VAL C N 1 ATOM 4626 C CA . VAL C 1 220 ? 10.014 29.517 42.392 1.00 72.77 ? 220 VAL C CA 1 ATOM 4627 C C . VAL C 1 220 ? 9.380 28.131 42.289 1.00 72.83 ? 220 VAL C C 1 ATOM 4628 O O . VAL C 1 220 ? 9.816 27.310 41.504 1.00 72.52 ? 220 VAL C O 1 ATOM 4629 C CB . VAL C 1 220 ? 9.721 30.359 41.132 1.00 73.00 ? 220 VAL C CB 1 ATOM 4630 C CG1 . VAL C 1 220 ? 8.229 30.584 40.977 1.00 72.46 ? 220 VAL C CG1 1 ATOM 4631 C CG2 . VAL C 1 220 ? 10.467 31.728 41.205 1.00 73.53 ? 220 VAL C CG2 1 ATOM 4632 N N . MET C 1 221 ? 8.356 27.878 43.094 1.00 72.66 ? 221 MET C N 1 ATOM 4633 C CA . MET C 1 221 ? 7.674 26.593 43.102 1.00 72.40 ? 221 MET C CA 1 ATOM 4634 C C . MET C 1 221 ? 6.218 26.769 43.524 1.00 71.53 ? 221 MET C C 1 ATOM 4635 O O . MET C 1 221 ? 5.890 27.663 44.315 1.00 71.75 ? 221 MET C O 1 ATOM 4636 C CB . MET C 1 221 ? 8.314 25.645 44.119 1.00 72.78 ? 221 MET C CB 1 ATOM 4637 C CG . MET C 1 221 ? 9.647 25.043 43.780 1.00 75.39 ? 221 MET C CG 1 ATOM 4638 S SD . MET C 1 221 ? 9.576 23.589 42.718 1.00 80.28 ? 221 MET C SD 1 ATOM 4639 C CE . MET C 1 221 ? 8.050 22.851 43.312 1.00 78.29 ? 221 MET C CE 1 ATOM 4640 N N . TRP C 1 222 ? 5.361 25.906 42.992 1.00 70.10 ? 222 TRP C N 1 ATOM 4641 C CA . TRP C 1 222 ? 3.997 25.765 43.479 1.00 69.13 ? 222 TRP C CA 1 ATOM 4642 C C . TRP C 1 222 ? 4.045 24.797 44.672 1.00 69.69 ? 222 TRP C C 1 ATOM 4643 O O . TRP C 1 222 ? 4.786 23.810 44.629 1.00 69.66 ? 222 TRP C O 1 ATOM 4644 C CB . TRP C 1 222 ? 3.064 25.255 42.375 1.00 67.26 ? 222 TRP C CB 1 ATOM 4645 C CG . TRP C 1 222 ? 2.750 26.318 41.444 1.00 64.74 ? 222 TRP C CG 1 ATOM 4646 C CD1 . TRP C 1 222 ? 3.409 26.632 40.306 1.00 63.24 ? 222 TRP C CD1 1 ATOM 4647 C CD2 . TRP C 1 222 ? 1.686 27.249 41.569 1.00 64.88 ? 222 TRP C CD2 1 ATOM 4648 N NE1 . TRP C 1 222 ? 2.816 27.711 39.696 1.00 63.49 ? 222 TRP C NE1 1 ATOM 4649 C CE2 . TRP C 1 222 ? 1.753 28.113 40.463 1.00 64.77 ? 222 TRP C CE2 1 ATOM 4650 C CE3 . TRP C 1 222 ? 0.658 27.446 42.518 1.00 64.82 ? 222 TRP C CE3 1 ATOM 4651 C CZ2 . TRP C 1 222 ? 0.838 29.161 40.277 1.00 65.49 ? 222 TRP C CZ2 1 ATOM 4652 C CZ3 . TRP C 1 222 ? -0.245 28.481 42.324 1.00 63.06 ? 222 TRP C CZ3 1 ATOM 4653 C CH2 . TRP C 1 222 ? -0.154 29.319 41.218 1.00 64.20 ? 222 TRP C CH2 1 ATOM 4654 N N . MET C 1 223 ? 3.269 25.094 45.719 1.00 69.83 ? 223 MET C N 1 ATOM 4655 C CA . MET C 1 223 ? 3.264 24.330 46.969 1.00 70.38 ? 223 MET C CA 1 ATOM 4656 C C . MET C 1 223 ? 1.835 24.047 47.417 1.00 70.44 ? 223 MET C C 1 ATOM 4657 O O . MET C 1 223 ? 0.950 24.873 47.207 1.00 71.04 ? 223 MET C O 1 ATOM 4658 C CB . MET C 1 223 ? 3.898 25.159 48.107 1.00 70.82 ? 223 MET C CB 1 ATOM 4659 C CG . MET C 1 223 ? 5.183 25.923 47.779 1.00 72.22 ? 223 MET C CG 1 ATOM 4660 S SD . MET C 1 223 ? 6.612 24.851 47.914 1.00 74.50 ? 223 MET C SD 1 ATOM 4661 C CE . MET C 1 223 ? 6.889 24.836 49.691 1.00 72.18 ? 223 MET C CE 1 ATOM 4662 N N . ARG C 1 224 ? 1.605 22.893 48.032 1.00 70.30 ? 224 ARG C N 1 ATOM 4663 C CA . ARG C 1 224 ? 0.348 22.645 48.730 1.00 70.73 ? 224 ARG C CA 1 ATOM 4664 C C . ARG C 1 224 ? 0.776 22.477 50.178 1.00 70.59 ? 224 ARG C C 1 ATOM 4665 O O . ARG C 1 224 ? 1.111 21.374 50.609 1.00 70.82 ? 224 ARG C O 1 ATOM 4666 C CB . ARG C 1 224 ? -0.394 21.418 48.194 1.00 70.84 ? 224 ARG C CB 1 ATOM 4667 C CG . ARG C 1 224 ? -1.669 21.154 48.957 1.00 72.03 ? 224 ARG C CG 1 ATOM 4668 C CD . ARG C 1 224 ? -2.580 20.102 48.382 1.00 73.66 ? 224 ARG C CD 1 ATOM 4669 N NE . ARG C 1 224 ? -3.410 20.656 47.320 1.00 73.57 ? 224 ARG C NE 1 ATOM 4670 C CZ . ARG C 1 224 ? -3.202 20.454 46.036 1.00 72.90 ? 224 ARG C CZ 1 ATOM 4671 N NH1 . ARG C 1 224 ? -2.188 19.703 45.635 1.00 74.87 ? 224 ARG C NH1 1 ATOM 4672 N NH2 . ARG C 1 224 ? -4.011 21.000 45.145 1.00 72.57 ? 224 ARG C NH2 1 ATOM 4673 N N . GLY C 1 225 ? 0.777 23.580 50.921 1.00 69.91 ? 225 GLY C N 1 ATOM 4674 C CA . GLY C 1 225 ? 1.381 23.584 52.247 1.00 70.11 ? 225 GLY C CA 1 ATOM 4675 C C . GLY C 1 225 ? 2.902 23.623 52.196 1.00 70.02 ? 225 GLY C C 1 ATOM 4676 O O . GLY C 1 225 ? 3.478 24.471 51.521 1.00 69.96 ? 225 GLY C O 1 ATOM 4677 N N . ASP C 1 226 ? 3.553 22.708 52.913 1.00 70.38 ? 226 ASP C N 1 ATOM 4678 C CA . ASP C 1 226 ? 5.020 22.609 52.911 1.00 71.18 ? 226 ASP C CA 1 ATOM 4679 C C . ASP C 1 226 ? 5.513 21.627 51.819 1.00 71.25 ? 226 ASP C C 1 ATOM 4680 O O . ASP C 1 226 ? 6.711 21.317 51.705 1.00 71.07 ? 226 ASP C O 1 ATOM 4681 C CB . ASP C 1 226 ? 5.554 22.235 54.316 1.00 71.59 ? 226 ASP C CB 1 ATOM 4682 C CG . ASP C 1 226 ? 6.146 23.451 55.097 1.00 72.63 ? 226 ASP C CG 1 ATOM 4683 O OD1 . ASP C 1 226 ? 6.501 24.480 54.460 1.00 74.34 ? 226 ASP C OD1 1 ATOM 4684 O OD2 . ASP C 1 226 ? 6.303 23.456 56.351 1.00 71.07 ? 226 ASP C OD2 1 ATOM 4685 N N . GLN C 1 227 ? 4.557 21.155 51.024 1.00 71.42 ? 227 GLN C N 1 ATOM 4686 C CA . GLN C 1 227 ? 4.781 20.196 49.959 1.00 71.46 ? 227 GLN C CA 1 ATOM 4687 C C . GLN C 1 227 ? 5.051 20.862 48.611 1.00 71.36 ? 227 GLN C C 1 ATOM 4688 O O . GLN C 1 227 ? 4.152 21.482 48.034 1.00 70.76 ? 227 GLN C O 1 ATOM 4689 C CB . GLN C 1 227 ? 3.556 19.295 49.842 1.00 71.56 ? 227 GLN C CB 1 ATOM 4690 C CG . GLN C 1 227 ? 3.685 17.960 50.527 1.00 73.60 ? 227 GLN C CG 1 ATOM 4691 C CD . GLN C 1 227 ? 4.300 16.913 49.602 1.00 76.75 ? 227 GLN C CD 1 ATOM 4692 O OE1 . GLN C 1 227 ? 5.150 17.237 48.751 1.00 76.77 ? 227 GLN C OE1 1 ATOM 4693 N NE2 . GLN C 1 227 ? 3.871 15.651 49.760 1.00 76.60 ? 227 GLN C NE2 1 ATOM 4694 N N . GLU C 1 228 ? 6.289 20.729 48.117 1.00 71.08 ? 228 GLU C N 1 ATOM 4695 C CA . GLU C 1 228 ? 6.660 21.261 46.807 1.00 71.42 ? 228 GLU C CA 1 ATOM 4696 C C . GLU C 1 228 ? 5.896 20.430 45.781 1.00 70.32 ? 228 GLU C C 1 ATOM 4697 O O . GLU C 1 228 ? 5.835 19.214 45.912 1.00 70.49 ? 228 GLU C O 1 ATOM 4698 C CB . GLU C 1 228 ? 8.172 21.127 46.534 1.00 71.00 ? 228 GLU C CB 1 ATOM 4699 C CG . GLU C 1 228 ? 9.133 21.851 47.475 1.00 72.51 ? 228 GLU C CG 1 ATOM 4700 C CD . GLU C 1 228 ? 10.580 21.832 46.963 1.00 73.95 ? 228 GLU C CD 1 ATOM 4701 O OE1 . GLU C 1 228 ? 11.487 21.333 47.681 1.00 75.63 ? 228 GLU C OE1 1 ATOM 4702 O OE2 . GLU C 1 228 ? 10.828 22.312 45.825 1.00 77.78 ? 228 GLU C OE2 1 ATOM 4703 N N . GLN C 1 229 ? 5.311 21.085 44.775 1.00 69.52 ? 229 GLN C N 1 ATOM 4704 C CA . GLN C 1 229 ? 4.648 20.374 43.692 1.00 68.95 ? 229 GLN C CA 1 ATOM 4705 C C . GLN C 1 229 ? 5.630 20.096 42.558 1.00 69.17 ? 229 GLN C C 1 ATOM 4706 O O . GLN C 1 229 ? 5.923 20.966 41.749 1.00 68.76 ? 229 GLN C O 1 ATOM 4707 C CB . GLN C 1 229 ? 3.434 21.119 43.138 1.00 68.40 ? 229 GLN C CB 1 ATOM 4708 C CG . GLN C 1 229 ? 2.353 21.510 44.138 1.00 67.48 ? 229 GLN C CG 1 ATOM 4709 C CD . GLN C 1 229 ? 1.786 20.351 44.933 1.00 65.22 ? 229 GLN C CD 1 ATOM 4710 O OE1 . GLN C 1 229 ? 2.082 20.217 46.111 1.00 65.34 ? 229 GLN C OE1 1 ATOM 4711 N NE2 . GLN C 1 229 ? 0.978 19.519 44.301 1.00 65.54 ? 229 GLN C NE2 1 ATOM 4712 N N . GLN C 1 230 ? 6.145 18.874 42.506 1.00 69.56 ? 230 GLN C N 1 ATOM 4713 C CA . GLN C 1 230 ? 6.926 18.436 41.358 1.00 69.90 ? 230 GLN C CA 1 ATOM 4714 C C . GLN C 1 230 ? 5.910 18.429 40.236 1.00 69.63 ? 230 GLN C C 1 ATOM 4715 O O . GLN C 1 230 ? 4.749 18.083 40.459 1.00 70.28 ? 230 GLN C O 1 ATOM 4716 C CB . GLN C 1 230 ? 7.470 17.040 41.607 1.00 70.76 ? 230 GLN C CB 1 ATOM 4717 C CG . GLN C 1 230 ? 6.416 16.047 42.082 1.00 71.67 ? 230 GLN C CG 1 ATOM 4718 C CD . GLN C 1 230 ? 6.993 14.988 42.993 1.00 74.98 ? 230 GLN C CD 1 ATOM 4719 O OE1 . GLN C 1 230 ? 8.157 14.619 42.854 1.00 76.48 ? 230 GLN C OE1 1 ATOM 4720 N NE2 . GLN C 1 230 ? 6.181 14.493 43.931 1.00 74.78 ? 230 GLN C NE2 1 ATOM 4721 N N . GLY C 1 231 ? 6.317 18.810 39.038 1.00 69.51 ? 231 GLY C N 1 ATOM 4722 C CA . GLY C 1 231 ? 5.331 19.001 37.977 1.00 69.74 ? 231 GLY C CA 1 ATOM 4723 C C . GLY C 1 231 ? 5.123 20.486 37.761 1.00 70.09 ? 231 GLY C C 1 ATOM 4724 O O . GLY C 1 231 ? 4.421 20.910 36.826 1.00 69.90 ? 231 GLY C O 1 ATOM 4725 N N . THR C 1 232 ? 5.742 21.253 38.660 1.00 69.62 ? 232 THR C N 1 ATOM 4726 C CA . THR C 1 232 ? 5.939 22.675 38.512 1.00 70.34 ? 232 THR C CA 1 ATOM 4727 C C . THR C 1 232 ? 6.993 22.746 37.422 1.00 71.22 ? 232 THR C C 1 ATOM 4728 O O . THR C 1 232 ? 8.095 22.207 37.577 1.00 71.05 ? 232 THR C O 1 ATOM 4729 C CB . THR C 1 232 ? 6.534 23.262 39.807 1.00 69.59 ? 232 THR C CB 1 ATOM 4730 O OG1 . THR C 1 232 ? 5.540 23.294 40.821 1.00 66.92 ? 232 THR C OG1 1 ATOM 4731 C CG2 . THR C 1 232 ? 6.922 24.702 39.633 1.00 71.22 ? 232 THR C CG2 1 ATOM 4732 N N . HIS C 1 233 ? 6.657 23.400 36.323 1.00 72.19 ? 233 HIS C N 1 ATOM 4733 C CA . HIS C 1 233 ? 7.591 23.567 35.246 1.00 73.30 ? 233 HIS C CA 1 ATOM 4734 C C . HIS C 1 233 ? 8.060 25.046 35.157 1.00 74.13 ? 233 HIS C C 1 ATOM 4735 O O . HIS C 1 233 ? 7.248 25.972 35.064 1.00 73.56 ? 233 HIS C O 1 ATOM 4736 C CB . HIS C 1 233 ? 6.983 23.029 33.952 1.00 73.29 ? 233 HIS C CB 1 ATOM 4737 C CG . HIS C 1 233 ? 6.673 21.543 33.990 1.00 76.17 ? 233 HIS C CG 1 ATOM 4738 N ND1 . HIS C 1 233 ? 7.585 20.586 34.405 1.00 76.24 ? 233 HIS C ND1 1 ATOM 4739 C CD2 . HIS C 1 233 ? 5.549 20.856 33.653 1.00 76.24 ? 233 HIS C CD2 1 ATOM 4740 C CE1 . HIS C 1 233 ? 7.035 19.386 34.330 1.00 75.67 ? 233 HIS C CE1 1 ATOM 4741 N NE2 . HIS C 1 233 ? 5.801 19.520 33.876 1.00 74.85 ? 233 HIS C NE2 1 ATOM 4742 N N . ARG C 1 234 ? 9.376 25.250 35.203 1.00 75.18 ? 234 ARG C N 1 ATOM 4743 C CA . ARG C 1 234 ? 9.969 26.590 35.076 1.00 76.93 ? 234 ARG C CA 1 ATOM 4744 C C . ARG C 1 234 ? 10.076 26.959 33.606 1.00 76.24 ? 234 ARG C C 1 ATOM 4745 O O . ARG C 1 234 ? 10.467 26.134 32.787 1.00 75.23 ? 234 ARG C O 1 ATOM 4746 C CB . ARG C 1 234 ? 11.392 26.636 35.647 1.00 77.06 ? 234 ARG C CB 1 ATOM 4747 C CG . ARG C 1 234 ? 11.509 26.857 37.118 1.00 79.86 ? 234 ARG C CG 1 ATOM 4748 C CD . ARG C 1 234 ? 12.922 26.600 37.688 1.00 79.46 ? 234 ARG C CD 1 ATOM 4749 N NE . ARG C 1 234 ? 12.796 26.482 39.149 1.00 86.75 ? 234 ARG C NE 1 ATOM 4750 C CZ . ARG C 1 234 ? 13.396 27.253 40.070 1.00 87.00 ? 234 ARG C CZ 1 ATOM 4751 N NH1 . ARG C 1 234 ? 14.229 28.250 39.709 1.00 84.17 ? 234 ARG C NH1 1 ATOM 4752 N NH2 . ARG C 1 234 ? 13.156 26.996 41.364 1.00 84.00 ? 234 ARG C NH2 1 ATOM 4753 N N . GLY C 1 235 ? 9.729 28.203 33.284 1.00 76.32 ? 235 GLY C N 1 ATOM 4754 C CA . GLY C 1 235 ? 9.935 28.718 31.926 1.00 76.55 ? 235 GLY C CA 1 ATOM 4755 C C . GLY C 1 235 ? 11.381 29.194 31.793 1.00 76.05 ? 235 GLY C C 1 ATOM 4756 O O . GLY C 1 235 ? 12.206 28.919 32.669 1.00 76.03 ? 235 GLY C O 1 ATOM 4757 N N . ASP C 1 236 ? 11.690 29.902 30.706 1.00 75.33 ? 236 ASP C N 1 ATOM 4758 C CA . ASP C 1 236 ? 13.020 30.456 30.508 1.00 74.77 ? 236 ASP C CA 1 ATOM 4759 C C . ASP C 1 236 ? 13.129 31.848 31.148 1.00 73.99 ? 236 ASP C C 1 ATOM 4760 O O . ASP C 1 236 ? 12.121 32.534 31.374 1.00 73.31 ? 236 ASP C O 1 ATOM 4761 C CB . ASP C 1 236 ? 13.360 30.541 29.027 1.00 74.90 ? 236 ASP C CB 1 ATOM 4762 C CG . ASP C 1 236 ? 13.474 29.183 28.368 1.00 77.25 ? 236 ASP C CG 1 ATOM 4763 O OD1 . ASP C 1 236 ? 14.026 28.235 28.979 1.00 79.53 ? 236 ASP C OD1 1 ATOM 4764 O OD2 . ASP C 1 236 ? 13.034 28.979 27.221 1.00 76.28 ? 236 ASP C OD2 1 ATOM 4765 N N . PHE C 1 237 ? 14.360 32.239 31.440 1.00 73.16 ? 237 PHE C N 1 ATOM 4766 C CA . PHE C 1 237 ? 14.663 33.572 31.950 1.00 73.13 ? 237 PHE C CA 1 ATOM 4767 C C . PHE C 1 237 ? 14.493 34.579 30.820 1.00 72.46 ? 237 PHE C C 1 ATOM 4768 O O . PHE C 1 237 ? 15.235 34.527 29.852 1.00 72.58 ? 237 PHE C O 1 ATOM 4769 C CB . PHE C 1 237 ? 16.102 33.625 32.485 1.00 73.62 ? 237 PHE C CB 1 ATOM 4770 C CG . PHE C 1 237 ? 16.260 33.056 33.868 1.00 74.83 ? 237 PHE C CG 1 ATOM 4771 C CD1 . PHE C 1 237 ? 15.955 33.833 34.985 1.00 74.41 ? 237 PHE C CD1 1 ATOM 4772 C CD2 . PHE C 1 237 ? 16.712 31.747 34.053 1.00 76.43 ? 237 PHE C CD2 1 ATOM 4773 C CE1 . PHE C 1 237 ? 16.096 33.315 36.256 1.00 76.24 ? 237 PHE C CE1 1 ATOM 4774 C CE2 . PHE C 1 237 ? 16.856 31.216 35.331 1.00 76.61 ? 237 PHE C CE2 1 ATOM 4775 C CZ . PHE C 1 237 ? 16.550 31.993 36.430 1.00 76.97 ? 237 PHE C CZ 1 ATOM 4776 N N . LEU C 1 238 ? 13.522 35.482 30.939 1.00 71.86 ? 238 LEU C N 1 ATOM 4777 C CA . LEU C 1 238 ? 13.269 36.491 29.906 1.00 70.75 ? 238 LEU C CA 1 ATOM 4778 C C . LEU C 1 238 ? 13.750 37.861 30.366 1.00 71.10 ? 238 LEU C C 1 ATOM 4779 O O . LEU C 1 238 ? 13.510 38.250 31.469 1.00 70.24 ? 238 LEU C O 1 ATOM 4780 C CB . LEU C 1 238 ? 11.780 36.533 29.562 1.00 71.08 ? 238 LEU C CB 1 ATOM 4781 C CG . LEU C 1 238 ? 11.108 35.188 29.204 1.00 69.05 ? 238 LEU C CG 1 ATOM 4782 C CD1 . LEU C 1 238 ? 9.661 35.376 28.746 1.00 69.20 ? 238 LEU C CD1 1 ATOM 4783 C CD2 . LEU C 1 238 ? 11.874 34.434 28.178 1.00 67.96 ? 238 LEU C CD2 1 ATOM 4784 N N . PRO C 1 239 ? 14.432 38.607 29.513 1.00 72.16 ? 239 PRO C N 1 ATOM 4785 C CA . PRO C 1 239 ? 14.967 39.889 29.933 1.00 71.84 ? 239 PRO C CA 1 ATOM 4786 C C . PRO C 1 239 ? 13.894 40.982 30.064 1.00 72.99 ? 239 PRO C C 1 ATOM 4787 O O . PRO C 1 239 ? 12.972 41.044 29.276 1.00 72.21 ? 239 PRO C O 1 ATOM 4788 C CB . PRO C 1 239 ? 15.942 40.230 28.818 1.00 72.06 ? 239 PRO C CB 1 ATOM 4789 C CG . PRO C 1 239 ? 15.339 39.564 27.619 1.00 72.44 ? 239 PRO C CG 1 ATOM 4790 C CD . PRO C 1 239 ? 14.736 38.300 28.098 1.00 70.87 ? 239 PRO C CD 1 ATOM 4791 N N . ASN C 1 240 ? 14.028 41.828 31.081 1.00 73.14 ? 240 ASN C N 1 ATOM 4792 C CA . ASN C 1 240 ? 13.296 43.077 31.123 1.00 73.81 ? 240 ASN C CA 1 ATOM 4793 C C . ASN C 1 240 ? 14.236 44.154 30.555 1.00 74.08 ? 240 ASN C C 1 ATOM 4794 O O . ASN C 1 240 ? 15.454 43.972 30.593 1.00 73.62 ? 240 ASN C O 1 ATOM 4795 C CB . ASN C 1 240 ? 12.842 43.389 32.548 1.00 74.02 ? 240 ASN C CB 1 ATOM 4796 C CG . ASN C 1 240 ? 11.613 42.618 32.921 1.00 74.55 ? 240 ASN C CG 1 ATOM 4797 O OD1 . ASN C 1 240 ? 10.709 42.500 32.118 1.00 74.17 ? 240 ASN C OD1 1 ATOM 4798 N ND2 . ASN C 1 240 ? 11.566 42.091 34.145 1.00 77.62 ? 240 ASN C ND2 1 ATOM 4799 N N . ALA C 1 241 ? 13.669 45.250 30.036 1.00 74.28 ? 241 ALA C N 1 ATOM 4800 C CA . ALA C 1 241 ? 14.428 46.336 29.413 1.00 74.48 ? 241 ALA C CA 1 ATOM 4801 C C . ALA C 1 241 ? 15.314 47.114 30.381 1.00 75.13 ? 241 ALA C C 1 ATOM 4802 O O . ALA C 1 241 ? 16.289 47.734 29.976 1.00 75.37 ? 241 ALA C O 1 ATOM 4803 C CB . ALA C 1 241 ? 13.494 47.272 28.722 1.00 74.35 ? 241 ALA C CB 1 ATOM 4804 N N . ASP C 1 242 ? 14.973 47.083 31.665 1.00 75.93 ? 242 ASP C N 1 ATOM 4805 C CA . ASP C 1 242 ? 15.736 47.783 32.697 1.00 75.84 ? 242 ASP C CA 1 ATOM 4806 C C . ASP C 1 242 ? 16.691 46.842 33.399 1.00 75.66 ? 242 ASP C C 1 ATOM 4807 O O . ASP C 1 242 ? 16.989 47.020 34.579 1.00 76.06 ? 242 ASP C O 1 ATOM 4808 C CB . ASP C 1 242 ? 14.779 48.355 33.715 1.00 76.13 ? 242 ASP C CB 1 ATOM 4809 C CG . ASP C 1 242 ? 13.932 47.283 34.391 1.00 77.28 ? 242 ASP C CG 1 ATOM 4810 O OD1 . ASP C 1 242 ? 14.115 46.070 34.143 1.00 76.64 ? 242 ASP C OD1 1 ATOM 4811 O OD2 . ASP C 1 242 ? 13.045 47.582 35.204 1.00 79.02 ? 242 ASP C OD2 1 ATOM 4812 N N . GLU C 1 243 ? 17.160 45.835 32.674 1.00 75.35 ? 243 GLU C N 1 ATOM 4813 C CA . GLU C 1 243 ? 18.149 44.881 33.165 1.00 75.23 ? 243 GLU C CA 1 ATOM 4814 C C . GLU C 1 243 ? 17.741 43.984 34.342 1.00 75.08 ? 243 GLU C C 1 ATOM 4815 O O . GLU C 1 243 ? 18.604 43.520 35.069 1.00 76.48 ? 243 GLU C O 1 ATOM 4816 C CB . GLU C 1 243 ? 19.531 45.400 33.533 0.00 40.00 ? 243 GLU C CB 1 ATOM 4817 C CG . GLU C 1 243 ? 20.209 46.200 32.434 0.00 40.00 ? 243 GLU C CG 1 ATOM 4818 C CD . GLU C 1 243 ? 21.504 46.856 32.900 0.00 40.00 ? 243 GLU C CD 1 ATOM 4819 O OE1 . GLU C 1 243 ? 21.865 46.683 34.083 0.00 40.00 ? 243 GLU C OE1 1 ATOM 4820 O OE2 . GLU C 1 243 ? 22.152 47.543 32.082 0.00 40.00 ? 243 GLU C OE2 1 ATOM 4821 N N . THR C 1 244 ? 16.451 43.749 34.547 1.00 73.74 ? 244 THR C N 1 ATOM 4822 C CA . THR C 1 244 ? 16.020 42.761 35.529 1.00 72.80 ? 244 THR C CA 1 ATOM 4823 C C . THR C 1 244 ? 15.481 41.556 34.737 1.00 73.10 ? 244 THR C C 1 ATOM 4824 O O . THR C 1 244 ? 15.465 41.593 33.518 1.00 72.56 ? 244 THR C O 1 ATOM 4825 C CB . THR C 1 244 ? 14.975 43.325 36.491 1.00 72.28 ? 244 THR C CB 1 ATOM 4826 O OG1 . THR C 1 244 ? 13.896 43.881 35.749 1.00 71.86 ? 244 THR C OG1 1 ATOM 4827 C CG2 . THR C 1 244 ? 15.549 44.543 37.309 1.00 72.62 ? 244 THR C CG2 1 ATOM 4828 N N . TRP C 1 245 ? 15.050 40.499 35.413 1.00 72.93 ? 245 TRP C N 1 ATOM 4829 C CA . TRP C 1 245 ? 14.607 39.295 34.717 1.00 73.02 ? 245 TRP C CA 1 ATOM 4830 C C . TRP C 1 245 ? 13.164 38.934 34.987 1.00 73.52 ? 245 TRP C C 1 ATOM 4831 O O . TRP C 1 245 ? 12.596 39.308 36.014 1.00 74.21 ? 245 TRP C O 1 ATOM 4832 C CB . TRP C 1 245 ? 15.444 38.119 35.163 1.00 73.40 ? 245 TRP C CB 1 ATOM 4833 C CG . TRP C 1 245 ? 16.852 38.206 34.818 1.00 73.05 ? 245 TRP C CG 1 ATOM 4834 C CD1 . TRP C 1 245 ? 17.875 38.600 35.625 1.00 73.60 ? 245 TRP C CD1 1 ATOM 4835 C CD2 . TRP C 1 245 ? 17.426 37.884 33.562 1.00 72.95 ? 245 TRP C CD2 1 ATOM 4836 N NE1 . TRP C 1 245 ? 19.064 38.544 34.937 1.00 74.28 ? 245 TRP C NE1 1 ATOM 4837 C CE2 . TRP C 1 245 ? 18.810 38.107 33.661 1.00 73.23 ? 245 TRP C CE2 1 ATOM 4838 C CE3 . TRP C 1 245 ? 16.910 37.427 32.344 1.00 73.07 ? 245 TRP C CE3 1 ATOM 4839 C CZ2 . TRP C 1 245 ? 19.680 37.884 32.591 1.00 73.75 ? 245 TRP C CZ2 1 ATOM 4840 C CZ3 . TRP C 1 245 ? 17.775 37.214 31.291 1.00 73.01 ? 245 TRP C CZ3 1 ATOM 4841 C CH2 . TRP C 1 245 ? 19.139 37.441 31.421 1.00 72.72 ? 245 TRP C CH2 1 ATOM 4842 N N . TYR C 1 246 ? 12.581 38.195 34.055 1.00 73.52 ? 246 TYR C N 1 ATOM 4843 C CA . TYR C 1 246 ? 11.230 37.729 34.163 1.00 73.76 ? 246 TYR C CA 1 ATOM 4844 C C . TYR C 1 246 ? 11.310 36.191 34.080 1.00 74.23 ? 246 TYR C C 1 ATOM 4845 O O . TYR C 1 246 ? 12.080 35.635 33.293 1.00 73.45 ? 246 TYR C O 1 ATOM 4846 C CB . TYR C 1 246 ? 10.398 38.343 33.029 1.00 74.02 ? 246 TYR C CB 1 ATOM 4847 C CG . TYR C 1 246 ? 8.959 37.856 32.854 1.00 74.58 ? 246 TYR C CG 1 ATOM 4848 C CD1 . TYR C 1 246 ? 7.865 38.704 33.097 1.00 74.23 ? 246 TYR C CD1 1 ATOM 4849 C CD2 . TYR C 1 246 ? 8.693 36.558 32.440 1.00 75.59 ? 246 TYR C CD2 1 ATOM 4850 C CE1 . TYR C 1 246 ? 6.511 38.248 32.926 1.00 73.85 ? 246 TYR C CE1 1 ATOM 4851 C CE2 . TYR C 1 246 ? 7.345 36.086 32.268 1.00 77.08 ? 246 TYR C CE2 1 ATOM 4852 C CZ . TYR C 1 246 ? 6.280 36.935 32.513 1.00 75.55 ? 246 TYR C CZ 1 ATOM 4853 O OH . TYR C 1 246 ? 5.000 36.445 32.327 1.00 76.51 ? 246 TYR C OH 1 ATOM 4854 N N . LEU C 1 247 ? 10.515 35.520 34.914 1.00 74.36 ? 247 LEU C N 1 ATOM 4855 C CA . LEU C 1 247 ? 10.400 34.082 34.896 1.00 74.29 ? 247 LEU C CA 1 ATOM 4856 C C . LEU C 1 247 ? 8.948 33.757 35.195 1.00 74.49 ? 247 LEU C C 1 ATOM 4857 O O . LEU C 1 247 ? 8.290 34.491 35.906 1.00 75.43 ? 247 LEU C O 1 ATOM 4858 C CB . LEU C 1 247 ? 11.278 33.491 35.993 1.00 74.47 ? 247 LEU C CB 1 ATOM 4859 C CG . LEU C 1 247 ? 11.378 31.964 36.049 1.00 74.88 ? 247 LEU C CG 1 ATOM 4860 C CD1 . LEU C 1 247 ? 12.388 31.480 35.075 1.00 75.15 ? 247 LEU C CD1 1 ATOM 4861 C CD2 . LEU C 1 247 ? 11.779 31.505 37.425 1.00 76.25 ? 247 LEU C CD2 1 ATOM 4862 N N . GLN C 1 248 ? 8.444 32.666 34.646 1.00 74.02 ? 248 GLN C N 1 ATOM 4863 C CA . GLN C 1 248 ? 7.151 32.163 35.068 1.00 73.77 ? 248 GLN C CA 1 ATOM 4864 C C . GLN C 1 248 ? 7.257 30.658 35.304 1.00 73.34 ? 248 GLN C C 1 ATOM 4865 O O . GLN C 1 248 ? 8.041 29.970 34.663 1.00 72.03 ? 248 GLN C O 1 ATOM 4866 C CB . GLN C 1 248 ? 6.014 32.535 34.105 1.00 72.98 ? 248 GLN C CB 1 ATOM 4867 C CG . GLN C 1 248 ? 6.038 31.842 32.773 1.00 73.59 ? 248 GLN C CG 1 ATOM 4868 C CD . GLN C 1 248 ? 4.962 32.382 31.824 1.00 75.16 ? 248 GLN C CD 1 ATOM 4869 O OE1 . GLN C 1 248 ? 4.627 33.594 31.828 1.00 76.05 ? 248 GLN C OE1 1 ATOM 4870 N NE2 . GLN C 1 248 ? 4.422 31.493 31.010 1.00 73.91 ? 248 GLN C NE2 1 ATOM 4871 N N . ALA C 1 249 ? 6.461 30.177 36.251 1.00 73.67 ? 249 ALA C N 1 ATOM 4872 C CA . ALA C 1 249 ? 6.434 28.775 36.624 1.00 73.70 ? 249 ALA C CA 1 ATOM 4873 C C . ALA C 1 249 ? 4.974 28.362 36.550 1.00 73.93 ? 249 ALA C C 1 ATOM 4874 O O . ALA C 1 249 ? 4.107 29.083 37.069 1.00 73.96 ? 249 ALA C O 1 ATOM 4875 C CB . ALA C 1 249 ? 6.980 28.579 38.031 1.00 73.99 ? 249 ALA C CB 1 ATOM 4876 N N . THR C 1 250 ? 4.727 27.219 35.904 1.00 73.38 ? 250 THR C N 1 ATOM 4877 C CA . THR C 1 250 ? 3.397 26.693 35.674 1.00 73.63 ? 250 THR C CA 1 ATOM 4878 C C . THR C 1 250 ? 3.184 25.326 36.321 1.00 73.02 ? 250 THR C C 1 ATOM 4879 O O . THR C 1 250 ? 4.133 24.627 36.653 1.00 72.56 ? 250 THR C O 1 ATOM 4880 C CB . THR C 1 250 ? 3.103 26.549 34.169 1.00 73.83 ? 250 THR C CB 1 ATOM 4881 O OG1 . THR C 1 250 ? 4.077 25.686 33.570 1.00 76.78 ? 250 THR C OG1 1 ATOM 4882 C CG2 . THR C 1 250 ? 3.269 27.859 33.432 1.00 74.04 ? 250 THR C CG2 1 ATOM 4883 N N . LEU C 1 251 ? 1.913 24.969 36.491 1.00 72.79 ? 251 LEU C N 1 ATOM 4884 C CA . LEU C 1 251 ? 1.527 23.689 37.037 1.00 72.76 ? 251 LEU C CA 1 ATOM 4885 C C . LEU C 1 251 ? 0.163 23.355 36.501 1.00 72.82 ? 251 LEU C C 1 ATOM 4886 O O . LEU C 1 251 ? -0.752 24.191 36.529 1.00 72.56 ? 251 LEU C O 1 ATOM 4887 C CB . LEU C 1 251 ? 1.519 23.703 38.568 1.00 72.91 ? 251 LEU C CB 1 ATOM 4888 C CG . LEU C 1 251 ? 1.056 22.446 39.322 1.00 72.20 ? 251 LEU C CG 1 ATOM 4889 C CD1 . LEU C 1 251 ? 2.153 21.403 39.504 1.00 69.81 ? 251 LEU C CD1 1 ATOM 4890 C CD2 . LEU C 1 251 ? 0.459 22.859 40.676 1.00 74.52 ? 251 LEU C CD2 1 ATOM 4891 N N . ASP C 1 252 ? 0.055 22.122 36.002 1.00 73.22 ? 252 ASP C N 1 ATOM 4892 C CA . ASP C 1 252 ? -1.206 21.538 35.560 1.00 73.26 ? 252 ASP C CA 1 ATOM 4893 C C . ASP C 1 252 ? -1.999 20.979 36.721 1.00 72.63 ? 252 ASP C C 1 ATOM 4894 O O . ASP C 1 252 ? -1.459 20.282 37.577 1.00 72.15 ? 252 ASP C O 1 ATOM 4895 C CB . ASP C 1 252 ? -0.972 20.440 34.554 1.00 74.02 ? 252 ASP C CB 1 ATOM 4896 C CG . ASP C 1 252 ? -1.573 20.766 33.201 1.00 76.77 ? 252 ASP C CG 1 ATOM 4897 O OD1 . ASP C 1 252 ? -2.574 20.071 32.826 1.00 78.00 ? 252 ASP C OD1 1 ATOM 4898 O OD2 . ASP C 1 252 ? -1.118 21.689 32.470 1.00 77.12 ? 252 ASP C OD2 1 ATOM 4899 N N . VAL C 1 253 ? -3.285 21.302 36.732 1.00 72.57 ? 253 VAL C N 1 ATOM 4900 C CA . VAL C 1 253 ? -4.190 20.893 37.790 1.00 73.09 ? 253 VAL C CA 1 ATOM 4901 C C . VAL C 1 253 ? -5.539 20.507 37.227 1.00 73.98 ? 253 VAL C C 1 ATOM 4902 O O . VAL C 1 253 ? -5.989 21.057 36.225 1.00 73.75 ? 253 VAL C O 1 ATOM 4903 C CB . VAL C 1 253 ? -4.386 22.006 38.878 1.00 73.20 ? 253 VAL C CB 1 ATOM 4904 C CG1 . VAL C 1 253 ? -3.152 22.149 39.732 1.00 72.45 ? 253 VAL C CG1 1 ATOM 4905 C CG2 . VAL C 1 253 ? -4.772 23.336 38.257 1.00 72.45 ? 253 VAL C CG2 1 ATOM 4906 N N . GLU C 1 254 ? -6.171 19.544 37.889 1.00 75.54 ? 254 GLU C N 1 ATOM 4907 C CA . GLU C 1 254 ? -7.527 19.122 37.577 1.00 76.68 ? 254 GLU C CA 1 ATOM 4908 C C . GLU C 1 254 ? -8.489 20.200 38.101 1.00 77.10 ? 254 GLU C C 1 ATOM 4909 O O . GLU C 1 254 ? -8.126 21.001 38.951 1.00 76.69 ? 254 GLU C O 1 ATOM 4910 C CB . GLU C 1 254 ? -7.816 17.787 38.248 1.00 76.46 ? 254 GLU C CB 1 ATOM 4911 C CG . GLU C 1 254 ? -6.933 16.628 37.804 1.00 77.31 ? 254 GLU C CG 1 ATOM 4912 C CD . GLU C 1 254 ? -7.277 15.323 38.523 1.00 78.64 ? 254 GLU C CD 1 ATOM 4913 O OE1 . GLU C 1 254 ? -7.926 15.370 39.600 1.00 81.57 ? 254 GLU C OE1 1 ATOM 4914 O OE2 . GLU C 1 254 ? -6.905 14.231 38.020 1.00 81.64 ? 254 GLU C OE2 1 ATOM 4915 N N . ALA C 1 255 ? -9.713 20.227 37.588 1.00 78.27 ? 255 ALA C N 1 ATOM 4916 C CA . ALA C 1 255 ? -10.717 21.176 38.070 1.00 79.04 ? 255 ALA C CA 1 ATOM 4917 C C . ALA C 1 255 ? -10.989 20.878 39.537 1.00 79.42 ? 255 ALA C C 1 ATOM 4918 O O . ALA C 1 255 ? -11.420 19.769 39.888 1.00 80.04 ? 255 ALA C O 1 ATOM 4919 C CB . ALA C 1 255 ? -12.014 21.053 37.251 1.00 79.17 ? 255 ALA C CB 1 ATOM 4920 N N . GLY C 1 256 ? -10.737 21.862 40.392 1.00 79.69 ? 256 GLY C N 1 ATOM 4921 C CA . GLY C 1 256 ? -10.962 21.700 41.829 1.00 79.54 ? 256 GLY C CA 1 ATOM 4922 C C . GLY C 1 256 ? -9.757 21.072 42.492 1.00 79.28 ? 256 GLY C C 1 ATOM 4923 O O . GLY C 1 256 ? -9.884 20.290 43.433 1.00 79.84 ? 256 GLY C O 1 ATOM 4924 N N . GLU C 1 257 ? -8.585 21.416 41.982 1.00 78.47 ? 257 GLU C N 1 ATOM 4925 C CA . GLU C 1 257 ? -7.330 20.951 42.517 1.00 77.27 ? 257 GLU C CA 1 ATOM 4926 C C . GLU C 1 257 ? -6.637 22.236 42.885 1.00 76.64 ? 257 GLU C C 1 ATOM 4927 O O . GLU C 1 257 ? -5.643 22.218 43.598 1.00 76.45 ? 257 GLU C O 1 ATOM 4928 C CB . GLU C 1 257 ? -6.837 19.889 41.947 0.00 40.00 ? 257 GLU C CB 1 ATOM 4929 C CG . GLU C 1 257 ? -5.712 19.275 42.765 0.00 40.00 ? 257 GLU C CG 1 ATOM 4930 C CD . GLU C 1 257 ? -4.978 18.180 42.016 0.00 40.00 ? 257 GLU C CD 1 ATOM 4931 O OE1 . GLU C 1 257 ? -5.350 17.901 40.857 0.00 40.00 ? 257 GLU C OE1 1 ATOM 4932 O OE2 . GLU C 1 257 ? -4.031 17.600 42.589 0.00 40.00 ? 257 GLU C OE2 1 ATOM 4933 N N . GLU C 1 258 ? -7.185 23.352 42.395 1.00 76.39 ? 258 GLU C N 1 ATOM 4934 C CA . GLU C 1 258 ? -6.623 24.692 42.626 1.00 76.30 ? 258 GLU C CA 1 ATOM 4935 C C . GLU C 1 258 ? -6.627 25.170 44.075 1.00 75.50 ? 258 GLU C C 1 ATOM 4936 O O . GLU C 1 258 ? -5.692 25.872 44.504 1.00 75.26 ? 258 GLU C O 1 ATOM 4937 C CB . GLU C 1 258 ? -7.347 25.775 41.813 1.00 77.16 ? 258 GLU C CB 1 ATOM 4938 C CG . GLU C 1 258 ? -7.515 25.561 40.320 1.00 78.89 ? 258 GLU C CG 1 ATOM 4939 C CD . GLU C 1 258 ? -8.930 25.179 39.946 1.00 82.54 ? 258 GLU C CD 1 ATOM 4940 O OE1 . GLU C 1 258 ? -9.684 24.680 40.823 1.00 84.05 ? 258 GLU C OE1 1 ATOM 4941 O OE2 . GLU C 1 258 ? -9.291 25.380 38.763 1.00 83.41 ? 258 GLU C OE2 1 ATOM 4942 N N . ALA C 1 259 ? -7.679 24.806 44.815 1.00 74.46 ? 259 ALA C N 1 ATOM 4943 C CA . ALA C 1 259 ? -7.841 25.249 46.194 1.00 73.35 ? 259 ALA C CA 1 ATOM 4944 C C . ALA C 1 259 ? -6.697 24.686 47.002 1.00 72.74 ? 259 ALA C C 1 ATOM 4945 O O . ALA C 1 259 ? -6.392 23.503 46.892 1.00 72.70 ? 259 ALA C O 1 ATOM 4946 C CB . ALA C 1 259 ? -9.166 24.789 46.740 1.00 72.93 ? 259 ALA C CB 1 ATOM 4947 N N . GLY C 1 260 ? -6.061 25.534 47.804 1.00 72.07 ? 260 GLY C N 1 ATOM 4948 C CA . GLY C 1 260 ? -4.942 25.108 48.639 1.00 71.56 ? 260 GLY C CA 1 ATOM 4949 C C . GLY C 1 260 ? -3.545 25.248 48.038 1.00 71.60 ? 260 GLY C C 1 ATOM 4950 O O . GLY C 1 260 ? -2.568 24.852 48.670 1.00 71.90 ? 260 GLY C O 1 ATOM 4951 N N . LEU C 1 261 ? -3.427 25.800 46.830 1.00 71.31 ? 261 LEU C N 1 ATOM 4952 C CA . LEU C 1 261 ? -2.107 25.945 46.200 1.00 71.00 ? 261 LEU C CA 1 ATOM 4953 C C . LEU C 1 261 ? -1.557 27.356 46.353 1.00 71.16 ? 261 LEU C C 1 ATOM 4954 O O . LEU C 1 261 ? -2.312 28.329 46.380 1.00 70.79 ? 261 LEU C O 1 ATOM 4955 C CB . LEU C 1 261 ? -2.138 25.545 44.726 1.00 71.03 ? 261 LEU C CB 1 ATOM 4956 C CG . LEU C 1 261 ? -2.384 24.078 44.340 1.00 70.52 ? 261 LEU C CG 1 ATOM 4957 C CD1 . LEU C 1 261 ? -2.816 23.996 42.897 1.00 70.05 ? 261 LEU C CD1 1 ATOM 4958 C CD2 . LEU C 1 261 ? -1.148 23.247 44.572 1.00 70.38 ? 261 LEU C CD2 1 ATOM 4959 N N . ALA C 1 262 ? -0.234 27.445 46.459 1.00 71.28 ? 262 ALA C N 1 ATOM 4960 C CA . ALA C 1 262 ? 0.460 28.728 46.549 1.00 72.27 ? 262 ALA C CA 1 ATOM 4961 C C . ALA C 1 262 ? 1.795 28.704 45.794 1.00 72.74 ? 262 ALA C C 1 ATOM 4962 O O . ALA C 1 262 ? 2.389 27.650 45.592 1.00 72.26 ? 262 ALA C O 1 ATOM 4963 C CB . ALA C 1 262 ? 0.672 29.137 47.979 1.00 71.42 ? 262 ALA C CB 1 ATOM 4964 N N . CYS C 1 263 ? 2.227 29.895 45.392 1.00 73.60 ? 263 CYS C N 1 ATOM 4965 C CA . CYS C 1 263 ? 3.483 30.112 44.731 1.00 73.47 ? 263 CYS C CA 1 ATOM 4966 C C . CYS C 1 263 ? 4.437 30.663 45.770 1.00 73.31 ? 263 CYS C C 1 ATOM 4967 O O . CYS C 1 263 ? 4.134 31.646 46.397 1.00 73.39 ? 263 CYS C O 1 ATOM 4968 C CB . CYS C 1 263 ? 3.304 31.156 43.649 1.00 73.16 ? 263 CYS C CB 1 ATOM 4969 S SG . CYS C 1 263 ? 4.712 31.233 42.512 1.00 77.12 ? 263 CYS C SG 1 ATOM 4970 N N . ARG C 1 264 ? 5.586 30.028 45.952 1.00 73.10 ? 264 ARG C N 1 ATOM 4971 C CA . ARG C 1 264 ? 6.574 30.480 46.908 1.00 72.99 ? 264 ARG C CA 1 ATOM 4972 C C . ARG C 1 264 ? 7.830 30.920 46.149 1.00 72.56 ? 264 ARG C C 1 ATOM 4973 O O . ARG C 1 264 ? 8.506 30.089 45.530 1.00 71.61 ? 264 ARG C O 1 ATOM 4974 C CB . ARG C 1 264 ? 6.872 29.345 47.906 1.00 73.09 ? 264 ARG C CB 1 ATOM 4975 C CG . ARG C 1 264 ? 7.529 29.782 49.204 1.00 73.46 ? 264 ARG C CG 1 ATOM 4976 C CD . ARG C 1 264 ? 7.522 28.714 50.306 1.00 74.44 ? 264 ARG C CD 1 ATOM 4977 N NE . ARG C 1 264 ? 7.228 29.305 51.612 1.00 77.67 ? 264 ARG C NE 1 ATOM 4978 C CZ . ARG C 1 264 ? 8.140 29.736 52.473 1.00 79.34 ? 264 ARG C CZ 1 ATOM 4979 N NH1 . ARG C 1 264 ? 9.431 29.648 52.191 1.00 80.84 ? 264 ARG C NH1 1 ATOM 4980 N NH2 . ARG C 1 264 ? 7.758 30.262 53.628 1.00 81.31 ? 264 ARG C NH2 1 ATOM 4981 N N . VAL C 1 265 ? 8.138 32.218 46.186 1.00 71.81 ? 265 VAL C N 1 ATOM 4982 C CA . VAL C 1 265 ? 9.369 32.679 45.569 1.00 71.40 ? 265 VAL C CA 1 ATOM 4983 C C . VAL C 1 265 ? 10.467 33.045 46.558 1.00 70.85 ? 265 VAL C C 1 ATOM 4984 O O . VAL C 1 265 ? 10.217 33.768 47.503 1.00 71.52 ? 265 VAL C O 1 ATOM 4985 C CB . VAL C 1 265 ? 9.205 33.664 44.327 1.00 72.17 ? 265 VAL C CB 1 ATOM 4986 C CG1 . VAL C 1 265 ? 7.807 34.249 44.162 1.00 71.08 ? 265 VAL C CG1 1 ATOM 4987 C CG2 . VAL C 1 265 ? 10.364 34.683 44.221 1.00 71.72 ? 265 VAL C CG2 1 ATOM 4988 N N . LYS C 1 266 ? 11.674 32.523 46.322 1.00 69.38 ? 266 LYS C N 1 ATOM 4989 C CA . LYS C 1 266 ? 12.845 32.831 47.137 1.00 69.24 ? 266 LYS C CA 1 ATOM 4990 C C . LYS C 1 266 ? 13.881 33.599 46.297 1.00 68.88 ? 266 LYS C C 1 ATOM 4991 O O . LYS C 1 266 ? 14.242 33.173 45.207 1.00 68.96 ? 266 LYS C O 1 ATOM 4992 C CB . LYS C 1 266 ? 13.489 31.563 47.710 1.00 68.81 ? 266 LYS C CB 1 ATOM 4993 C CG . LYS C 1 266 ? 12.540 30.644 48.479 1.00 69.87 ? 266 LYS C CG 1 ATOM 4994 C CD . LYS C 1 266 ? 13.298 29.557 49.247 1.00 69.83 ? 266 LYS C CD 1 ATOM 4995 C CE . LYS C 1 266 ? 12.363 28.687 50.057 1.00 70.83 ? 266 LYS C CE 1 ATOM 4996 N NZ . LYS C 1 266 ? 13.109 27.870 51.040 1.00 71.83 ? 266 LYS C NZ 1 ATOM 4997 N N . HIS C 1 267 ? 14.353 34.736 46.804 1.00 68.27 ? 267 HIS C N 1 ATOM 4998 C CA . HIS C 1 267 ? 15.353 35.510 46.097 1.00 67.63 ? 267 HIS C CA 1 ATOM 4999 C C . HIS C 1 267 ? 16.288 36.190 47.065 1.00 68.10 ? 267 HIS C C 1 ATOM 5000 O O . HIS C 1 267 ? 15.909 36.474 48.190 1.00 68.28 ? 267 HIS C O 1 ATOM 5001 C CB . HIS C 1 267 ? 14.718 36.537 45.185 1.00 66.80 ? 267 HIS C CB 1 ATOM 5002 C CG . HIS C 1 267 ? 15.677 37.120 44.202 1.00 65.87 ? 267 HIS C CG 1 ATOM 5003 N ND1 . HIS C 1 267 ? 16.165 38.402 44.311 1.00 68.05 ? 267 HIS C ND1 1 ATOM 5004 C CD2 . HIS C 1 267 ? 16.250 36.595 43.095 1.00 67.16 ? 267 HIS C CD2 1 ATOM 5005 C CE1 . HIS C 1 267 ? 16.994 38.646 43.312 1.00 65.65 ? 267 HIS C CE1 1 ATOM 5006 N NE2 . HIS C 1 267 ? 17.061 37.565 42.559 1.00 66.95 ? 267 HIS C NE2 1 ATOM 5007 N N . SER C 1 268 ? 17.511 36.462 46.625 1.00 68.29 ? 268 SER C N 1 ATOM 5008 C CA . SER C 1 268 ? 18.497 37.054 47.513 1.00 68.68 ? 268 SER C CA 1 ATOM 5009 C C . SER C 1 268 ? 18.123 38.478 47.955 1.00 68.89 ? 268 SER C C 1 ATOM 5010 O O . SER C 1 268 ? 18.573 38.946 48.967 1.00 69.19 ? 268 SER C O 1 ATOM 5011 C CB . SER C 1 268 ? 19.876 37.011 46.857 1.00 68.17 ? 268 SER C CB 1 ATOM 5012 O OG . SER C 1 268 ? 19.807 37.509 45.544 1.00 68.12 ? 268 SER C OG 1 ATOM 5013 N N . SER C 1 269 ? 17.283 39.152 47.186 1.00 70.35 ? 269 SER C N 1 ATOM 5014 C CA . SER C 1 269 ? 16.891 40.529 47.484 1.00 70.92 ? 269 SER C CA 1 ATOM 5015 C C . SER C 1 269 ? 15.918 40.695 48.663 1.00 71.21 ? 269 SER C C 1 ATOM 5016 O O . SER C 1 269 ? 15.860 41.754 49.267 1.00 71.75 ? 269 SER C O 1 ATOM 5017 C CB . SER C 1 269 ? 16.265 41.153 46.236 1.00 70.05 ? 269 SER C CB 1 ATOM 5018 O OG . SER C 1 269 ? 15.138 40.393 45.853 1.00 71.82 ? 269 SER C OG 1 ATOM 5019 N N . LEU C 1 270 ? 15.165 39.653 48.983 1.00 71.94 ? 270 LEU C N 1 ATOM 5020 C CA . LEU C 1 270 ? 14.056 39.757 49.937 1.00 72.53 ? 270 LEU C CA 1 ATOM 5021 C C . LEU C 1 270 ? 14.430 39.637 51.404 1.00 73.19 ? 270 LEU C C 1 ATOM 5022 O O . LEU C 1 270 ? 13.568 39.734 52.287 1.00 72.21 ? 270 LEU C O 1 ATOM 5023 C CB . LEU C 1 270 ? 13.073 38.635 49.657 1.00 72.10 ? 270 LEU C CB 1 ATOM 5024 C CG . LEU C 1 270 ? 12.566 38.462 48.242 1.00 71.65 ? 270 LEU C CG 1 ATOM 5025 C CD1 . LEU C 1 270 ? 12.083 37.052 48.130 1.00 71.28 ? 270 LEU C CD1 1 ATOM 5026 C CD2 . LEU C 1 270 ? 11.478 39.476 47.982 1.00 71.41 ? 270 LEU C CD2 1 ATOM 5027 N N . GLY C 1 271 ? 15.712 39.422 51.664 1.00 74.97 ? 271 GLY C N 1 ATOM 5028 C CA . GLY C 1 271 ? 16.147 39.048 53.019 1.00 76.63 ? 271 GLY C CA 1 ATOM 5029 C C . GLY C 1 271 ? 15.602 37.631 53.107 1.00 77.50 ? 271 GLY C C 1 ATOM 5030 O O . GLY C 1 271 ? 15.621 36.892 52.104 1.00 78.85 ? 271 GLY C O 1 ATOM 5031 N N . GLY C 1 272 ? 15.106 37.229 54.265 1.00 77.59 ? 272 GLY C N 1 ATOM 5032 C CA . GLY C 1 272 ? 14.510 35.897 54.347 1.00 77.62 ? 272 GLY C CA 1 ATOM 5033 C C . GLY C 1 272 ? 12.999 35.899 54.189 1.00 77.16 ? 272 GLY C C 1 ATOM 5034 O O . GLY C 1 272 ? 12.333 34.914 54.518 1.00 77.19 ? 272 GLY C O 1 ATOM 5035 N N . GLN C 1 273 ? 12.466 37.010 53.688 1.00 76.65 ? 273 GLN C N 1 ATOM 5036 C CA . GLN C 1 273 ? 11.035 37.193 53.576 1.00 75.86 ? 273 GLN C CA 1 ATOM 5037 C C . GLN C 1 273 ? 10.556 36.658 52.238 1.00 75.24 ? 273 GLN C C 1 ATOM 5038 O O . GLN C 1 273 ? 10.307 37.431 51.332 1.00 75.41 ? 273 GLN C O 1 ATOM 5039 C CB . GLN C 1 273 ? 10.596 38.106 54.006 0.00 40.00 ? 273 GLN C CB 1 ATOM 5040 C CG . GLN C 1 273 ? 9.188 38.066 54.664 0.00 40.00 ? 273 GLN C CG 1 ATOM 5041 C CD . GLN C 1 273 ? 9.230 37.764 56.171 0.00 40.00 ? 273 GLN C CD 1 ATOM 5042 O OE1 . GLN C 1 273 ? 9.744 38.572 56.960 0.00 40.00 ? 273 GLN C OE1 1 ATOM 5043 N NE2 . GLN C 1 273 ? 8.676 36.619 56.573 0.00 40.00 ? 273 GLN C NE2 1 ATOM 5044 N N . ASP C 1 274 ? 10.430 35.339 52.129 1.00 74.91 ? 274 ASP C N 1 ATOM 5045 C CA . ASP C 1 274 ? 9.872 34.684 50.924 1.00 75.16 ? 274 ASP C CA 1 ATOM 5046 C C . ASP C 1 274 ? 8.540 35.252 50.481 1.00 75.18 ? 274 ASP C C 1 ATOM 5047 O O . ASP C 1 274 ? 7.767 35.746 51.315 1.00 74.88 ? 274 ASP C O 1 ATOM 5048 C CB . ASP C 1 274 ? 9.587 33.217 51.218 1.00 75.08 ? 274 ASP C CB 1 ATOM 5049 C CG . ASP C 1 274 ? 10.727 32.315 50.898 1.00 75.99 ? 274 ASP C CG 1 ATOM 5050 O OD1 . ASP C 1 274 ? 11.902 32.578 51.276 1.00 75.96 ? 274 ASP C OD1 1 ATOM 5051 O OD2 . ASP C 1 274 ? 10.511 31.276 50.250 1.00 78.77 ? 274 ASP C OD2 1 ATOM 5052 N N . ILE C 1 275 ? 8.263 35.170 49.176 1.00 75.59 ? 275 ILE C N 1 ATOM 5053 C CA . ILE C 1 275 ? 6.954 35.603 48.643 1.00 75.79 ? 275 ILE C CA 1 ATOM 5054 C C . ILE C 1 275 ? 5.969 34.443 48.498 1.00 76.02 ? 275 ILE C C 1 ATOM 5055 O O . ILE C 1 275 ? 6.238 33.474 47.790 1.00 76.83 ? 275 ILE C O 1 ATOM 5056 C CB . ILE C 1 275 ? 7.069 36.407 47.295 1.00 75.59 ? 275 ILE C CB 1 ATOM 5057 C CG1 . ILE C 1 275 ? 7.918 37.674 47.509 1.00 75.16 ? 275 ILE C CG1 1 ATOM 5058 C CG2 . ILE C 1 275 ? 5.663 36.764 46.808 1.00 73.37 ? 275 ILE C CG2 1 ATOM 5059 C CD1 . ILE C 1 275 ? 7.970 38.610 46.338 1.00 76.02 ? 275 ILE C CD1 1 ATOM 5060 N N . ILE C 1 276 ? 4.828 34.531 49.168 1.00 75.64 ? 276 ILE C N 1 ATOM 5061 C CA . ILE C 1 276 ? 3.840 33.465 49.046 1.00 75.25 ? 276 ILE C CA 1 ATOM 5062 C C . ILE C 1 276 ? 2.514 34.021 48.582 1.00 74.57 ? 276 ILE C C 1 ATOM 5063 O O . ILE C 1 276 ? 1.936 34.884 49.254 1.00 75.40 ? 276 ILE C O 1 ATOM 5064 C CB . ILE C 1 276 ? 3.664 32.655 50.346 1.00 74.90 ? 276 ILE C CB 1 ATOM 5065 C CG1 . ILE C 1 276 ? 5.015 32.380 51.020 1.00 75.31 ? 276 ILE C CG1 1 ATOM 5066 C CG2 . ILE C 1 276 ? 2.962 31.365 50.012 1.00 75.83 ? 276 ILE C CG2 1 ATOM 5067 C CD1 . ILE C 1 276 ? 4.945 31.687 52.376 1.00 75.15 ? 276 ILE C CD1 1 ATOM 5068 N N . LEU C 1 277 ? 2.050 33.527 47.437 1.00 73.34 ? 277 LEU C N 1 ATOM 5069 C CA . LEU C 1 277 ? 0.788 33.966 46.863 1.00 72.90 ? 277 LEU C CA 1 ATOM 5070 C C . LEU C 1 277 ? -0.107 32.787 46.747 1.00 72.53 ? 277 LEU C C 1 ATOM 5071 O O . LEU C 1 277 ? 0.258 31.791 46.153 1.00 72.21 ? 277 LEU C O 1 ATOM 5072 C CB . LEU C 1 277 ? 0.950 34.599 45.490 1.00 72.60 ? 277 LEU C CB 1 ATOM 5073 C CG . LEU C 1 277 ? 1.808 35.863 45.386 1.00 74.19 ? 277 LEU C CG 1 ATOM 5074 C CD1 . LEU C 1 277 ? 2.180 36.047 43.956 1.00 75.14 ? 277 LEU C CD1 1 ATOM 5075 C CD2 . LEU C 1 277 ? 1.085 37.083 45.917 1.00 75.65 ? 277 LEU C CD2 1 ATOM 5076 N N . TYR C 1 278 ? -1.292 32.934 47.331 1.00 72.51 ? 278 TYR C N 1 ATOM 5077 C CA . TYR C 1 278 ? -2.300 31.900 47.388 1.00 72.87 ? 278 TYR C CA 1 ATOM 5078 C C . TYR C 1 278 ? -3.288 32.034 46.247 1.00 73.32 ? 278 TYR C C 1 ATOM 5079 O O . TYR C 1 278 ? -3.883 33.091 46.030 1.00 73.76 ? 278 TYR C O 1 ATOM 5080 C CB . TYR C 1 278 ? -3.025 31.918 48.744 1.00 71.77 ? 278 TYR C CB 1 ATOM 5081 C CG . TYR C 1 278 ? -2.068 31.946 49.903 1.00 70.44 ? 278 TYR C CG 1 ATOM 5082 C CD1 . TYR C 1 278 ? -1.637 33.157 50.421 1.00 70.58 ? 278 TYR C CD1 1 ATOM 5083 C CD2 . TYR C 1 278 ? -1.581 30.764 50.480 1.00 68.98 ? 278 TYR C CD2 1 ATOM 5084 C CE1 . TYR C 1 278 ? -0.753 33.207 51.477 1.00 70.62 ? 278 TYR C CE1 1 ATOM 5085 C CE2 . TYR C 1 278 ? -0.694 30.802 51.544 1.00 67.78 ? 278 TYR C CE2 1 ATOM 5086 C CZ . TYR C 1 278 ? -0.287 32.030 52.033 1.00 70.60 ? 278 TYR C CZ 1 ATOM 5087 O OH . TYR C 1 278 ? 0.591 32.137 53.087 1.00 73.36 ? 278 TYR C OH 1 ATOM 5088 N N . TRP C 1 279 ? -3.450 30.939 45.523 1.00 73.77 ? 279 TRP C N 1 ATOM 5089 C CA . TRP C 1 279 ? -4.454 30.874 44.480 1.00 74.14 ? 279 TRP C CA 1 ATOM 5090 C C . TRP C 1 279 ? -5.854 30.947 45.121 1.00 74.83 ? 279 TRP C C 1 ATOM 5091 O O . TRP C 1 279 ? -6.680 31.817 44.806 1.00 75.38 ? 279 TRP C O 1 ATOM 5092 C CB . TRP C 1 279 ? -4.274 29.610 43.615 1.00 73.80 ? 279 TRP C CB 1 ATOM 5093 C CG . TRP C 1 279 ? -5.302 29.586 42.540 1.00 73.50 ? 279 TRP C CG 1 ATOM 5094 C CD1 . TRP C 1 279 ? -6.436 28.855 42.519 1.00 73.59 ? 279 TRP C CD1 1 ATOM 5095 C CD2 . TRP C 1 279 ? -5.297 30.350 41.336 1.00 73.04 ? 279 TRP C CD2 1 ATOM 5096 N NE1 . TRP C 1 279 ? -7.146 29.106 41.371 1.00 73.49 ? 279 TRP C NE1 1 ATOM 5097 C CE2 . TRP C 1 279 ? -6.466 30.026 40.627 1.00 72.79 ? 279 TRP C CE2 1 ATOM 5098 C CE3 . TRP C 1 279 ? -4.420 31.282 40.781 1.00 74.19 ? 279 TRP C CE3 1 ATOM 5099 C CZ2 . TRP C 1 279 ? -6.778 30.589 39.401 1.00 73.01 ? 279 TRP C CZ2 1 ATOM 5100 C CZ3 . TRP C 1 279 ? -4.734 31.841 39.564 1.00 74.05 ? 279 TRP C CZ3 1 ATOM 5101 C CH2 . TRP C 1 279 ? -5.904 31.491 38.886 1.00 73.92 ? 279 TRP C CH2 1 ATOM 5102 N N . GLN D 2 2 ? 19.580 28.274 8.487 1.00 82.84 ? 2 GLN D N 1 ATOM 5103 C CA . GLN D 2 2 ? 18.339 29.108 8.634 1.00 83.12 ? 2 GLN D CA 1 ATOM 5104 C C . GLN D 2 2 ? 17.386 28.636 9.772 1.00 81.98 ? 2 GLN D C 1 ATOM 5105 O O . GLN D 2 2 ? 16.691 27.625 9.634 1.00 82.20 ? 2 GLN D O 1 ATOM 5106 C CB . GLN D 2 2 ? 17.604 29.191 7.274 1.00 82.99 ? 2 GLN D CB 1 ATOM 5107 C CG . GLN D 2 2 ? 16.603 30.353 7.180 1.00 84.01 ? 2 GLN D CG 1 ATOM 5108 C CD . GLN D 2 2 ? 16.075 30.620 5.758 1.00 84.19 ? 2 GLN D CD 1 ATOM 5109 O OE1 . GLN D 2 2 ? 15.329 29.809 5.168 1.00 84.51 ? 2 GLN D OE1 1 ATOM 5110 N NE2 . GLN D 2 2 ? 16.458 31.770 5.212 1.00 84.39 ? 2 GLN D NE2 1 ATOM 5111 N N . LYS D 2 3 ? 17.361 29.374 10.883 1.00 81.09 ? 3 LYS D N 1 ATOM 5112 C CA . LYS D 2 3 ? 16.501 29.053 12.030 1.00 79.64 ? 3 LYS D CA 1 ATOM 5113 C C . LYS D 2 3 ? 15.329 30.040 12.230 1.00 79.13 ? 3 LYS D C 1 ATOM 5114 O O . LYS D 2 3 ? 15.515 31.261 12.164 1.00 78.43 ? 3 LYS D O 1 ATOM 5115 C CB . LYS D 2 3 ? 17.622 29.258 13.006 0.00 40.00 ? 3 LYS D CB 1 ATOM 5116 C CG . LYS D 2 3 ? 18.484 27.984 13.167 0.00 40.00 ? 3 LYS D CG 1 ATOM 5117 C CD . LYS D 2 3 ? 19.592 28.075 14.249 0.00 40.00 ? 3 LYS D CD 1 ATOM 5118 C CE . LYS D 2 3 ? 20.942 28.664 13.705 0.00 40.00 ? 3 LYS D CE 1 ATOM 5119 N NZ . LYS D 2 3 ? 21.560 27.937 12.514 0.00 40.00 ? 3 LYS D NZ 1 ATOM 5120 N N . THR D 2 4 ? 14.133 29.488 12.480 1.00 78.01 ? 4 THR D N 1 ATOM 5121 C CA . THR D 2 4 ? 12.874 30.252 12.696 1.00 77.12 ? 4 THR D CA 1 ATOM 5122 C C . THR D 2 4 ? 12.738 30.930 14.082 1.00 76.00 ? 4 THR D C 1 ATOM 5123 O O . THR D 2 4 ? 12.833 30.254 15.114 1.00 76.59 ? 4 THR D O 1 ATOM 5124 C CB . THR D 2 4 ? 11.626 29.340 12.461 1.00 77.38 ? 4 THR D CB 1 ATOM 5125 O OG1 . THR D 2 4 ? 10.430 30.123 12.558 1.00 77.50 ? 4 THR D OG1 1 ATOM 5126 C CG2 . THR D 2 4 ? 11.457 28.312 13.601 1.00 77.68 ? 4 THR D CG2 1 ATOM 5127 N N . PRO D 2 5 ? 12.510 32.244 14.105 1.00 74.40 ? 5 PRO D N 1 ATOM 5128 C CA . PRO D 2 5 ? 12.372 32.968 15.361 1.00 73.71 ? 5 PRO D CA 1 ATOM 5129 C C . PRO D 2 5 ? 11.148 32.550 16.216 1.00 73.58 ? 5 PRO D C 1 ATOM 5130 O O . PRO D 2 5 ? 10.064 32.263 15.689 1.00 73.46 ? 5 PRO D O 1 ATOM 5131 C CB . PRO D 2 5 ? 12.250 34.430 14.905 1.00 73.20 ? 5 PRO D CB 1 ATOM 5132 C CG . PRO D 2 5 ? 11.764 34.353 13.500 1.00 73.09 ? 5 PRO D CG 1 ATOM 5133 C CD . PRO D 2 5 ? 12.377 33.142 12.938 1.00 73.95 ? 5 PRO D CD 1 ATOM 5134 N N . GLN D 2 6 ? 11.382 32.514 17.520 1.00 72.91 ? 6 GLN D N 1 ATOM 5135 C CA . GLN D 2 6 ? 10.409 32.293 18.553 1.00 73.01 ? 6 GLN D CA 1 ATOM 5136 C C . GLN D 2 6 ? 10.095 33.688 19.118 1.00 72.81 ? 6 GLN D C 1 ATOM 5137 O O . GLN D 2 6 ? 10.987 34.535 19.202 1.00 71.55 ? 6 GLN D O 1 ATOM 5138 C CB . GLN D 2 6 ? 11.072 31.463 19.632 1.00 73.64 ? 6 GLN D CB 1 ATOM 5139 C CG . GLN D 2 6 ? 10.130 30.534 20.403 1.00 79.03 ? 6 GLN D CG 1 ATOM 5140 C CD . GLN D 2 6 ? 10.730 30.093 21.740 1.00 82.93 ? 6 GLN D CD 1 ATOM 5141 O OE1 . GLN D 2 6 ? 11.194 28.938 21.877 1.00 82.42 ? 6 GLN D OE1 1 ATOM 5142 N NE2 . GLN D 2 6 ? 10.733 31.006 22.721 1.00 76.46 ? 6 GLN D NE2 1 ATOM 5143 N N . ILE D 2 7 ? 8.842 33.934 19.496 1.00 72.21 ? 7 ILE D N 1 ATOM 5144 C CA . ILE D 2 7 ? 8.445 35.231 20.038 1.00 72.24 ? 7 ILE D CA 1 ATOM 5145 C C . ILE D 2 7 ? 7.771 35.025 21.378 1.00 72.25 ? 7 ILE D C 1 ATOM 5146 O O . ILE D 2 7 ? 6.907 34.192 21.511 1.00 71.69 ? 7 ILE D O 1 ATOM 5147 C CB . ILE D 2 7 ? 7.456 35.954 19.086 1.00 72.86 ? 7 ILE D CB 1 ATOM 5148 C CG1 . ILE D 2 7 ? 8.047 36.115 17.678 1.00 74.49 ? 7 ILE D CG1 1 ATOM 5149 C CG2 . ILE D 2 7 ? 7.014 37.306 19.664 1.00 71.66 ? 7 ILE D CG2 1 ATOM 5150 C CD1 . ILE D 2 7 ? 6.991 36.257 16.605 1.00 77.19 ? 7 ILE D CD1 1 ATOM 5151 N N . GLN D 2 8 ? 8.168 35.784 22.392 1.00 73.18 ? 8 GLN D N 1 ATOM 5152 C CA . GLN D 2 8 ? 7.470 35.697 23.666 1.00 73.39 ? 8 GLN D CA 1 ATOM 5153 C C . GLN D 2 8 ? 7.109 37.131 23.988 1.00 73.85 ? 8 GLN D C 1 ATOM 5154 O O . GLN D 2 8 ? 7.979 37.991 23.971 1.00 74.23 ? 8 GLN D O 1 ATOM 5155 C CB . GLN D 2 8 ? 8.337 35.004 24.731 1.00 72.71 ? 8 GLN D CB 1 ATOM 5156 C CG . GLN D 2 8 ? 8.745 33.599 24.333 1.00 73.40 ? 8 GLN D CG 1 ATOM 5157 C CD . GLN D 2 8 ? 9.770 32.960 25.261 1.00 73.83 ? 8 GLN D CD 1 ATOM 5158 O OE1 . GLN D 2 8 ? 10.984 32.889 24.937 1.00 72.69 ? 8 GLN D OE1 1 ATOM 5159 N NE2 . GLN D 2 8 ? 9.302 32.498 26.408 1.00 72.90 ? 8 GLN D NE2 1 ATOM 5160 N N . VAL D 2 9 ? 5.822 37.366 24.253 1.00 73.60 ? 9 VAL D N 1 ATOM 5161 C CA . VAL D 2 9 ? 5.303 38.673 24.626 1.00 73.40 ? 9 VAL D CA 1 ATOM 5162 C C . VAL D 2 9 ? 4.900 38.593 26.102 1.00 72.54 ? 9 VAL D C 1 ATOM 5163 O O . VAL D 2 9 ? 4.221 37.650 26.496 1.00 72.19 ? 9 VAL D O 1 ATOM 5164 C CB . VAL D 2 9 ? 4.085 39.114 23.759 1.00 73.66 ? 9 VAL D CB 1 ATOM 5165 C CG1 . VAL D 2 9 ? 3.658 40.519 24.132 1.00 75.25 ? 9 VAL D CG1 1 ATOM 5166 C CG2 . VAL D 2 9 ? 4.441 39.120 22.312 1.00 74.35 ? 9 VAL D CG2 1 ATOM 5167 N N . TYR D 2 10 ? 5.319 39.569 26.910 1.00 69.97 ? 10 TYR D N 1 ATOM 5168 C CA . TYR D 2 10 ? 5.094 39.523 28.353 1.00 68.67 ? 10 TYR D CA 1 ATOM 5169 C C . TYR D 2 10 ? 5.223 40.925 28.938 1.00 69.03 ? 10 TYR D C 1 ATOM 5170 O O . TYR D 2 10 ? 5.776 41.800 28.313 1.00 69.90 ? 10 TYR D O 1 ATOM 5171 C CB . TYR D 2 10 ? 6.069 38.566 29.051 1.00 67.72 ? 10 TYR D CB 1 ATOM 5172 C CG . TYR D 2 10 ? 7.511 38.869 28.738 1.00 66.06 ? 10 TYR D CG 1 ATOM 5173 C CD1 . TYR D 2 10 ? 8.085 38.462 27.530 1.00 65.70 ? 10 TYR D CD1 1 ATOM 5174 C CD2 . TYR D 2 10 ? 8.309 39.564 29.652 1.00 66.27 ? 10 TYR D CD2 1 ATOM 5175 C CE1 . TYR D 2 10 ? 9.412 38.744 27.234 1.00 67.08 ? 10 TYR D CE1 1 ATOM 5176 C CE2 . TYR D 2 10 ? 9.635 39.848 29.375 1.00 64.90 ? 10 TYR D CE2 1 ATOM 5177 C CZ . TYR D 2 10 ? 10.189 39.443 28.158 1.00 68.18 ? 10 TYR D CZ 1 ATOM 5178 O OH . TYR D 2 10 ? 11.496 39.722 27.861 1.00 64.21 ? 10 TYR D OH 1 ATOM 5179 N N . SER D 2 11 ? 4.713 41.106 30.143 1.00 69.59 ? 11 SER D N 1 ATOM 5180 C CA . SER D 2 11 ? 4.613 42.397 30.802 1.00 70.83 ? 11 SER D CA 1 ATOM 5181 C C . SER D 2 11 ? 5.726 42.626 31.819 1.00 70.80 ? 11 SER D C 1 ATOM 5182 O O . SER D 2 11 ? 6.232 41.665 32.424 1.00 70.67 ? 11 SER D O 1 ATOM 5183 C CB . SER D 2 11 ? 3.284 42.418 31.532 1.00 70.81 ? 11 SER D CB 1 ATOM 5184 O OG . SER D 2 11 ? 2.792 43.723 31.503 1.00 75.89 ? 11 SER D OG 1 ATOM 5185 N N . ARG D 2 12 ? 6.104 43.890 32.020 1.00 70.98 ? 12 ARG D N 1 ATOM 5186 C CA . ARG D 2 12 ? 7.143 44.209 32.992 1.00 70.96 ? 12 ARG D CA 1 ATOM 5187 C C . ARG D 2 12 ? 6.565 44.105 34.373 1.00 70.94 ? 12 ARG D C 1 ATOM 5188 O O . ARG D 2 12 ? 7.190 43.540 35.258 1.00 71.07 ? 12 ARG D O 1 ATOM 5189 C CB . ARG D 2 12 ? 7.736 45.602 32.784 1.00 70.95 ? 12 ARG D CB 1 ATOM 5190 C CG . ARG D 2 12 ? 9.202 45.653 33.094 1.00 72.47 ? 12 ARG D CG 1 ATOM 5191 C CD . ARG D 2 12 ? 9.616 46.308 34.378 1.00 77.32 ? 12 ARG D CD 1 ATOM 5192 N NE . ARG D 2 12 ? 9.739 45.402 35.513 1.00 79.84 ? 12 ARG D NE 1 ATOM 5193 C CZ . ARG D 2 12 ? 10.551 45.598 36.536 1.00 77.93 ? 12 ARG D CZ 1 ATOM 5194 N NH1 . ARG D 2 12 ? 11.326 46.654 36.582 1.00 80.09 ? 12 ARG D NH1 1 ATOM 5195 N NH2 . ARG D 2 12 ? 10.598 44.735 37.524 1.00 78.60 ? 12 ARG D NH2 1 ATOM 5196 N N . HIS D 2 13 ? 5.364 44.654 34.541 1.00 70.75 ? 13 HIS D N 1 ATOM 5197 C CA . HIS D 2 13 ? 4.653 44.656 35.811 1.00 70.64 ? 13 HIS D CA 1 ATOM 5198 C C . HIS D 2 13 ? 3.405 43.816 35.705 1.00 71.11 ? 13 HIS D C 1 ATOM 5199 O O . HIS D 2 13 ? 3.001 43.452 34.606 1.00 71.48 ? 13 HIS D O 1 ATOM 5200 C CB . HIS D 2 13 ? 4.296 46.087 36.213 1.00 70.00 ? 13 HIS D CB 1 ATOM 5201 C CG . HIS D 2 13 ? 5.468 47.007 36.196 1.00 69.16 ? 13 HIS D CG 1 ATOM 5202 N ND1 . HIS D 2 13 ? 6.454 46.972 37.158 1.00 68.37 ? 13 HIS D ND1 1 ATOM 5203 C CD2 . HIS D 2 13 ? 5.819 47.987 35.330 1.00 68.24 ? 13 HIS D CD2 1 ATOM 5204 C CE1 . HIS D 2 13 ? 7.360 47.893 36.885 1.00 67.80 ? 13 HIS D CE1 1 ATOM 5205 N NE2 . HIS D 2 13 ? 6.996 48.522 35.782 1.00 68.08 ? 13 HIS D NE2 1 ATOM 5206 N N . PRO D 2 14 ? 2.800 43.485 36.838 1.00 71.48 ? 14 PRO D N 1 ATOM 5207 C CA . PRO D 2 14 ? 1.500 42.832 36.824 1.00 71.55 ? 14 PRO D CA 1 ATOM 5208 C C . PRO D 2 14 ? 0.539 43.748 36.076 1.00 71.49 ? 14 PRO D C 1 ATOM 5209 O O . PRO D 2 14 ? 0.384 44.905 36.442 1.00 71.21 ? 14 PRO D O 1 ATOM 5210 C CB . PRO D 2 14 ? 1.122 42.743 38.310 1.00 71.73 ? 14 PRO D CB 1 ATOM 5211 C CG . PRO D 2 14 ? 2.435 42.806 39.050 1.00 71.52 ? 14 PRO D CG 1 ATOM 5212 C CD . PRO D 2 14 ? 3.310 43.697 38.210 1.00 71.89 ? 14 PRO D CD 1 ATOM 5213 N N . PRO D 2 15 ? -0.098 43.242 35.025 1.00 71.86 ? 15 PRO D N 1 ATOM 5214 C CA . PRO D 2 15 ? -0.976 44.075 34.220 1.00 71.87 ? 15 PRO D CA 1 ATOM 5215 C C . PRO D 2 15 ? -2.283 44.392 34.933 1.00 72.19 ? 15 PRO D C 1 ATOM 5216 O O . PRO D 2 15 ? -2.967 43.494 35.402 1.00 72.25 ? 15 PRO D O 1 ATOM 5217 C CB . PRO D 2 15 ? -1.212 43.230 32.962 1.00 72.22 ? 15 PRO D CB 1 ATOM 5218 C CG . PRO D 2 15 ? -0.869 41.845 33.323 1.00 72.11 ? 15 PRO D CG 1 ATOM 5219 C CD . PRO D 2 15 ? -0.029 41.852 34.537 1.00 71.33 ? 15 PRO D CD 1 ATOM 5220 N N . GLU D 2 16 ? -2.616 45.676 35.019 1.00 72.48 ? 16 GLU D N 1 ATOM 5221 C CA . GLU D 2 16 ? -3.879 46.106 35.592 1.00 72.35 ? 16 GLU D CA 1 ATOM 5222 C C . GLU D 2 16 ? -4.466 47.088 34.605 1.00 72.41 ? 16 GLU D C 1 ATOM 5223 O O . GLU D 2 16 ? -3.773 47.994 34.164 1.00 73.25 ? 16 GLU D O 1 ATOM 5224 C CB . GLU D 2 16 ? -3.472 46.836 37.066 0.00 40.00 ? 16 GLU D CB 1 ATOM 5225 C CG . GLU D 2 16 ? -4.556 47.846 37.493 0.00 40.00 ? 16 GLU D CG 1 ATOM 5226 C CD . GLU D 2 16 ? -4.586 48.163 39.000 0.00 40.00 ? 16 GLU D CD 1 ATOM 5227 O OE1 . GLU D 2 16 ? -3.699 48.919 39.504 0.00 40.00 ? 16 GLU D OE1 1 ATOM 5228 O OE2 . GLU D 2 16 ? -5.523 47.672 39.697 0.00 40.00 ? 16 GLU D OE2 1 ATOM 5229 N N . ASN D 2 17 ? -5.737 46.907 34.266 1.00 72.40 ? 17 ASN D N 1 ATOM 5230 C CA . ASN D 2 17 ? -6.433 47.785 33.327 1.00 72.38 ? 17 ASN D CA 1 ATOM 5231 C C . ASN D 2 17 ? -6.368 49.255 33.743 1.00 72.39 ? 17 ASN D C 1 ATOM 5232 O O . ASN D 2 17 ? -6.531 49.584 34.917 1.00 72.02 ? 17 ASN D O 1 ATOM 5233 C CB . ASN D 2 17 ? -7.874 47.321 33.139 1.00 72.24 ? 17 ASN D CB 1 ATOM 5234 C CG . ASN D 2 17 ? -7.956 45.963 32.462 1.00 72.22 ? 17 ASN D CG 1 ATOM 5235 O OD1 . ASN D 2 17 ? -7.014 45.523 31.827 1.00 71.19 ? 17 ASN D OD1 1 ATOM 5236 N ND2 . ASN D 2 17 ? -9.082 45.302 32.598 1.00 71.89 ? 17 ASN D ND2 1 ATOM 5237 N N . GLY D 2 18 ? -6.116 50.126 32.772 1.00 72.47 ? 18 GLY D N 1 ATOM 5238 C CA . GLY D 2 18 ? -5.911 51.559 33.053 1.00 72.18 ? 18 GLY D CA 1 ATOM 5239 C C . GLY D 2 18 ? -4.576 51.942 33.680 1.00 71.45 ? 18 GLY D C 1 ATOM 5240 O O . GLY D 2 18 ? -4.303 53.132 33.858 1.00 71.97 ? 18 GLY D O 1 ATOM 5241 N N . LYS D 2 19 ? -3.739 50.962 34.012 1.00 70.95 ? 19 LYS D N 1 ATOM 5242 C CA . LYS D 2 19 ? -2.457 51.225 34.684 1.00 70.06 ? 19 LYS D CA 1 ATOM 5243 C C . LYS D 2 19 ? -1.227 51.058 33.770 1.00 69.81 ? 19 LYS D C 1 ATOM 5244 O O . LYS D 2 19 ? -0.972 49.949 33.249 1.00 69.78 ? 19 LYS D O 1 ATOM 5245 C CB . LYS D 2 19 ? -2.290 50.368 36.097 0.00 40.00 ? 19 LYS D CB 1 ATOM 5246 C CG . LYS D 2 19 ? -0.960 50.477 36.891 0.00 40.00 ? 19 LYS D CG 1 ATOM 5247 C CD . LYS D 2 19 ? -1.037 49.713 38.229 0.00 40.00 ? 19 LYS D CD 1 ATOM 5248 C CE . LYS D 2 19 ? 0.341 49.452 38.870 0.00 40.00 ? 19 LYS D CE 1 ATOM 5249 N NZ . LYS D 2 19 ? 0.869 50.603 39.677 0.00 40.00 ? 19 LYS D NZ 1 ATOM 5250 N N . PRO D 2 20 ? -0.480 52.160 33.590 1.00 68.91 ? 20 PRO D N 1 ATOM 5251 C CA . PRO D 2 20 ? 0.744 52.201 32.778 1.00 67.77 ? 20 PRO D CA 1 ATOM 5252 C C . PRO D 2 20 ? 1.738 51.089 33.089 1.00 67.31 ? 20 PRO D C 1 ATOM 5253 O O . PRO D 2 20 ? 2.176 50.918 34.240 1.00 66.40 ? 20 PRO D O 1 ATOM 5254 C CB . PRO D 2 20 ? 1.366 53.555 33.153 1.00 68.02 ? 20 PRO D CB 1 ATOM 5255 C CG . PRO D 2 20 ? 0.204 54.418 33.524 1.00 68.12 ? 20 PRO D CG 1 ATOM 5256 C CD . PRO D 2 20 ? -0.786 53.478 34.180 1.00 68.83 ? 20 PRO D CD 1 ATOM 5257 N N . ASN D 2 21 ? 2.096 50.345 32.049 1.00 66.65 ? 21 ASN D N 1 ATOM 5258 C CA . ASN D 2 21 ? 3.012 49.211 32.166 1.00 66.85 ? 21 ASN D CA 1 ATOM 5259 C C . ASN D 2 21 ? 3.996 49.323 30.981 1.00 66.21 ? 21 ASN D C 1 ATOM 5260 O O . ASN D 2 21 ? 4.039 50.352 30.302 1.00 65.97 ? 21 ASN D O 1 ATOM 5261 C CB . ASN D 2 21 ? 2.180 47.897 32.150 1.00 66.24 ? 21 ASN D CB 1 ATOM 5262 C CG . ASN D 2 21 ? 2.844 46.736 32.888 1.00 68.07 ? 21 ASN D CG 1 ATOM 5263 O OD1 . ASN D 2 21 ? 4.055 46.568 32.879 1.00 69.42 ? 21 ASN D OD1 1 ATOM 5264 N ND2 . ASN D 2 21 ? 2.031 45.921 33.525 1.00 69.03 ? 21 ASN D ND2 1 ATOM 5265 N N . ILE D 2 22 ? 4.776 48.277 30.754 1.00 64.96 ? 22 ILE D N 1 ATOM 5266 C CA . ILE D 2 22 ? 5.663 48.163 29.613 1.00 64.65 ? 22 ILE D CA 1 ATOM 5267 C C . ILE D 2 22 ? 5.491 46.714 29.134 1.00 65.42 ? 22 ILE D C 1 ATOM 5268 O O . ILE D 2 22 ? 5.478 45.799 29.950 1.00 63.55 ? 22 ILE D O 1 ATOM 5269 C CB . ILE D 2 22 ? 7.117 48.407 29.996 1.00 64.54 ? 22 ILE D CB 1 ATOM 5270 C CG1 . ILE D 2 22 ? 7.341 49.865 30.470 1.00 66.77 ? 22 ILE D CG1 1 ATOM 5271 C CG2 . ILE D 2 22 ? 8.060 48.121 28.823 1.00 62.71 ? 22 ILE D CG2 1 ATOM 5272 C CD1 . ILE D 2 22 ? 8.632 50.014 31.166 1.00 68.17 ? 22 ILE D CD1 1 ATOM 5273 N N . LEU D 2 23 ? 5.352 46.566 27.815 1.00 66.86 ? 23 LEU D N 1 ATOM 5274 C CA . LEU D 2 23 ? 5.180 45.270 27.124 1.00 68.18 ? 23 LEU D CA 1 ATOM 5275 C C . LEU D 2 23 ? 6.500 45.007 26.391 1.00 69.25 ? 23 LEU D C 1 ATOM 5276 O O . LEU D 2 23 ? 6.996 45.863 25.662 1.00 68.63 ? 23 LEU D O 1 ATOM 5277 C CB . LEU D 2 23 ? 3.961 45.285 26.166 1.00 66.97 ? 23 LEU D CB 1 ATOM 5278 C CG . LEU D 2 23 ? 3.404 43.973 25.563 1.00 68.15 ? 23 LEU D CG 1 ATOM 5279 C CD1 . LEU D 2 23 ? 2.896 43.001 26.631 1.00 62.52 ? 23 LEU D CD1 1 ATOM 5280 C CD2 . LEU D 2 23 ? 2.293 44.236 24.491 1.00 67.98 ? 23 LEU D CD2 1 ATOM 5281 N N . ASN D 2 24 ? 7.045 43.817 26.634 1.00 70.24 ? 24 ASN D N 1 ATOM 5282 C CA . ASN D 2 24 ? 8.247 43.344 26.024 1.00 71.68 ? 24 ASN D CA 1 ATOM 5283 C C . ASN D 2 24 ? 7.907 42.306 24.964 1.00 72.95 ? 24 ASN D C 1 ATOM 5284 O O . ASN D 2 24 ? 6.957 41.545 25.118 1.00 74.20 ? 24 ASN D O 1 ATOM 5285 C CB . ASN D 2 24 ? 9.134 42.665 27.074 1.00 72.09 ? 24 ASN D CB 1 ATOM 5286 C CG . ASN D 2 24 ? 9.425 43.555 28.264 1.00 72.22 ? 24 ASN D CG 1 ATOM 5287 O OD1 . ASN D 2 24 ? 9.825 44.694 28.110 1.00 72.24 ? 24 ASN D OD1 1 ATOM 5288 N ND2 . ASN D 2 24 ? 9.229 43.025 29.465 1.00 73.89 ? 24 ASN D ND2 1 ATOM 5289 N N . CYS D 2 25 ? 8.685 42.275 23.885 1.00 74.17 ? 25 CYS D N 1 ATOM 5290 C CA . CYS D 2 25 ? 8.576 41.231 22.852 1.00 73.28 ? 25 CYS D CA 1 ATOM 5291 C C . CYS D 2 25 ? 9.978 40.679 22.656 1.00 72.99 ? 25 CYS D C 1 ATOM 5292 O O . CYS D 2 25 ? 10.837 41.343 22.114 1.00 72.88 ? 25 CYS D O 1 ATOM 5293 C CB . CYS D 2 25 ? 8.065 41.809 21.562 1.00 73.33 ? 25 CYS D CB 1 ATOM 5294 S SG . CYS D 2 25 ? 8.000 40.582 20.243 1.00 76.91 ? 25 CYS D SG 1 ATOM 5295 N N . TYR D 2 26 ? 10.191 39.463 23.130 1.00 72.45 ? 26 TYR D N 1 ATOM 5296 C CA . TYR D 2 26 ? 11.487 38.802 23.099 1.00 71.99 ? 26 TYR D CA 1 ATOM 5297 C C . TYR D 2 26 ? 11.552 37.817 21.927 1.00 72.01 ? 26 TYR D C 1 ATOM 5298 O O . TYR D 2 26 ? 10.853 36.786 21.905 1.00 72.33 ? 26 TYR D O 1 ATOM 5299 C CB . TYR D 2 26 ? 11.731 38.095 24.445 1.00 71.63 ? 26 TYR D CB 1 ATOM 5300 C CG . TYR D 2 26 ? 13.128 37.541 24.712 1.00 69.74 ? 26 TYR D CG 1 ATOM 5301 C CD1 . TYR D 2 26 ? 14.268 38.242 24.372 1.00 68.24 ? 26 TYR D CD1 1 ATOM 5302 C CD2 . TYR D 2 26 ? 13.271 36.312 25.323 1.00 70.43 ? 26 TYR D CD2 1 ATOM 5303 C CE1 . TYR D 2 26 ? 15.517 37.738 24.619 1.00 69.92 ? 26 TYR D CE1 1 ATOM 5304 C CE2 . TYR D 2 26 ? 14.500 35.785 25.582 1.00 71.41 ? 26 TYR D CE2 1 ATOM 5305 C CZ . TYR D 2 26 ? 15.617 36.491 25.232 1.00 71.84 ? 26 TYR D CZ 1 ATOM 5306 O OH . TYR D 2 26 ? 16.818 35.931 25.512 1.00 74.66 ? 26 TYR D OH 1 ATOM 5307 N N . VAL D 2 27 ? 12.398 38.149 20.955 1.00 71.60 ? 27 VAL D N 1 ATOM 5308 C CA . VAL D 2 27 ? 12.587 37.343 19.745 1.00 70.96 ? 27 VAL D CA 1 ATOM 5309 C C . VAL D 2 27 ? 13.943 36.664 19.763 1.00 70.55 ? 27 VAL D C 1 ATOM 5310 O O . VAL D 2 27 ? 14.999 37.329 19.826 1.00 70.23 ? 27 VAL D O 1 ATOM 5311 C CB . VAL D 2 27 ? 12.466 38.189 18.471 1.00 71.00 ? 27 VAL D CB 1 ATOM 5312 C CG1 . VAL D 2 27 ? 12.052 37.308 17.327 1.00 71.44 ? 27 VAL D CG1 1 ATOM 5313 C CG2 . VAL D 2 27 ? 11.430 39.263 18.666 1.00 70.44 ? 27 VAL D CG2 1 ATOM 5314 N N . THR D 2 28 ? 13.917 35.342 19.706 1.00 69.45 ? 28 THR D N 1 ATOM 5315 C CA . THR D 2 28 ? 15.118 34.552 19.830 1.00 70.18 ? 28 THR D CA 1 ATOM 5316 C C . THR D 2 28 ? 15.189 33.479 18.756 1.00 70.95 ? 28 THR D C 1 ATOM 5317 O O . THR D 2 28 ? 14.264 33.310 17.971 1.00 71.27 ? 28 THR D O 1 ATOM 5318 C CB . THR D 2 28 ? 15.079 33.827 21.194 1.00 70.74 ? 28 THR D CB 1 ATOM 5319 O OG1 . THR D 2 28 ? 13.843 33.117 21.307 1.00 70.49 ? 28 THR D OG1 1 ATOM 5320 C CG2 . THR D 2 28 ? 14.986 34.794 22.328 1.00 69.66 ? 28 THR D CG2 1 ATOM 5321 N N . GLN D 2 29 ? 16.297 32.749 18.734 1.00 71.26 ? 29 GLN D N 1 ATOM 5322 C CA . GLN D 2 29 ? 16.408 31.543 17.946 1.00 71.51 ? 29 GLN D CA 1 ATOM 5323 C C . GLN D 2 29 ? 16.463 31.727 16.449 1.00 70.94 ? 29 GLN D C 1 ATOM 5324 O O . GLN D 2 29 ? 16.182 30.795 15.714 1.00 71.36 ? 29 GLN D O 1 ATOM 5325 C CB . GLN D 2 29 ? 15.187 30.647 18.255 1.00 72.81 ? 29 GLN D CB 1 ATOM 5326 C CG . GLN D 2 29 ? 15.543 29.207 18.451 1.00 75.46 ? 29 GLN D CG 1 ATOM 5327 C CD . GLN D 2 29 ? 16.519 29.112 19.567 1.00 79.37 ? 29 GLN D CD 1 ATOM 5328 O OE1 . GLN D 2 29 ? 16.342 29.793 20.582 1.00 80.05 ? 29 GLN D OE1 1 ATOM 5329 N NE2 . GLN D 2 29 ? 17.561 28.288 19.404 1.00 81.43 ? 29 GLN D NE2 1 ATOM 5330 N N . PHE D 2 30 ? 16.814 32.911 15.976 1.00 70.87 ? 30 PHE D N 1 ATOM 5331 C CA . PHE D 2 30 ? 16.796 33.135 14.541 1.00 69.20 ? 30 PHE D CA 1 ATOM 5332 C C . PHE D 2 30 ? 18.169 33.282 13.873 1.00 69.38 ? 30 PHE D C 1 ATOM 5333 O O . PHE D 2 30 ? 19.188 33.518 14.523 1.00 69.83 ? 30 PHE D O 1 ATOM 5334 C CB . PHE D 2 30 ? 15.829 34.256 14.185 1.00 68.44 ? 30 PHE D CB 1 ATOM 5335 C CG . PHE D 2 30 ? 16.243 35.621 14.664 1.00 67.66 ? 30 PHE D CG 1 ATOM 5336 C CD1 . PHE D 2 30 ? 15.859 36.090 15.920 1.00 68.64 ? 30 PHE D CD1 1 ATOM 5337 C CD2 . PHE D 2 30 ? 16.998 36.444 13.867 1.00 66.11 ? 30 PHE D CD2 1 ATOM 5338 C CE1 . PHE D 2 30 ? 16.237 37.364 16.356 1.00 68.06 ? 30 PHE D CE1 1 ATOM 5339 C CE2 . PHE D 2 30 ? 17.376 37.716 14.302 1.00 64.64 ? 30 PHE D CE2 1 ATOM 5340 C CZ . PHE D 2 30 ? 16.995 38.170 15.545 1.00 66.10 ? 30 PHE D CZ 1 ATOM 5341 N N . HIS D 2 31 ? 18.168 33.134 12.556 1.00 69.56 ? 31 HIS D N 1 ATOM 5342 C CA . HIS D 2 31 ? 19.333 33.272 11.701 1.00 69.79 ? 31 HIS D CA 1 ATOM 5343 C C . HIS D 2 31 ? 18.820 33.199 10.263 1.00 69.77 ? 31 HIS D C 1 ATOM 5344 O O . HIS D 2 31 ? 18.043 32.294 9.953 1.00 69.79 ? 31 HIS D O 1 ATOM 5345 C CB . HIS D 2 31 ? 20.357 32.154 11.951 1.00 70.59 ? 31 HIS D CB 1 ATOM 5346 C CG . HIS D 2 31 ? 21.703 32.419 11.340 1.00 70.44 ? 31 HIS D CG 1 ATOM 5347 N ND1 . HIS D 2 31 ? 22.034 32.033 10.058 1.00 71.00 ? 31 HIS D ND1 1 ATOM 5348 C CD2 . HIS D 2 31 ? 22.799 33.032 11.846 1.00 70.73 ? 31 HIS D CD2 1 ATOM 5349 C CE1 . HIS D 2 31 ? 23.275 32.401 9.800 1.00 72.62 ? 31 HIS D CE1 1 ATOM 5350 N NE2 . HIS D 2 31 ? 23.761 33.010 10.871 1.00 71.46 ? 31 HIS D NE2 1 ATOM 5351 N N . PRO D 2 32 ? 19.256 34.127 9.389 1.00 69.48 ? 32 PRO D N 1 ATOM 5352 C CA . PRO D 2 32 ? 20.288 35.139 9.725 1.00 69.08 ? 32 PRO D CA 1 ATOM 5353 C C . PRO D 2 32 ? 19.786 36.357 10.515 1.00 68.72 ? 32 PRO D C 1 ATOM 5354 O O . PRO D 2 32 ? 18.585 36.505 10.713 1.00 67.82 ? 32 PRO D O 1 ATOM 5355 C CB . PRO D 2 32 ? 20.859 35.539 8.352 1.00 69.24 ? 32 PRO D CB 1 ATOM 5356 C CG . PRO D 2 32 ? 19.862 35.033 7.299 1.00 69.37 ? 32 PRO D CG 1 ATOM 5357 C CD . PRO D 2 32 ? 18.784 34.269 8.004 1.00 69.52 ? 32 PRO D CD 1 ATOM 5358 N N . PRO D 2 33 ? 20.705 37.218 10.953 1.00 68.99 ? 33 PRO D N 1 ATOM 5359 C CA . PRO D 2 33 ? 20.374 38.329 11.860 1.00 70.01 ? 33 PRO D CA 1 ATOM 5360 C C . PRO D 2 33 ? 19.481 39.435 11.329 1.00 71.21 ? 33 PRO D C 1 ATOM 5361 O O . PRO D 2 33 ? 19.224 40.386 12.044 1.00 72.60 ? 33 PRO D O 1 ATOM 5362 C CB . PRO D 2 33 ? 21.738 38.916 12.222 1.00 69.42 ? 33 PRO D CB 1 ATOM 5363 C CG . PRO D 2 33 ? 22.625 38.507 11.166 1.00 68.93 ? 33 PRO D CG 1 ATOM 5364 C CD . PRO D 2 33 ? 22.132 37.206 10.609 1.00 68.14 ? 33 PRO D CD 1 ATOM 5365 N N . HIS D 2 34 ? 19.009 39.323 10.098 1.00 72.57 ? 34 HIS D N 1 ATOM 5366 C CA . HIS D 2 34 ? 18.216 40.381 9.502 1.00 73.17 ? 34 HIS D CA 1 ATOM 5367 C C . HIS D 2 34 ? 16.775 40.090 9.818 1.00 73.22 ? 34 HIS D C 1 ATOM 5368 O O . HIS D 2 34 ? 16.270 39.019 9.503 1.00 73.33 ? 34 HIS D O 1 ATOM 5369 C CB . HIS D 2 34 ? 18.512 40.456 8.010 1.00 73.35 ? 34 HIS D CB 1 ATOM 5370 C CG . HIS D 2 34 ? 19.974 40.280 7.700 1.00 76.17 ? 34 HIS D CG 1 ATOM 5371 N ND1 . HIS D 2 34 ? 20.941 41.172 8.123 1.00 76.67 ? 34 HIS D ND1 1 ATOM 5372 C CD2 . HIS D 2 34 ? 20.632 39.310 7.022 1.00 77.59 ? 34 HIS D CD2 1 ATOM 5373 C CE1 . HIS D 2 34 ? 22.126 40.762 7.716 1.00 77.98 ? 34 HIS D CE1 1 ATOM 5374 N NE2 . HIS D 2 34 ? 21.968 39.636 7.045 1.00 79.78 ? 34 HIS D NE2 1 ATOM 5375 N N . ILE D 2 35 ? 16.123 41.055 10.457 1.00 73.36 ? 35 ILE D N 1 ATOM 5376 C CA . ILE D 2 35 ? 14.769 40.876 10.938 1.00 73.47 ? 35 ILE D CA 1 ATOM 5377 C C . ILE D 2 35 ? 14.026 42.201 11.083 1.00 74.02 ? 35 ILE D C 1 ATOM 5378 O O . ILE D 2 35 ? 14.629 43.222 11.403 1.00 73.93 ? 35 ILE D O 1 ATOM 5379 C CB . ILE D 2 35 ? 14.824 40.144 12.290 1.00 73.50 ? 35 ILE D CB 1 ATOM 5380 C CG1 . ILE D 2 35 ? 13.496 39.450 12.605 1.00 73.55 ? 35 ILE D CG1 1 ATOM 5381 C CG2 . ILE D 2 35 ? 15.270 41.090 13.420 1.00 73.09 ? 35 ILE D CG2 1 ATOM 5382 C CD1 . ILE D 2 35 ? 13.659 38.294 13.551 1.00 71.37 ? 35 ILE D CD1 1 ATOM 5383 N N . GLU D 2 36 ? 12.715 42.175 10.844 1.00 74.49 ? 36 GLU D N 1 ATOM 5384 C CA . GLU D 2 36 ? 11.872 43.325 11.115 1.00 74.73 ? 36 GLU D CA 1 ATOM 5385 C C . GLU D 2 36 ? 10.857 42.982 12.207 1.00 74.51 ? 36 GLU D C 1 ATOM 5386 O O . GLU D 2 36 ? 10.120 41.991 12.106 1.00 74.34 ? 36 GLU D O 1 ATOM 5387 C CB . GLU D 2 36 ? 11.187 43.832 9.844 1.00 74.85 ? 36 GLU D CB 1 ATOM 5388 C CG . GLU D 2 36 ? 10.028 44.818 10.086 1.00 78.48 ? 36 GLU D CG 1 ATOM 5389 C CD . GLU D 2 36 ? 10.432 46.245 10.539 1.00 82.10 ? 36 GLU D CD 1 ATOM 5390 O OE1 . GLU D 2 36 ? 11.471 46.437 11.241 1.00 81.40 ? 36 GLU D OE1 1 ATOM 5391 O OE2 . GLU D 2 36 ? 9.677 47.200 10.184 1.00 81.68 ? 36 GLU D OE2 1 ATOM 5392 N N . ILE D 2 37 ? 10.833 43.815 13.246 1.00 74.20 ? 37 ILE D N 1 ATOM 5393 C CA . ILE D 2 37 ? 9.941 43.636 14.398 1.00 73.60 ? 37 ILE D CA 1 ATOM 5394 C C . ILE D 2 37 ? 9.056 44.854 14.589 1.00 73.50 ? 37 ILE D C 1 ATOM 5395 O O . ILE D 2 37 ? 9.546 45.994 14.612 1.00 72.45 ? 37 ILE D O 1 ATOM 5396 C CB . ILE D 2 37 ? 10.753 43.365 15.693 1.00 73.78 ? 37 ILE D CB 1 ATOM 5397 C CG1 . ILE D 2 37 ? 11.504 42.036 15.580 1.00 75.45 ? 37 ILE D CG1 1 ATOM 5398 C CG2 . ILE D 2 37 ? 9.841 43.327 16.963 1.00 73.28 ? 37 ILE D CG2 1 ATOM 5399 C CD1 . ILE D 2 37 ? 12.576 41.844 16.614 1.00 75.17 ? 37 ILE D CD1 1 ATOM 5400 N N . GLN D 2 38 ? 7.761 44.579 14.724 1.00 73.22 ? 38 GLN D N 1 ATOM 5401 C CA . GLN D 2 38 ? 6.735 45.577 14.982 1.00 73.75 ? 38 GLN D CA 1 ATOM 5402 C C . GLN D 2 38 ? 5.884 45.107 16.132 1.00 73.68 ? 38 GLN D C 1 ATOM 5403 O O . GLN D 2 38 ? 5.550 43.912 16.224 1.00 73.92 ? 38 GLN D O 1 ATOM 5404 C CB . GLN D 2 38 ? 5.775 45.694 13.802 1.00 73.66 ? 38 GLN D CB 1 ATOM 5405 C CG . GLN D 2 38 ? 6.391 46.008 12.473 1.00 76.23 ? 38 GLN D CG 1 ATOM 5406 C CD . GLN D 2 38 ? 5.467 45.623 11.332 1.00 80.24 ? 38 GLN D CD 1 ATOM 5407 O OE1 . GLN D 2 38 ? 4.232 45.643 11.476 1.00 81.03 ? 38 GLN D OE1 1 ATOM 5408 N NE2 . GLN D 2 38 ? 6.056 45.263 10.196 1.00 81.73 ? 38 GLN D NE2 1 ATOM 5409 N N . MET D 2 39 ? 5.523 46.039 17.008 1.00 73.52 ? 39 MET D N 1 ATOM 5410 C CA . MET D 2 39 ? 4.498 45.766 18.009 1.00 73.78 ? 39 MET D CA 1 ATOM 5411 C C . MET D 2 39 ? 3.283 46.554 17.592 1.00 72.56 ? 39 MET D C 1 ATOM 5412 O O . MET D 2 39 ? 3.387 47.709 17.136 1.00 72.09 ? 39 MET D O 1 ATOM 5413 C CB . MET D 2 39 ? 4.947 46.074 19.427 1.00 73.74 ? 39 MET D CB 1 ATOM 5414 C CG . MET D 2 39 ? 6.250 45.343 19.822 1.00 75.69 ? 39 MET D CG 1 ATOM 5415 S SD . MET D 2 39 ? 6.778 45.665 21.512 1.00 77.80 ? 39 MET D SD 1 ATOM 5416 C CE . MET D 2 39 ? 5.494 44.774 22.384 1.00 77.30 ? 39 MET D CE 1 ATOM 5417 N N . LEU D 2 40 ? 2.133 45.909 17.737 1.00 71.56 ? 40 LEU D N 1 ATOM 5418 C CA . LEU D 2 40 ? 0.875 46.463 17.274 1.00 70.98 ? 40 LEU D CA 1 ATOM 5419 C C . LEU D 2 40 ? -0.089 46.674 18.420 1.00 70.79 ? 40 LEU D C 1 ATOM 5420 O O . LEU D 2 40 ? -0.112 45.889 19.377 1.00 71.09 ? 40 LEU D O 1 ATOM 5421 C CB . LEU D 2 40 ? 0.230 45.502 16.285 1.00 70.72 ? 40 LEU D CB 1 ATOM 5422 C CG . LEU D 2 40 ? 1.050 44.960 15.110 1.00 71.23 ? 40 LEU D CG 1 ATOM 5423 C CD1 . LEU D 2 40 ? 0.509 43.629 14.661 1.00 71.90 ? 40 LEU D CD1 1 ATOM 5424 C CD2 . LEU D 2 40 ? 1.090 45.952 13.938 1.00 71.17 ? 40 LEU D CD2 1 ATOM 5425 N N . LYS D 2 41 ? -0.871 47.740 18.312 1.00 70.36 ? 41 LYS D N 1 ATOM 5426 C CA . LYS D 2 41 ? -2.015 47.977 19.176 1.00 70.16 ? 41 LYS D CA 1 ATOM 5427 C C . LYS D 2 41 ? -3.244 47.971 18.266 1.00 70.01 ? 41 LYS D C 1 ATOM 5428 O O . LYS D 2 41 ? -3.318 48.717 17.296 1.00 70.11 ? 41 LYS D O 1 ATOM 5429 C CB . LYS D 2 41 ? -1.897 49.306 19.920 1.00 70.30 ? 41 LYS D CB 1 ATOM 5430 C CG . LYS D 2 41 ? -3.071 49.587 20.884 1.00 70.63 ? 41 LYS D CG 1 ATOM 5431 C CD . LYS D 2 41 ? -3.106 51.057 21.337 1.00 69.58 ? 41 LYS D CD 1 ATOM 5432 C CE . LYS D 2 41 ? -4.053 51.256 22.507 1.00 70.31 ? 41 LYS D CE 1 ATOM 5433 N NZ . LYS D 2 41 ? -4.586 52.668 22.585 1.00 71.82 ? 41 LYS D NZ 1 ATOM 5434 N N . ASN D 2 42 ? -4.212 47.124 18.573 1.00 70.08 ? 42 ASN D N 1 ATOM 5435 C CA . ASN D 2 42 ? -5.402 46.991 17.723 1.00 69.96 ? 42 ASN D CA 1 ATOM 5436 C C . ASN D 2 42 ? -5.102 46.787 16.239 1.00 70.22 ? 42 ASN D C 1 ATOM 5437 O O . ASN D 2 42 ? -5.739 47.392 15.376 1.00 69.26 ? 42 ASN D O 1 ATOM 5438 C CB . ASN D 2 42 ? -6.327 48.186 17.929 1.00 69.76 ? 42 ASN D CB 1 ATOM 5439 C CG . ASN D 2 42 ? -6.924 48.215 19.318 1.00 69.25 ? 42 ASN D CG 1 ATOM 5440 O OD1 . ASN D 2 42 ? -7.149 47.162 19.922 1.00 70.41 ? 42 ASN D OD1 1 ATOM 5441 N ND2 . ASN D 2 42 ? -7.187 49.413 19.835 1.00 65.81 ? 42 ASN D ND2 1 ATOM 5442 N N . GLY D 2 43 ? -4.122 45.929 15.955 1.00 70.75 ? 43 GLY D N 1 ATOM 5443 C CA . GLY D 2 43 ? -3.695 45.667 14.568 1.00 71.99 ? 43 GLY D CA 1 ATOM 5444 C C . GLY D 2 43 ? -2.912 46.772 13.858 1.00 72.32 ? 43 GLY D C 1 ATOM 5445 O O . GLY D 2 43 ? -2.511 46.602 12.709 1.00 72.30 ? 43 GLY D O 1 ATOM 5446 N N . LYS D 2 44 ? -2.699 47.897 14.547 1.00 73.24 ? 44 LYS D N 1 ATOM 5447 C CA . LYS D 2 44 ? -1.996 49.055 14.007 1.00 73.70 ? 44 LYS D CA 1 ATOM 5448 C C . LYS D 2 44 ? -0.661 49.303 14.710 1.00 74.29 ? 44 LYS D C 1 ATOM 5449 O O . LYS D 2 44 ? -0.542 49.172 15.929 1.00 74.17 ? 44 LYS D O 1 ATOM 5450 C CB . LYS D 2 44 ? -2.896 50.272 14.053 1.00 73.86 ? 44 LYS D CB 1 ATOM 5451 C CG . LYS D 2 44 ? -4.142 50.091 13.197 1.00 75.15 ? 44 LYS D CG 1 ATOM 5452 C CD . LYS D 2 44 ? -3.752 49.939 11.721 1.00 76.81 ? 44 LYS D CD 1 ATOM 5453 C CE . LYS D 2 44 ? -4.671 48.986 10.973 1.00 77.35 ? 44 LYS D CE 1 ATOM 5454 N NZ . LYS D 2 44 ? -6.106 49.271 11.229 1.00 77.22 ? 44 LYS D NZ 1 ATOM 5455 N N . LYS D 2 45 ? 0.336 49.664 13.904 1.00 74.73 ? 45 LYS D N 1 ATOM 5456 C CA . LYS D 2 45 ? 1.724 49.816 14.333 1.00 75.14 ? 45 LYS D CA 1 ATOM 5457 C C . LYS D 2 45 ? 1.932 50.858 15.445 1.00 74.43 ? 45 LYS D C 1 ATOM 5458 O O . LYS D 2 45 ? 1.393 51.962 15.392 1.00 73.80 ? 45 LYS D O 1 ATOM 5459 C CB . LYS D 2 45 ? 2.598 50.146 13.111 1.00 75.38 ? 45 LYS D CB 1 ATOM 5460 C CG . LYS D 2 45 ? 4.081 49.755 13.224 1.00 76.59 ? 45 LYS D CG 1 ATOM 5461 C CD . LYS D 2 45 ? 4.891 50.435 12.114 1.00 76.51 ? 45 LYS D CD 1 ATOM 5462 C CE . LYS D 2 45 ? 5.081 51.928 12.405 1.00 79.72 ? 45 LYS D CE 1 ATOM 5463 N NZ . LYS D 2 45 ? 5.182 52.767 11.165 1.00 79.98 ? 45 LYS D NZ 1 ATOM 5464 N N . ILE D 2 46 ? 2.724 50.471 16.450 1.00 74.02 ? 46 ILE D N 1 ATOM 5465 C CA . ILE D 2 46 ? 3.073 51.346 17.562 1.00 73.43 ? 46 ILE D CA 1 ATOM 5466 C C . ILE D 2 46 ? 4.398 52.058 17.216 1.00 73.50 ? 46 ILE D C 1 ATOM 5467 O O . ILE D 2 46 ? 5.421 51.387 16.995 1.00 73.67 ? 46 ILE D O 1 ATOM 5468 C CB . ILE D 2 46 ? 3.172 50.528 18.890 1.00 73.08 ? 46 ILE D CB 1 ATOM 5469 C CG1 . ILE D 2 46 ? 1.831 49.864 19.216 1.00 72.99 ? 46 ILE D CG1 1 ATOM 5470 C CG2 . ILE D 2 46 ? 3.596 51.407 20.077 1.00 72.22 ? 46 ILE D CG2 1 ATOM 5471 C CD1 . ILE D 2 46 ? 1.904 48.941 20.421 1.00 73.87 ? 46 ILE D CD1 1 ATOM 5472 N N . PRO D 2 47 ? 4.378 53.390 17.160 1.00 72.77 ? 47 PRO D N 1 ATOM 5473 C CA . PRO D 2 47 ? 5.578 54.191 16.888 1.00 73.13 ? 47 PRO D CA 1 ATOM 5474 C C . PRO D 2 47 ? 6.683 54.130 17.958 1.00 73.34 ? 47 PRO D C 1 ATOM 5475 O O . PRO D 2 47 ? 7.811 53.777 17.609 1.00 73.83 ? 47 PRO D O 1 ATOM 5476 C CB . PRO D 2 47 ? 5.023 55.619 16.746 1.00 73.11 ? 47 PRO D CB 1 ATOM 5477 C CG . PRO D 2 47 ? 3.554 55.423 16.501 1.00 72.83 ? 47 PRO D CG 1 ATOM 5478 C CD . PRO D 2 47 ? 3.191 54.240 17.337 1.00 73.05 ? 47 PRO D CD 1 ATOM 5479 N N . LYS D 2 48 ? 6.387 54.461 19.222 1.00 73.70 ? 48 LYS D N 1 ATOM 5480 C CA . LYS D 2 48 ? 7.393 54.430 20.312 1.00 74.56 ? 48 LYS D CA 1 ATOM 5481 C C . LYS D 2 48 ? 7.782 52.992 20.769 1.00 75.74 ? 48 LYS D C 1 ATOM 5482 O O . LYS D 2 48 ? 7.383 52.538 21.857 1.00 75.77 ? 48 LYS D O 1 ATOM 5483 C CB . LYS D 2 48 ? 7.388 55.259 21.322 0.00 40.00 ? 48 LYS D CB 1 ATOM 5484 C CG . LYS D 2 48 ? 8.648 55.301 22.199 0.00 40.00 ? 48 LYS D CG 1 ATOM 5485 C CD . LYS D 2 48 ? 8.868 56.671 22.835 0.00 40.00 ? 48 LYS D CD 1 ATOM 5486 C CE . LYS D 2 48 ? 10.041 56.650 23.832 0.00 40.00 ? 48 LYS D CE 1 ATOM 5487 N NZ . LYS D 2 48 ? 10.467 58.044 24.212 0.00 40.00 ? 48 LYS D NZ 1 ATOM 5488 N N . VAL D 2 49 ? 8.548 52.288 19.935 1.00 76.22 ? 49 VAL D N 1 ATOM 5489 C CA . VAL D 2 49 ? 9.012 50.925 20.225 1.00 76.85 ? 49 VAL D CA 1 ATOM 5490 C C . VAL D 2 49 ? 10.551 50.916 20.320 1.00 78.10 ? 49 VAL D C 1 ATOM 5491 O O . VAL D 2 49 ? 11.257 51.216 19.349 1.00 78.90 ? 49 VAL D O 1 ATOM 5492 C CB . VAL D 2 49 ? 8.485 49.913 19.176 1.00 76.92 ? 49 VAL D CB 1 ATOM 5493 C CG1 . VAL D 2 49 ? 9.032 48.504 19.424 1.00 76.11 ? 49 VAL D CG1 1 ATOM 5494 C CG2 . VAL D 2 49 ? 6.979 49.867 19.200 1.00 75.97 ? 49 VAL D CG2 1 ATOM 5495 N N . GLU D 2 50 ? 11.064 50.587 21.503 1.00 78.84 ? 50 GLU D N 1 ATOM 5496 C CA . GLU D 2 50 ? 12.510 50.538 21.752 1.00 79.22 ? 50 GLU D CA 1 ATOM 5497 C C . GLU D 2 50 ? 13.080 49.143 21.523 1.00 78.73 ? 50 GLU D C 1 ATOM 5498 O O . GLU D 2 50 ? 12.405 48.133 21.763 1.00 78.94 ? 50 GLU D O 1 ATOM 5499 C CB . GLU D 2 50 ? 12.862 51.057 23.155 1.00 79.62 ? 50 GLU D CB 1 ATOM 5500 C CG . GLU D 2 50 ? 13.666 52.350 23.195 1.00 82.27 ? 50 GLU D CG 1 ATOM 5501 C CD . GLU D 2 50 ? 12.857 53.645 23.180 1.00 85.15 ? 50 GLU D CD 1 ATOM 5502 O OE1 . GLU D 2 50 ? 11.763 53.704 23.776 1.00 86.94 ? 50 GLU D OE1 1 ATOM 5503 O OE2 . GLU D 2 50 ? 13.332 54.627 22.566 1.00 85.19 ? 50 GLU D OE2 1 ATOM 5504 N N . MET D 2 51 ? 14.328 49.095 21.052 1.00 78.35 ? 51 MET D N 1 ATOM 5505 C CA . MET D 2 51 ? 14.979 47.835 20.657 1.00 78.41 ? 51 MET D CA 1 ATOM 5506 C C . MET D 2 51 ? 16.338 47.673 21.317 1.00 77.36 ? 51 MET D C 1 ATOM 5507 O O . MET D 2 51 ? 17.132 48.608 21.328 1.00 76.06 ? 51 MET D O 1 ATOM 5508 C CB . MET D 2 51 ? 15.236 47.833 19.147 1.00 79.05 ? 51 MET D CB 1 ATOM 5509 C CG . MET D 2 51 ? 14.043 48.111 18.267 1.00 80.15 ? 51 MET D CG 1 ATOM 5510 S SD . MET D 2 51 ? 13.215 46.610 17.769 1.00 81.82 ? 51 MET D SD 1 ATOM 5511 C CE . MET D 2 51 ? 11.714 47.288 17.040 1.00 81.68 ? 51 MET D CE 1 ATOM 5512 N N . SER D 2 52 ? 16.618 46.494 21.860 1.00 76.28 ? 52 SER D N 1 ATOM 5513 C CA . SER D 2 52 ? 17.969 46.262 22.341 1.00 76.36 ? 52 SER D CA 1 ATOM 5514 C C . SER D 2 52 ? 18.908 46.220 21.128 1.00 76.50 ? 52 SER D C 1 ATOM 5515 O O . SER D 2 52 ? 18.450 46.119 19.982 1.00 76.71 ? 52 SER D O 1 ATOM 5516 C CB . SER D 2 52 ? 18.086 44.998 23.213 1.00 76.48 ? 52 SER D CB 1 ATOM 5517 O OG . SER D 2 52 ? 17.873 43.780 22.511 1.00 76.33 ? 52 SER D OG 1 ATOM 5518 N N . ASP D 2 53 ? 20.210 46.313 21.363 1.00 76.74 ? 53 ASP D N 1 ATOM 5519 C CA . ASP D 2 53 ? 21.154 46.077 20.280 1.00 77.10 ? 53 ASP D CA 1 ATOM 5520 C C . ASP D 2 53 ? 21.076 44.590 20.018 1.00 77.22 ? 53 ASP D C 1 ATOM 5521 O O . ASP D 2 53 ? 20.880 43.791 20.937 1.00 78.91 ? 53 ASP D O 1 ATOM 5522 C CB . ASP D 2 53 ? 22.599 46.445 20.631 1.00 77.27 ? 53 ASP D CB 1 ATOM 5523 C CG . ASP D 2 53 ? 22.763 47.879 21.047 1.00 76.58 ? 53 ASP D CG 1 ATOM 5524 O OD1 . ASP D 2 53 ? 22.328 48.802 20.314 1.00 76.75 ? 53 ASP D OD1 1 ATOM 5525 O OD2 . ASP D 2 53 ? 23.335 48.165 22.116 1.00 76.23 ? 53 ASP D OD2 1 ATOM 5526 N N . MET D 2 54 ? 21.213 44.215 18.760 1.00 76.84 ? 54 MET D N 1 ATOM 5527 C CA . MET D 2 54 ? 21.196 42.832 18.361 1.00 75.58 ? 54 MET D CA 1 ATOM 5528 C C . MET D 2 54 ? 22.334 42.092 19.078 1.00 74.59 ? 54 MET D C 1 ATOM 5529 O O . MET D 2 54 ? 23.458 42.608 19.167 1.00 74.22 ? 54 MET D O 1 ATOM 5530 C CB . MET D 2 54 ? 21.395 42.816 16.856 1.00 76.42 ? 54 MET D CB 1 ATOM 5531 C CG . MET D 2 54 ? 21.553 41.467 16.213 1.00 78.75 ? 54 MET D CG 1 ATOM 5532 S SD . MET D 2 54 ? 20.048 40.540 16.111 1.00 81.41 ? 54 MET D SD 1 ATOM 5533 C CE . MET D 2 54 ? 19.087 41.512 14.952 1.00 81.48 ? 54 MET D CE 1 ATOM 5534 N N . SER D 2 55 ? 22.050 40.893 19.594 1.00 73.18 ? 55 SER D N 1 ATOM 5535 C CA . SER D 2 55 ? 23.089 40.067 20.218 1.00 71.69 ? 55 SER D CA 1 ATOM 5536 C C . SER D 2 55 ? 22.874 38.611 19.828 1.00 71.68 ? 55 SER D C 1 ATOM 5537 O O . SER D 2 55 ? 21.917 38.317 19.121 1.00 71.18 ? 55 SER D O 1 ATOM 5538 C CB . SER D 2 55 ? 23.124 40.291 21.744 1.00 72.02 ? 55 SER D CB 1 ATOM 5539 O OG . SER D 2 55 ? 24.107 39.490 22.385 1.00 70.16 ? 55 SER D OG 1 ATOM 5540 N N . PHE D 2 56 ? 23.756 37.721 20.267 1.00 71.54 ? 56 PHE D N 1 ATOM 5541 C CA . PHE D 2 56 ? 23.632 36.277 20.020 1.00 72.60 ? 56 PHE D CA 1 ATOM 5542 C C . PHE D 2 56 ? 23.977 35.433 21.264 1.00 73.33 ? 56 PHE D C 1 ATOM 5543 O O . PHE D 2 56 ? 24.550 35.964 22.235 1.00 74.06 ? 56 PHE D O 1 ATOM 5544 C CB . PHE D 2 56 ? 24.300 35.799 18.700 1.00 72.20 ? 56 PHE D CB 1 ATOM 5545 C CG . PHE D 2 56 ? 25.783 35.954 18.648 1.00 72.37 ? 56 PHE D CG 1 ATOM 5546 C CD1 . PHE D 2 56 ? 26.630 35.008 19.240 1.00 73.10 ? 56 PHE D CD1 1 ATOM 5547 C CD2 . PHE D 2 56 ? 26.355 37.038 17.996 1.00 72.62 ? 56 PHE D CD2 1 ATOM 5548 C CE1 . PHE D 2 56 ? 28.021 35.161 19.188 1.00 69.43 ? 56 PHE D CE1 1 ATOM 5549 C CE2 . PHE D 2 56 ? 27.746 37.187 17.943 1.00 70.45 ? 56 PHE D CE2 1 ATOM 5550 C CZ . PHE D 2 56 ? 28.567 36.250 18.538 1.00 70.28 ? 56 PHE D CZ 1 ATOM 5551 N N . SER D 2 57 ? 23.623 34.155 21.235 1.00 73.51 ? 57 SER D N 1 ATOM 5552 C CA . SER D 2 57 ? 23.746 33.267 22.403 1.00 74.62 ? 57 SER D CA 1 ATOM 5553 C C . SER D 2 57 ? 24.924 32.333 22.358 1.00 73.91 ? 57 SER D C 1 ATOM 5554 O O . SER D 2 57 ? 25.715 32.347 21.423 1.00 73.25 ? 57 SER D O 1 ATOM 5555 C CB . SER D 2 57 ? 22.512 32.356 22.481 1.00 74.62 ? 57 SER D CB 1 ATOM 5556 O OG . SER D 2 57 ? 21.338 33.122 22.650 1.00 79.43 ? 57 SER D OG 1 ATOM 5557 N N . LYS D 2 58 ? 25.015 31.509 23.398 1.00 74.42 ? 58 LYS D N 1 ATOM 5558 C CA . LYS D 2 58 ? 25.980 30.415 23.459 1.00 74.45 ? 58 LYS D CA 1 ATOM 5559 C C . LYS D 2 58 ? 25.865 29.604 22.154 1.00 74.61 ? 58 LYS D C 1 ATOM 5560 O O . LYS D 2 58 ? 26.878 29.307 21.551 1.00 75.35 ? 58 LYS D O 1 ATOM 5561 C CB . LYS D 2 58 ? 25.923 29.645 24.593 0.00 40.00 ? 58 LYS D CB 1 ATOM 5562 C CG . LYS D 2 58 ? 27.135 28.724 24.793 0.00 40.00 ? 58 LYS D CG 1 ATOM 5563 C CD . LYS D 2 58 ? 28.383 29.482 25.265 0.00 40.00 ? 58 LYS D CD 1 ATOM 5564 C CE . LYS D 2 58 ? 29.660 28.789 24.799 0.00 40.00 ? 58 LYS D CE 1 ATOM 5565 N NZ . LYS D 2 58 ? 29.807 28.873 23.312 0.00 40.00 ? 58 LYS D NZ 1 ATOM 5566 N N . ASP D 2 59 ? 24.643 29.271 21.721 1.00 74.10 ? 59 ASP D N 1 ATOM 5567 C CA . ASP D 2 59 ? 24.402 28.399 20.530 1.00 73.99 ? 59 ASP D CA 1 ATOM 5568 C C . ASP D 2 59 ? 24.509 29.084 19.167 1.00 72.97 ? 59 ASP D C 1 ATOM 5569 O O . ASP D 2 59 ? 24.206 28.481 18.134 1.00 73.04 ? 59 ASP D O 1 ATOM 5570 C CB . ASP D 2 59 ? 23.036 27.693 20.643 1.00 74.57 ? 59 ASP D CB 1 ATOM 5571 C CG . ASP D 2 59 ? 21.855 28.586 20.221 1.00 75.62 ? 59 ASP D CG 1 ATOM 5572 O OD1 . ASP D 2 59 ? 20.855 28.056 19.655 1.00 77.09 ? 59 ASP D OD1 1 ATOM 5573 O OD2 . ASP D 2 59 ? 21.826 29.817 20.396 1.00 75.53 ? 59 ASP D OD2 1 ATOM 5574 N N . TRP D 2 60 ? 24.943 30.344 19.199 1.00 72.02 ? 60 TRP D N 1 ATOM 5575 C CA . TRP D 2 60 ? 25.201 31.235 18.044 1.00 71.21 ? 60 TRP D CA 1 ATOM 5576 C C . TRP D 2 60 ? 23.974 31.855 17.412 1.00 71.77 ? 60 TRP D C 1 ATOM 5577 O O . TRP D 2 60 ? 24.121 32.675 16.509 1.00 72.51 ? 60 TRP D O 1 ATOM 5578 C CB . TRP D 2 60 ? 26.093 30.629 16.933 1.00 69.98 ? 60 TRP D CB 1 ATOM 5579 C CG . TRP D 2 60 ? 27.452 30.189 17.357 1.00 69.69 ? 60 TRP D CG 1 ATOM 5580 C CD1 . TRP D 2 60 ? 27.830 28.920 17.669 1.00 68.11 ? 60 TRP D CD1 1 ATOM 5581 C CD2 . TRP D 2 60 ? 28.626 31.008 17.519 1.00 69.03 ? 60 TRP D CD2 1 ATOM 5582 N NE1 . TRP D 2 60 ? 29.159 28.886 18.017 1.00 68.77 ? 60 TRP D NE1 1 ATOM 5583 C CE2 . TRP D 2 60 ? 29.681 30.146 17.937 1.00 68.45 ? 60 TRP D CE2 1 ATOM 5584 C CE3 . TRP D 2 60 ? 28.900 32.383 17.357 1.00 66.91 ? 60 TRP D CE3 1 ATOM 5585 C CZ2 . TRP D 2 60 ? 30.987 30.604 18.194 1.00 67.27 ? 60 TRP D CZ2 1 ATOM 5586 C CZ3 . TRP D 2 60 ? 30.213 32.842 17.619 1.00 67.61 ? 60 TRP D CZ3 1 ATOM 5587 C CH2 . TRP D 2 60 ? 31.231 31.948 18.030 1.00 67.81 ? 60 TRP D CH2 1 ATOM 5588 N N . SER D 2 61 ? 22.776 31.471 17.865 1.00 72.09 ? 61 SER D N 1 ATOM 5589 C CA . SER D 2 61 ? 21.514 32.009 17.319 1.00 71.95 ? 61 SER D CA 1 ATOM 5590 C C . SER D 2 61 ? 21.227 33.406 17.894 1.00 71.90 ? 61 SER D C 1 ATOM 5591 O O . SER D 2 61 ? 21.587 33.690 19.044 1.00 71.46 ? 61 SER D O 1 ATOM 5592 C CB . SER D 2 61 ? 20.366 31.040 17.631 1.00 72.06 ? 61 SER D CB 1 ATOM 5593 O OG . SER D 2 61 ? 20.164 30.940 19.025 1.00 72.35 ? 61 SER D OG 1 ATOM 5594 N N . PHE D 2 62 ? 20.583 34.273 17.102 1.00 71.81 ? 62 PHE D N 1 ATOM 5595 C CA . PHE D 2 62 ? 20.398 35.682 17.477 1.00 71.56 ? 62 PHE D CA 1 ATOM 5596 C C . PHE D 2 62 ? 19.139 35.976 18.296 1.00 72.66 ? 62 PHE D C 1 ATOM 5597 O O . PHE D 2 62 ? 18.152 35.278 18.219 1.00 72.93 ? 62 PHE D O 1 ATOM 5598 C CB . PHE D 2 62 ? 20.410 36.599 16.229 1.00 72.09 ? 62 PHE D CB 1 ATOM 5599 C CG . PHE D 2 62 ? 21.760 36.708 15.544 1.00 71.89 ? 62 PHE D CG 1 ATOM 5600 C CD1 . PHE D 2 62 ? 22.222 35.700 14.690 1.00 71.53 ? 62 PHE D CD1 1 ATOM 5601 C CD2 . PHE D 2 62 ? 22.573 37.817 15.752 1.00 72.15 ? 62 PHE D CD2 1 ATOM 5602 C CE1 . PHE D 2 62 ? 23.476 35.797 14.053 1.00 71.90 ? 62 PHE D CE1 1 ATOM 5603 C CE2 . PHE D 2 62 ? 23.827 37.922 15.120 1.00 72.12 ? 62 PHE D CE2 1 ATOM 5604 C CZ . PHE D 2 62 ? 24.279 36.908 14.267 1.00 71.60 ? 62 PHE D CZ 1 ATOM 5605 N N . TYR D 2 63 ? 19.194 37.038 19.089 1.00 73.93 ? 63 TYR D N 1 ATOM 5606 C CA . TYR D 2 63 ? 18.068 37.499 19.898 1.00 74.82 ? 63 TYR D CA 1 ATOM 5607 C C . TYR D 2 63 ? 18.042 39.018 19.969 1.00 74.03 ? 63 TYR D C 1 ATOM 5608 O O . TYR D 2 63 ? 19.023 39.697 19.715 1.00 74.06 ? 63 TYR D O 1 ATOM 5609 C CB . TYR D 2 63 ? 18.056 36.903 21.324 1.00 76.15 ? 63 TYR D CB 1 ATOM 5610 C CG . TYR D 2 63 ? 19.270 37.257 22.172 1.00 77.46 ? 63 TYR D CG 1 ATOM 5611 C CD1 . TYR D 2 63 ? 19.320 38.441 22.937 1.00 77.63 ? 63 TYR D CD1 1 ATOM 5612 C CD2 . TYR D 2 63 ? 20.372 36.401 22.204 1.00 78.65 ? 63 TYR D CD2 1 ATOM 5613 C CE1 . TYR D 2 63 ? 20.456 38.745 23.711 1.00 78.03 ? 63 TYR D CE1 1 ATOM 5614 C CE2 . TYR D 2 63 ? 21.500 36.700 22.971 1.00 78.19 ? 63 TYR D CE2 1 ATOM 5615 C CZ . TYR D 2 63 ? 21.535 37.852 23.707 1.00 77.68 ? 63 TYR D CZ 1 ATOM 5616 O OH . TYR D 2 63 ? 22.670 38.081 24.431 1.00 81.04 ? 63 TYR D OH 1 ATOM 5617 N N . ILE D 2 64 ? 16.874 39.528 20.324 1.00 74.14 ? 64 ILE D N 1 ATOM 5618 C CA . ILE D 2 64 ? 16.613 40.961 20.469 1.00 73.45 ? 64 ILE D CA 1 ATOM 5619 C C . ILE D 2 64 ? 15.358 41.111 21.338 1.00 72.49 ? 64 ILE D C 1 ATOM 5620 O O . ILE D 2 64 ? 14.451 40.250 21.318 1.00 73.46 ? 64 ILE D O 1 ATOM 5621 C CB . ILE D 2 64 ? 16.500 41.610 19.055 1.00 73.43 ? 64 ILE D CB 1 ATOM 5622 C CG1 . ILE D 2 64 ? 16.089 43.078 19.080 1.00 74.21 ? 64 ILE D CG1 1 ATOM 5623 C CG2 . ILE D 2 64 ? 15.533 40.848 18.203 1.00 74.64 ? 64 ILE D CG2 1 ATOM 5624 C CD1 . ILE D 2 64 ? 16.646 43.825 17.864 1.00 73.26 ? 64 ILE D CD1 1 ATOM 5625 N N . LEU D 2 65 ? 15.317 42.178 22.113 1.00 70.80 ? 65 LEU D N 1 ATOM 5626 C CA . LEU D 2 65 ? 14.123 42.562 22.843 1.00 70.22 ? 65 LEU D CA 1 ATOM 5627 C C . LEU D 2 65 ? 13.638 43.918 22.331 1.00 70.46 ? 65 LEU D C 1 ATOM 5628 O O . LEU D 2 65 ? 14.427 44.842 22.165 1.00 70.91 ? 65 LEU D O 1 ATOM 5629 C CB . LEU D 2 65 ? 14.435 42.681 24.328 1.00 69.45 ? 65 LEU D CB 1 ATOM 5630 C CG . LEU D 2 65 ? 13.379 43.228 25.269 1.00 67.89 ? 65 LEU D CG 1 ATOM 5631 C CD1 . LEU D 2 65 ? 12.386 42.168 25.723 1.00 69.23 ? 65 LEU D CD1 1 ATOM 5632 C CD2 . LEU D 2 65 ? 14.101 43.772 26.452 1.00 66.25 ? 65 LEU D CD2 1 ATOM 5633 N N . ALA D 2 66 ? 12.344 44.011 22.083 1.00 70.55 ? 66 ALA D N 1 ATOM 5634 C CA . ALA D 2 66 ? 11.688 45.265 21.750 1.00 70.08 ? 66 ALA D CA 1 ATOM 5635 C C . ALA D 2 66 ? 10.763 45.479 22.932 1.00 70.49 ? 66 ALA D C 1 ATOM 5636 O O . ALA D 2 66 ? 10.267 44.510 23.516 1.00 69.70 ? 66 ALA D O 1 ATOM 5637 C CB . ALA D 2 66 ? 10.888 45.130 20.487 1.00 70.35 ? 66 ALA D CB 1 ATOM 5638 N N . HIS D 2 67 ? 10.528 46.724 23.299 1.00 69.97 ? 67 HIS D N 1 ATOM 5639 C CA . HIS D 2 67 ? 9.648 47.000 24.411 1.00 71.13 ? 67 HIS D CA 1 ATOM 5640 C C . HIS D 2 67 ? 9.044 48.328 24.210 1.00 71.72 ? 67 HIS D C 1 ATOM 5641 O O . HIS D 2 67 ? 9.645 49.200 23.602 1.00 72.18 ? 67 HIS D O 1 ATOM 5642 C CB . HIS D 2 67 ? 10.388 47.002 25.750 1.00 71.15 ? 67 HIS D CB 1 ATOM 5643 C CG . HIS D 2 67 ? 11.493 48.009 25.830 1.00 73.72 ? 67 HIS D CG 1 ATOM 5644 N ND1 . HIS D 2 67 ? 11.311 49.278 26.343 1.00 73.54 ? 67 HIS D ND1 1 ATOM 5645 C CD2 . HIS D 2 67 ? 12.796 47.932 25.463 1.00 74.37 ? 67 HIS D CD2 1 ATOM 5646 C CE1 . HIS D 2 67 ? 12.454 49.937 26.288 1.00 74.56 ? 67 HIS D CE1 1 ATOM 5647 N NE2 . HIS D 2 67 ? 13.368 49.145 25.758 1.00 75.13 ? 67 HIS D NE2 1 ATOM 5648 N N . THR D 2 68 ? 7.845 48.487 24.735 1.00 73.46 ? 68 THR D N 1 ATOM 5649 C CA . THR D 2 68 ? 7.131 49.742 24.594 1.00 75.08 ? 68 THR D CA 1 ATOM 5650 C C . THR D 2 68 ? 6.268 50.034 25.816 1.00 75.63 ? 68 THR D C 1 ATOM 5651 O O . THR D 2 68 ? 5.931 49.134 26.603 1.00 77.13 ? 68 THR D O 1 ATOM 5652 C CB . THR D 2 68 ? 6.294 49.729 23.275 1.00 74.75 ? 68 THR D CB 1 ATOM 5653 O OG1 . THR D 2 68 ? 5.745 51.021 23.047 1.00 75.66 ? 68 THR D OG1 1 ATOM 5654 C CG2 . THR D 2 68 ? 5.070 48.847 23.377 1.00 75.01 ? 68 THR D CG2 1 ATOM 5655 N N . GLU D 2 69 ? 5.919 51.293 25.968 1.00 76.08 ? 69 GLU D N 1 ATOM 5656 C CA . GLU D 2 69 ? 5.005 51.722 27.024 1.00 76.59 ? 69 GLU D CA 1 ATOM 5657 C C . GLU D 2 69 ? 3.576 51.423 26.606 1.00 76.22 ? 69 GLU D C 1 ATOM 5658 O O . GLU D 2 69 ? 3.158 51.794 25.513 1.00 76.54 ? 69 GLU D O 1 ATOM 5659 C CB . GLU D 2 69 ? 5.182 53.212 27.304 1.00 75.97 ? 69 GLU D CB 1 ATOM 5660 C CG . GLU D 2 69 ? 6.549 53.534 27.892 1.00 76.50 ? 69 GLU D CG 1 ATOM 5661 C CD . GLU D 2 69 ? 6.786 55.028 28.092 1.00 77.56 ? 69 GLU D CD 1 ATOM 5662 O OE1 . GLU D 2 69 ? 7.951 55.478 27.950 1.00 77.45 ? 69 GLU D OE1 1 ATOM 5663 O OE2 . GLU D 2 69 ? 5.808 55.755 28.387 1.00 79.65 ? 69 GLU D OE2 1 ATOM 5664 N N . PHE D 2 70 ? 2.825 50.744 27.462 1.00 75.44 ? 70 PHE D N 1 ATOM 5665 C CA . PHE D 2 70 ? 1.418 50.513 27.164 1.00 74.61 ? 70 PHE D CA 1 ATOM 5666 C C . PHE D 2 70 ? 0.561 50.569 28.419 1.00 74.61 ? 70 PHE D C 1 ATOM 5667 O O . PHE D 2 70 ? 1.077 50.497 29.546 1.00 74.61 ? 70 PHE D O 1 ATOM 5668 C CB . PHE D 2 70 ? 1.225 49.212 26.363 1.00 74.38 ? 70 PHE D CB 1 ATOM 5669 C CG . PHE D 2 70 ? 1.135 47.952 27.195 1.00 73.70 ? 70 PHE D CG 1 ATOM 5670 C CD1 . PHE D 2 70 ? 2.042 47.682 28.214 1.00 72.79 ? 70 PHE D CD1 1 ATOM 5671 C CD2 . PHE D 2 70 ? 0.120 47.017 26.935 1.00 73.78 ? 70 PHE D CD2 1 ATOM 5672 C CE1 . PHE D 2 70 ? 1.938 46.491 28.967 1.00 72.65 ? 70 PHE D CE1 1 ATOM 5673 C CE2 . PHE D 2 70 ? 0.011 45.834 27.680 1.00 71.55 ? 70 PHE D CE2 1 ATOM 5674 C CZ . PHE D 2 70 ? 0.926 45.579 28.697 1.00 71.92 ? 70 PHE D CZ 1 ATOM 5675 N N . THR D 2 71 ? -0.741 50.714 28.218 1.00 74.65 ? 71 THR D N 1 ATOM 5676 C CA . THR D 2 71 ? -1.692 50.610 29.302 1.00 74.79 ? 71 THR D CA 1 ATOM 5677 C C . THR D 2 71 ? -2.801 49.648 28.923 1.00 75.00 ? 71 THR D C 1 ATOM 5678 O O . THR D 2 71 ? -3.679 49.975 28.131 1.00 75.36 ? 71 THR D O 1 ATOM 5679 C CB . THR D 2 71 ? -2.156 52.019 29.892 1.00 75.11 ? 71 THR D CB 1 ATOM 5680 O OG1 . THR D 2 71 ? -3.582 52.146 29.850 1.00 74.82 ? 71 THR D OG1 1 ATOM 5681 C CG2 . THR D 2 71 ? -1.656 53.207 29.062 1.00 75.39 ? 71 THR D CG2 1 ATOM 5682 N N . PRO D 2 72 ? -2.724 48.441 29.491 1.00 75.05 ? 72 PRO D N 1 ATOM 5683 C CA . PRO D 2 72 ? -3.728 47.404 29.325 1.00 75.00 ? 72 PRO D CA 1 ATOM 5684 C C . PRO D 2 72 ? -5.169 47.848 29.573 1.00 75.71 ? 72 PRO D C 1 ATOM 5685 O O . PRO D 2 72 ? -5.523 48.416 30.630 1.00 76.50 ? 72 PRO D O 1 ATOM 5686 C CB . PRO D 2 72 ? -3.335 46.362 30.370 1.00 75.12 ? 72 PRO D CB 1 ATOM 5687 C CG . PRO D 2 72 ? -2.309 46.977 31.171 1.00 75.12 ? 72 PRO D CG 1 ATOM 5688 C CD . PRO D 2 72 ? -1.623 47.985 30.346 1.00 74.72 ? 72 PRO D CD 1 ATOM 5689 N N . THR D 2 73 ? -5.991 47.581 28.574 1.00 75.58 ? 73 THR D N 1 ATOM 5690 C CA . THR D 2 73 ? -7.384 47.881 28.608 1.00 75.57 ? 73 THR D CA 1 ATOM 5691 C C . THR D 2 73 ? -8.109 46.598 28.242 1.00 76.12 ? 73 THR D C 1 ATOM 5692 O O . THR D 2 73 ? -7.496 45.620 27.808 1.00 76.43 ? 73 THR D O 1 ATOM 5693 C CB . THR D 2 73 ? -7.643 49.022 27.633 1.00 75.42 ? 73 THR D CB 1 ATOM 5694 O OG1 . THR D 2 73 ? -7.431 50.260 28.316 1.00 75.68 ? 73 THR D OG1 1 ATOM 5695 C CG2 . THR D 2 73 ? -9.072 49.129 27.264 1.00 75.23 ? 73 THR D CG2 1 ATOM 5696 N N . GLU D 2 74 ? -9.422 46.620 28.435 1.00 76.81 ? 74 GLU D N 1 ATOM 5697 C CA . GLU D 2 74 ? -10.326 45.519 28.124 1.00 76.64 ? 74 GLU D CA 1 ATOM 5698 C C . GLU D 2 74 ? -10.935 45.715 26.734 1.00 76.31 ? 74 GLU D C 1 ATOM 5699 O O . GLU D 2 74 ? -11.847 44.985 26.348 1.00 76.24 ? 74 GLU D O 1 ATOM 5700 C CB . GLU D 2 74 ? -11.445 45.457 29.186 1.00 76.66 ? 74 GLU D CB 1 ATOM 5701 C CG . GLU D 2 74 ? -12.278 46.742 29.334 1.00 77.81 ? 74 GLU D CG 1 ATOM 5702 C CD . GLU D 2 74 ? -11.538 47.906 30.018 1.00 79.35 ? 74 GLU D CD 1 ATOM 5703 O OE1 . GLU D 2 74 ? -12.025 49.061 29.954 1.00 77.99 ? 74 GLU D OE1 1 ATOM 5704 O OE2 . GLU D 2 74 ? -10.464 47.675 30.625 1.00 80.15 ? 74 GLU D OE2 1 ATOM 5705 N N . THR D 2 75 ? -10.428 46.705 25.999 1.00 75.70 ? 75 THR D N 1 ATOM 5706 C CA . THR D 2 75 ? -10.885 47.022 24.640 1.00 75.23 ? 75 THR D CA 1 ATOM 5707 C C . THR D 2 75 ? -9.723 47.075 23.644 1.00 75.00 ? 75 THR D C 1 ATOM 5708 O O . THR D 2 75 ? -9.941 47.212 22.439 1.00 75.50 ? 75 THR D O 1 ATOM 5709 C CB . THR D 2 75 ? -11.612 48.384 24.591 1.00 75.32 ? 75 THR D CB 1 ATOM 5710 O OG1 . THR D 2 75 ? -10.899 49.322 25.399 1.00 75.26 ? 75 THR D OG1 1 ATOM 5711 C CG2 . THR D 2 75 ? -13.000 48.319 25.210 1.00 75.24 ? 75 THR D CG2 1 ATOM 5712 N N . ASP D 2 76 ? -8.500 46.972 24.139 1.00 74.01 ? 76 ASP D N 1 ATOM 5713 C CA . ASP D 2 76 ? -7.329 47.010 23.285 1.00 73.59 ? 76 ASP D CA 1 ATOM 5714 C C . ASP D 2 76 ? -6.645 45.637 23.227 1.00 73.02 ? 76 ASP D C 1 ATOM 5715 O O . ASP D 2 76 ? -6.548 44.952 24.242 1.00 72.94 ? 76 ASP D O 1 ATOM 5716 C CB . ASP D 2 76 ? -6.335 48.051 23.799 1.00 73.79 ? 76 ASP D CB 1 ATOM 5717 C CG . ASP D 2 76 ? -6.895 49.485 23.775 1.00 75.02 ? 76 ASP D CG 1 ATOM 5718 O OD1 . ASP D 2 76 ? -7.337 49.961 22.711 1.00 73.46 ? 76 ASP D OD1 1 ATOM 5719 O OD2 . ASP D 2 76 ? -6.922 50.218 24.781 1.00 78.36 ? 76 ASP D OD2 1 ATOM 5720 N N . THR D 2 77 ? -6.181 45.253 22.036 1.00 71.87 ? 77 THR D N 1 ATOM 5721 C CA . THR D 2 77 ? -5.363 44.056 21.853 1.00 71.48 ? 77 THR D CA 1 ATOM 5722 C C . THR D 2 77 ? -3.940 44.483 21.502 1.00 70.51 ? 77 THR D C 1 ATOM 5723 O O . THR D 2 77 ? -3.753 45.482 20.825 1.00 70.18 ? 77 THR D O 1 ATOM 5724 C CB . THR D 2 77 ? -5.861 43.215 20.680 1.00 71.55 ? 77 THR D CB 1 ATOM 5725 O OG1 . THR D 2 77 ? -5.631 43.948 19.475 1.00 72.46 ? 77 THR D OG1 1 ATOM 5726 C CG2 . THR D 2 77 ? -7.378 42.981 20.717 1.00 71.37 ? 77 THR D CG2 1 ATOM 5727 N N . TYR D 2 78 ? -2.960 43.712 21.959 1.00 69.67 ? 78 TYR D N 1 ATOM 5728 C CA . TYR D 2 78 ? -1.534 43.965 21.715 1.00 69.12 ? 78 TYR D CA 1 ATOM 5729 C C . TYR D 2 78 ? -0.875 42.725 21.132 1.00 68.90 ? 78 TYR D C 1 ATOM 5730 O O . TYR D 2 78 ? -1.111 41.599 21.618 1.00 68.52 ? 78 TYR D O 1 ATOM 5731 C CB . TYR D 2 78 ? -0.817 44.406 23.001 1.00 68.75 ? 78 TYR D CB 1 ATOM 5732 C CG . TYR D 2 78 ? -1.329 45.718 23.517 1.00 69.24 ? 78 TYR D CG 1 ATOM 5733 C CD1 . TYR D 2 78 ? -2.402 45.759 24.418 1.00 71.81 ? 78 TYR D CD1 1 ATOM 5734 C CD2 . TYR D 2 78 ? -0.774 46.915 23.107 1.00 68.19 ? 78 TYR D CD2 1 ATOM 5735 C CE1 . TYR D 2 78 ? -2.893 46.956 24.895 1.00 69.40 ? 78 TYR D CE1 1 ATOM 5736 C CE2 . TYR D 2 78 ? -1.261 48.126 23.586 1.00 67.86 ? 78 TYR D CE2 1 ATOM 5737 C CZ . TYR D 2 78 ? -2.320 48.133 24.478 1.00 69.18 ? 78 TYR D CZ 1 ATOM 5738 O OH . TYR D 2 78 ? -2.837 49.322 24.975 1.00 71.61 ? 78 TYR D OH 1 ATOM 5739 N N . ALA D 2 79 ? -0.063 42.943 20.094 1.00 68.11 ? 79 ALA D N 1 ATOM 5740 C CA . ALA D 2 79 ? 0.595 41.858 19.378 1.00 68.33 ? 79 ALA D CA 1 ATOM 5741 C C . ALA D 2 79 ? 2.035 42.180 19.016 1.00 68.89 ? 79 ALA D C 1 ATOM 5742 O O . ALA D 2 79 ? 2.469 43.325 19.065 1.00 67.59 ? 79 ALA D O 1 ATOM 5743 C CB . ALA D 2 79 ? -0.178 41.507 18.143 1.00 67.14 ? 79 ALA D CB 1 ATOM 5744 N N . CYS D 2 80 ? 2.781 41.153 18.647 1.00 70.27 ? 80 CYS D N 1 ATOM 5745 C CA . CYS D 2 80 ? 4.124 41.392 18.133 1.00 71.37 ? 80 CYS D CA 1 ATOM 5746 C C . CYS D 2 80 ? 4.151 40.701 16.809 1.00 71.47 ? 80 CYS D C 1 ATOM 5747 O O . CYS D 2 80 ? 3.750 39.533 16.729 1.00 73.09 ? 80 CYS D O 1 ATOM 5748 C CB . CYS D 2 80 ? 5.186 40.821 19.065 1.00 71.19 ? 80 CYS D CB 1 ATOM 5749 S SG . CYS D 2 80 ? 6.900 41.286 18.664 1.00 73.40 ? 80 CYS D SG 1 ATOM 5750 N N . ARG D 2 81 ? 4.608 41.412 15.779 1.00 71.22 ? 81 ARG D N 1 ATOM 5751 C CA . ARG D 2 81 ? 4.712 40.862 14.424 1.00 71.34 ? 81 ARG D CA 1 ATOM 5752 C C . ARG D 2 81 ? 6.159 40.800 13.954 1.00 71.55 ? 81 ARG D C 1 ATOM 5753 O O . ARG D 2 81 ? 6.899 41.781 14.056 1.00 70.79 ? 81 ARG D O 1 ATOM 5754 C CB . ARG D 2 81 ? 3.880 41.673 13.446 1.00 71.20 ? 81 ARG D CB 1 ATOM 5755 C CG . ARG D 2 81 ? 3.843 41.121 12.051 1.00 70.95 ? 81 ARG D CG 1 ATOM 5756 C CD . ARG D 2 81 ? 2.870 41.855 11.194 1.00 72.23 ? 81 ARG D CD 1 ATOM 5757 N NE . ARG D 2 81 ? 1.514 41.495 11.596 1.00 76.37 ? 81 ARG D NE 1 ATOM 5758 C CZ . ARG D 2 81 ? 0.401 42.122 11.216 1.00 76.37 ? 81 ARG D CZ 1 ATOM 5759 N NH1 . ARG D 2 81 ? 0.460 43.176 10.411 1.00 76.69 ? 81 ARG D NH1 1 ATOM 5760 N NH2 . ARG D 2 81 ? -0.775 41.691 11.652 1.00 74.21 ? 81 ARG D NH2 1 ATOM 5761 N N . VAL D 2 82 ? 6.558 39.644 13.430 1.00 71.85 ? 82 VAL D N 1 ATOM 5762 C CA . VAL D 2 82 ? 7.962 39.454 13.080 1.00 71.72 ? 82 VAL D CA 1 ATOM 5763 C C . VAL D 2 82 ? 8.128 38.952 11.650 1.00 72.49 ? 82 VAL D C 1 ATOM 5764 O O . VAL D 2 82 ? 7.591 37.907 11.286 1.00 72.77 ? 82 VAL D O 1 ATOM 5765 C CB . VAL D 2 82 ? 8.700 38.577 14.175 1.00 72.04 ? 82 VAL D CB 1 ATOM 5766 C CG1 . VAL D 2 82 ? 10.130 38.256 13.824 1.00 70.85 ? 82 VAL D CG1 1 ATOM 5767 C CG2 . VAL D 2 82 ? 8.652 39.255 15.520 1.00 70.05 ? 82 VAL D CG2 1 ATOM 5768 N N . LYS D 2 83 ? 8.868 39.733 10.849 1.00 72.80 ? 83 LYS D N 1 ATOM 5769 C CA . LYS D 2 83 ? 9.260 39.365 9.484 1.00 72.92 ? 83 LYS D CA 1 ATOM 5770 C C . LYS D 2 83 ? 10.698 38.838 9.395 1.00 72.54 ? 83 LYS D C 1 ATOM 5771 O O . LYS D 2 83 ? 11.648 39.562 9.691 1.00 72.70 ? 83 LYS D O 1 ATOM 5772 C CB . LYS D 2 83 ? 9.103 40.544 8.516 1.00 73.33 ? 83 LYS D CB 1 ATOM 5773 C CG . LYS D 2 83 ? 7.889 40.476 7.660 1.00 74.60 ? 83 LYS D CG 1 ATOM 5774 C CD . LYS D 2 83 ? 8.212 40.969 6.262 1.00 78.14 ? 83 LYS D CD 1 ATOM 5775 C CE . LYS D 2 83 ? 7.158 40.500 5.260 1.00 79.42 ? 83 LYS D CE 1 ATOM 5776 N NZ . LYS D 2 83 ? 7.497 40.983 3.897 1.00 81.39 ? 83 LYS D NZ 1 ATOM 5777 N N . HIS D 2 84 ? 10.833 37.582 8.984 1.00 72.26 ? 84 HIS D N 1 ATOM 5778 C CA . HIS D 2 84 ? 12.120 36.939 8.821 1.00 72.21 ? 84 HIS D CA 1 ATOM 5779 C C . HIS D 2 84 ? 12.190 36.078 7.570 1.00 72.99 ? 84 HIS D C 1 ATOM 5780 O O . HIS D 2 84 ? 11.180 35.510 7.152 1.00 73.09 ? 84 HIS D O 1 ATOM 5781 C CB . HIS D 2 84 ? 12.464 36.091 10.048 1.00 71.98 ? 84 HIS D CB 1 ATOM 5782 C CG . HIS D 2 84 ? 13.897 35.664 10.083 1.00 70.27 ? 84 HIS D CG 1 ATOM 5783 N ND1 . HIS D 2 84 ? 14.296 34.371 9.835 1.00 69.99 ? 84 HIS D ND1 1 ATOM 5784 C CD2 . HIS D 2 84 ? 15.026 36.369 10.322 1.00 69.89 ? 84 HIS D CD2 1 ATOM 5785 C CE1 . HIS D 2 84 ? 15.611 34.297 9.926 1.00 70.52 ? 84 HIS D CE1 1 ATOM 5786 N NE2 . HIS D 2 84 ? 16.078 35.498 10.222 1.00 69.85 ? 84 HIS D NE2 1 ATOM 5787 N N . ALA D 2 85 ? 13.381 35.974 6.973 1.00 73.74 ? 85 ALA D N 1 ATOM 5788 C CA . ALA D 2 85 ? 13.550 35.195 5.740 1.00 74.72 ? 85 ALA D CA 1 ATOM 5789 C C . ALA D 2 85 ? 13.163 33.709 5.868 1.00 75.49 ? 85 ALA D C 1 ATOM 5790 O O . ALA D 2 85 ? 12.751 33.097 4.871 1.00 75.60 ? 85 ALA D O 1 ATOM 5791 C CB . ALA D 2 85 ? 14.948 35.370 5.151 1.00 74.78 ? 85 ALA D CB 1 ATOM 5792 N N . SER D 2 86 ? 13.291 33.149 7.083 1.00 76.07 ? 86 SER D N 1 ATOM 5793 C CA . SER D 2 86 ? 12.804 31.794 7.432 1.00 76.83 ? 86 SER D CA 1 ATOM 5794 C C . SER D 2 86 ? 11.317 31.524 7.209 1.00 76.80 ? 86 SER D C 1 ATOM 5795 O O . SER D 2 86 ? 10.902 30.371 7.092 1.00 76.09 ? 86 SER D O 1 ATOM 5796 C CB . SER D 2 86 ? 13.035 31.523 8.907 1.00 77.11 ? 86 SER D CB 1 ATOM 5797 O OG . SER D 2 86 ? 14.311 30.959 9.109 1.00 80.27 ? 86 SER D OG 1 ATOM 5798 N N . MET D 2 87 ? 10.518 32.581 7.165 1.00 77.27 ? 87 MET D N 1 ATOM 5799 C CA . MET D 2 87 ? 9.076 32.414 7.122 1.00 78.84 ? 87 MET D CA 1 ATOM 5800 C C . MET D 2 87 ? 8.460 33.065 5.893 1.00 78.58 ? 87 MET D C 1 ATOM 5801 O O . MET D 2 87 ? 8.898 34.145 5.481 1.00 78.55 ? 87 MET D O 1 ATOM 5802 C CB . MET D 2 87 ? 8.448 32.987 8.395 1.00 78.73 ? 87 MET D CB 1 ATOM 5803 C CG . MET D 2 87 ? 9.157 32.582 9.695 1.00 80.51 ? 87 MET D CG 1 ATOM 5804 S SD . MET D 2 87 ? 8.304 33.196 11.161 1.00 81.03 ? 87 MET D SD 1 ATOM 5805 C CE . MET D 2 87 ? 6.877 32.109 11.040 1.00 83.19 ? 87 MET D CE 1 ATOM 5806 N N . ALA D 2 88 ? 7.452 32.397 5.318 1.00 78.71 ? 88 ALA D N 1 ATOM 5807 C CA . ALA D 2 88 ? 6.719 32.918 4.166 1.00 78.51 ? 88 ALA D CA 1 ATOM 5808 C C . ALA D 2 88 ? 6.149 34.294 4.481 1.00 78.37 ? 88 ALA D C 1 ATOM 5809 O O . ALA D 2 88 ? 6.630 35.293 3.942 1.00 78.83 ? 88 ALA D O 1 ATOM 5810 C CB . ALA D 2 88 ? 5.608 31.959 3.728 1.00 78.54 ? 88 ALA D CB 1 ATOM 5811 N N . GLU D 2 89 ? 5.137 34.344 5.351 1.00 77.79 ? 89 GLU D N 1 ATOM 5812 C CA . GLU D 2 89 ? 4.510 35.610 5.760 1.00 76.65 ? 89 GLU D CA 1 ATOM 5813 C C . GLU D 2 89 ? 4.980 36.011 7.155 1.00 76.06 ? 89 GLU D C 1 ATOM 5814 O O . GLU D 2 89 ? 5.583 35.191 7.863 1.00 76.22 ? 89 GLU D O 1 ATOM 5815 C CB . GLU D 2 89 ? 2.987 35.207 5.674 0.00 40.00 ? 89 GLU D CB 1 ATOM 5816 C CG . GLU D 2 89 ? 2.324 34.439 6.825 0.00 40.00 ? 89 GLU D CG 1 ATOM 5817 C CD . GLU D 2 89 ? 0.836 34.777 7.020 0.00 40.00 ? 89 GLU D CD 1 ATOM 5818 O OE1 . GLU D 2 89 ? 0.001 34.334 6.191 0.00 40.00 ? 89 GLU D OE1 1 ATOM 5819 O OE2 . GLU D 2 89 ? 0.491 35.465 8.015 0.00 40.00 ? 89 GLU D OE2 1 ATOM 5820 N N . PRO D 2 90 ? 4.727 37.258 7.567 1.00 75.54 ? 90 PRO D N 1 ATOM 5821 C CA . PRO D 2 90 ? 5.063 37.690 8.939 1.00 74.80 ? 90 PRO D CA 1 ATOM 5822 C C . PRO D 2 90 ? 4.369 36.821 9.993 1.00 74.33 ? 90 PRO D C 1 ATOM 5823 O O . PRO D 2 90 ? 3.316 36.268 9.733 1.00 73.49 ? 90 PRO D O 1 ATOM 5824 C CB . PRO D 2 90 ? 4.551 39.131 9.006 1.00 74.68 ? 90 PRO D CB 1 ATOM 5825 C CG . PRO D 2 90 ? 4.410 39.572 7.572 1.00 75.51 ? 90 PRO D CG 1 ATOM 5826 C CD . PRO D 2 90 ? 4.125 38.341 6.771 1.00 75.44 ? 90 PRO D CD 1 ATOM 5827 N N . LYS D 2 91 ? 4.971 36.698 11.170 1.00 74.32 ? 91 LYS D N 1 ATOM 5828 C CA . LYS D 2 91 ? 4.379 35.911 12.236 1.00 74.14 ? 91 LYS D CA 1 ATOM 5829 C C . LYS D 2 91 ? 3.933 36.881 13.315 1.00 73.29 ? 91 LYS D C 1 ATOM 5830 O O . LYS D 2 91 ? 4.712 37.725 13.772 1.00 73.43 ? 91 LYS D O 1 ATOM 5831 C CB . LYS D 2 91 ? 5.378 34.905 12.790 1.00 74.60 ? 91 LYS D CB 1 ATOM 5832 C CG . LYS D 2 91 ? 4.745 33.838 13.643 1.00 77.10 ? 91 LYS D CG 1 ATOM 5833 C CD . LYS D 2 91 ? 5.707 33.387 14.743 1.00 80.83 ? 91 LYS D CD 1 ATOM 5834 C CE . LYS D 2 91 ? 6.756 32.374 14.272 1.00 82.65 ? 91 LYS D CE 1 ATOM 5835 N NZ . LYS D 2 91 ? 7.655 31.939 15.382 1.00 83.98 ? 91 LYS D NZ 1 ATOM 5836 N N . THR D 2 92 ? 2.674 36.764 13.711 1.00 72.57 ? 92 THR D N 1 ATOM 5837 C CA . THR D 2 92 ? 2.106 37.639 14.727 1.00 72.50 ? 92 THR D CA 1 ATOM 5838 C C . THR D 2 92 ? 1.683 36.811 15.927 1.00 71.86 ? 92 THR D C 1 ATOM 5839 O O . THR D 2 92 ? 0.909 35.881 15.790 1.00 72.50 ? 92 THR D O 1 ATOM 5840 C CB . THR D 2 92 ? 0.863 38.389 14.201 1.00 72.20 ? 92 THR D CB 1 ATOM 5841 O OG1 . THR D 2 92 ? 1.102 38.890 12.887 1.00 71.86 ? 92 THR D OG1 1 ATOM 5842 C CG2 . THR D 2 92 ? 0.647 39.635 15.000 1.00 72.44 ? 92 THR D CG2 1 ATOM 5843 N N . VAL D 2 93 ? 2.206 37.155 17.089 1.00 71.05 ? 93 VAL D N 1 ATOM 5844 C CA . VAL D 2 93 ? 1.747 36.581 18.335 1.00 70.48 ? 93 VAL D CA 1 ATOM 5845 C C . VAL D 2 93 ? 1.141 37.635 19.230 1.00 70.84 ? 93 VAL D C 1 ATOM 5846 O O . VAL D 2 93 ? 1.770 38.680 19.541 1.00 69.60 ? 93 VAL D O 1 ATOM 5847 C CB . VAL D 2 93 ? 2.806 35.668 19.094 1.00 70.90 ? 93 VAL D CB 1 ATOM 5848 C CG1 . VAL D 2 93 ? 4.122 35.709 18.479 1.00 72.64 ? 93 VAL D CG1 1 ATOM 5849 C CG2 . VAL D 2 93 ? 2.850 35.891 20.588 1.00 67.40 ? 93 VAL D CG2 1 ATOM 5850 N N . TYR D 2 94 ? -0.093 37.336 19.626 1.00 69.97 ? 94 TYR D N 1 ATOM 5851 C CA . TYR D 2 94 ? -0.870 38.191 20.491 1.00 70.42 ? 94 TYR D CA 1 ATOM 5852 C C . TYR D 2 94 ? -0.477 38.093 21.948 1.00 70.72 ? 94 TYR D C 1 ATOM 5853 O O . TYR D 2 94 ? -0.207 37.001 22.462 1.00 69.56 ? 94 TYR D O 1 ATOM 5854 C CB . TYR D 2 94 ? -2.367 37.905 20.263 1.00 70.70 ? 94 TYR D CB 1 ATOM 5855 C CG . TYR D 2 94 ? -2.810 38.639 19.040 1.00 69.30 ? 94 TYR D CG 1 ATOM 5856 C CD1 . TYR D 2 94 ? -2.698 38.078 17.782 1.00 68.90 ? 94 TYR D CD1 1 ATOM 5857 C CD2 . TYR D 2 94 ? -3.316 39.925 19.149 1.00 70.36 ? 94 TYR D CD2 1 ATOM 5858 C CE1 . TYR D 2 94 ? -3.104 38.793 16.663 1.00 72.00 ? 94 TYR D CE1 1 ATOM 5859 C CE2 . TYR D 2 94 ? -3.722 40.643 18.051 1.00 67.88 ? 94 TYR D CE2 1 ATOM 5860 C CZ . TYR D 2 94 ? -3.616 40.088 16.829 1.00 69.70 ? 94 TYR D CZ 1 ATOM 5861 O OH . TYR D 2 94 ? -4.025 40.833 15.772 1.00 71.37 ? 94 TYR D OH 1 ATOM 5862 N N . TRP D 2 95 ? -0.430 39.239 22.616 1.00 70.94 ? 95 TRP D N 1 ATOM 5863 C CA . TRP D 2 95 ? -0.256 39.227 24.062 1.00 73.01 ? 95 TRP D CA 1 ATOM 5864 C C . TRP D 2 95 ? -1.553 38.715 24.721 1.00 75.02 ? 95 TRP D C 1 ATOM 5865 O O . TRP D 2 95 ? -2.623 39.322 24.560 1.00 75.01 ? 95 TRP D O 1 ATOM 5866 C CB . TRP D 2 95 ? 0.081 40.625 24.553 1.00 72.60 ? 95 TRP D CB 1 ATOM 5867 C CG . TRP D 2 95 ? 0.064 40.847 26.044 1.00 72.75 ? 95 TRP D CG 1 ATOM 5868 C CD1 . TRP D 2 95 ? 0.919 40.320 26.998 1.00 71.46 ? 95 TRP D CD1 1 ATOM 5869 C CD2 . TRP D 2 95 ? -0.849 41.682 26.749 1.00 72.11 ? 95 TRP D CD2 1 ATOM 5870 N NE1 . TRP D 2 95 ? 0.572 40.775 28.249 1.00 68.98 ? 95 TRP D NE1 1 ATOM 5871 C CE2 . TRP D 2 95 ? -0.508 41.619 28.125 1.00 71.66 ? 95 TRP D CE2 1 ATOM 5872 C CE3 . TRP D 2 95 ? -1.942 42.482 26.360 1.00 72.52 ? 95 TRP D CE3 1 ATOM 5873 C CZ2 . TRP D 2 95 ? -1.223 42.326 29.107 1.00 71.42 ? 95 TRP D CZ2 1 ATOM 5874 C CZ3 . TRP D 2 95 ? -2.652 43.190 27.347 1.00 71.99 ? 95 TRP D CZ3 1 ATOM 5875 C CH2 . TRP D 2 95 ? -2.283 43.098 28.696 1.00 72.69 ? 95 TRP D CH2 1 ATOM 5876 N N . ASP D 2 96 ? -1.467 37.600 25.440 1.00 76.59 ? 96 ASP D N 1 ATOM 5877 C CA . ASP D 2 96 ? -2.613 37.129 26.195 1.00 78.57 ? 96 ASP D CA 1 ATOM 5878 C C . ASP D 2 96 ? -2.482 37.814 27.531 1.00 79.87 ? 96 ASP D C 1 ATOM 5879 O O . ASP D 2 96 ? -1.619 37.442 28.337 1.00 80.12 ? 96 ASP D O 1 ATOM 5880 C CB . ASP D 2 96 ? -2.660 35.611 26.347 1.00 78.53 ? 96 ASP D CB 1 ATOM 5881 C CG . ASP D 2 96 ? -3.938 35.137 27.072 1.00 79.98 ? 96 ASP D CG 1 ATOM 5882 O OD1 . ASP D 2 96 ? -4.389 35.826 28.006 1.00 79.81 ? 96 ASP D OD1 1 ATOM 5883 O OD2 . ASP D 2 96 ? -4.557 34.084 26.778 1.00 80.75 ? 96 ASP D OD2 1 ATOM 5884 N N . ARG D 2 97 ? -3.358 38.811 27.713 1.00 81.56 ? 97 ARG D N 1 ATOM 5885 C CA . ARG D 2 97 ? -3.404 39.781 28.817 1.00 82.60 ? 97 ARG D CA 1 ATOM 5886 C C . ARG D 2 97 ? -3.049 39.327 30.222 1.00 83.49 ? 97 ARG D C 1 ATOM 5887 O O . ARG D 2 97 ? -3.544 39.889 31.197 1.00 83.18 ? 97 ARG D O 1 ATOM 5888 C CB . ARG D 2 97 ? -4.890 40.454 28.983 0.00 40.00 ? 97 ARG D CB 1 ATOM 5889 C CG . ARG D 2 97 ? -5.992 39.641 28.324 0.00 40.00 ? 97 ARG D CG 1 ATOM 5890 C CD . ARG D 2 97 ? -5.908 39.723 26.809 0.00 40.00 ? 97 ARG D CD 1 ATOM 5891 N NE . ARG D 2 97 ? -5.213 40.928 26.364 0.00 40.00 ? 97 ARG D NE 1 ATOM 5892 C CZ . ARG D 2 97 ? -5.003 41.242 25.090 0.00 40.00 ? 97 ARG D CZ 1 ATOM 5893 N NH1 . ARG D 2 97 ? -5.436 40.438 24.129 0.00 40.00 ? 97 ARG D NH1 1 ATOM 5894 N NH2 . ARG D 2 97 ? -4.360 42.359 24.780 0.00 40.00 ? 97 ARG D NH2 1 ATOM 5895 N N . ASP D 2 98 ? -2.195 38.315 30.300 1.00 84.39 ? 98 ASP D N 1 ATOM 5896 C CA . ASP D 2 98 ? -1.785 37.689 31.546 1.00 86.15 ? 98 ASP D CA 1 ATOM 5897 C C . ASP D 2 98 ? -0.279 37.936 31.765 1.00 87.57 ? 98 ASP D C 1 ATOM 5898 O O . ASP D 2 98 ? 0.129 38.548 32.787 1.00 88.01 ? 98 ASP D O 1 ATOM 5899 C CB . ASP D 2 98 ? -2.077 36.189 31.491 1.00 85.77 ? 98 ASP D CB 1 ATOM 5900 C CG . ASP D 2 98 ? -3.563 35.866 31.518 1.00 87.41 ? 98 ASP D CG 1 ATOM 5901 O OD1 . ASP D 2 98 ? -4.390 36.791 31.679 1.00 92.08 ? 98 ASP D OD1 1 ATOM 5902 O OD2 . ASP D 2 98 ? -4.009 34.705 31.395 1.00 84.77 ? 98 ASP D OD2 1 ATOM 5903 N N . MET D 2 99 ? 0.526 37.457 30.793 1.00 88.42 ? 99 MET D N 1 ATOM 5904 C CA . MET D 2 99 ? 1.997 37.555 30.777 1.00 89.27 ? 99 MET D CA 1 ATOM 5905 C C . MET D 2 99 ? 2.554 38.963 30.950 1.00 88.65 ? 99 MET D C 1 ATOM 5906 O O . MET D 2 99 ? 3.569 39.102 31.629 1.00 88.99 ? 99 MET D O 1 ATOM 5907 C CB . MET D 2 99 ? 2.574 36.920 29.516 1.00 88.44 ? 99 MET D CB 1 ATOM 5908 C CG . MET D 2 99 ? 2.790 35.420 29.666 1.00 90.31 ? 99 MET D CG 1 ATOM 5909 S SD . MET D 2 99 ? 3.747 34.683 28.329 1.00 92.11 ? 99 MET D SD 1 ATOM 5910 C CE . MET D 2 99 ? 5.460 35.078 28.732 1.00 90.34 ? 99 MET D CE 1 ATOM 5911 O OXT . MET D 2 99 ? 2.020 39.950 30.433 1.00 88.61 ? 99 MET D OXT 1 HETATM 5912 C C1 . NAG E 3 . ? -1.993 6.285 0.343 1.00 76.04 ? 500 NAG A C1 1 HETATM 5913 C C2 . NAG E 3 . ? -2.772 6.961 -0.802 1.00 77.75 ? 500 NAG A C2 1 HETATM 5914 C C3 . NAG E 3 . ? -3.712 8.060 -0.261 1.00 77.21 ? 500 NAG A C3 1 HETATM 5915 C C4 . NAG E 3 . ? -4.561 7.575 0.937 1.00 76.92 ? 500 NAG A C4 1 HETATM 5916 C C5 . NAG E 3 . ? -3.751 6.746 1.947 1.00 76.64 ? 500 NAG A C5 1 HETATM 5917 C C6 . NAG E 3 . ? -4.659 5.896 2.829 1.00 76.29 ? 500 NAG A C6 1 HETATM 5918 C C7 . NAG E 3 . ? -1.309 6.661 -2.783 1.00 76.89 ? 500 NAG A C7 1 HETATM 5919 C C8 . NAG E 3 . ? 0.192 6.661 -2.844 1.00 76.64 ? 500 NAG A C8 1 HETATM 5920 N N2 . NAG E 3 . ? -1.888 7.449 -1.866 1.00 77.38 ? 500 NAG A N2 1 HETATM 5921 O O3 . NAG E 3 . ? -4.560 8.505 -1.304 1.00 76.61 ? 500 NAG A O3 1 HETATM 5922 O O4 . NAG E 3 . ? -5.193 8.644 1.618 1.00 74.75 ? 500 NAG A O4 1 HETATM 5923 O O5 . NAG E 3 . ? -2.939 5.806 1.276 1.00 77.00 ? 500 NAG A O5 1 HETATM 5924 O O6 . NAG E 3 . ? -5.382 6.710 3.714 1.00 77.06 ? 500 NAG A O6 1 HETATM 5925 O O7 . NAG E 3 . ? -1.944 5.953 -3.559 1.00 76.85 ? 500 NAG A O7 1 HETATM 5926 C C1 . NAG F 3 . ? 3.043 11.987 10.706 1.00 71.39 ? 501 NAG A C1 1 HETATM 5927 C C2 . NAG F 3 . ? 2.314 12.494 9.460 1.00 74.64 ? 501 NAG A C2 1 HETATM 5928 C C3 . NAG F 3 . ? 3.193 13.067 8.319 1.00 75.07 ? 501 NAG A C3 1 HETATM 5929 C C4 . NAG F 3 . ? 4.546 13.631 8.762 1.00 74.17 ? 501 NAG A C4 1 HETATM 5930 C C5 . NAG F 3 . ? 5.132 12.766 9.884 1.00 73.48 ? 501 NAG A C5 1 HETATM 5931 C C6 . NAG F 3 . ? 6.373 13.383 10.491 1.00 75.69 ? 501 NAG A C6 1 HETATM 5932 C C7 . NAG F 3 . ? 0.160 11.665 8.701 1.00 75.58 ? 501 NAG A C7 1 HETATM 5933 C C8 . NAG F 3 . ? -0.560 10.698 7.805 1.00 76.26 ? 501 NAG A C8 1 HETATM 5934 N N2 . NAG F 3 . ? 1.454 11.434 8.963 1.00 74.25 ? 501 NAG A N2 1 HETATM 5935 O O3 . NAG F 3 . ? 2.486 14.103 7.666 1.00 74.74 ? 501 NAG A O3 1 HETATM 5936 O O4 . NAG F 3 . ? 5.417 13.805 7.642 1.00 74.98 ? 501 NAG A O4 1 HETATM 5937 O O5 . NAG F 3 . ? 4.210 12.717 10.949 1.00 71.47 ? 501 NAG A O5 1 HETATM 5938 O O6 . NAG F 3 . ? 6.021 14.609 11.140 1.00 77.38 ? 501 NAG A O6 1 HETATM 5939 O O7 . NAG F 3 . ? -0.464 12.618 9.158 1.00 75.03 ? 501 NAG A O7 1 HETATM 5940 C C1 . NAG G 3 . ? 21.715 -5.651 28.999 1.00 68.13 ? 511 NAG A C1 1 HETATM 5941 C C2 . NAG G 3 . ? 23.231 -5.824 28.878 1.00 66.75 ? 511 NAG A C2 1 HETATM 5942 C C3 . NAG G 3 . ? 23.525 -7.076 28.063 1.00 67.51 ? 511 NAG A C3 1 HETATM 5943 C C4 . NAG G 3 . ? 22.889 -8.317 28.686 1.00 68.88 ? 511 NAG A C4 1 HETATM 5944 C C5 . NAG G 3 . ? 21.393 -7.995 28.861 1.00 69.67 ? 511 NAG A C5 1 HETATM 5945 C C6 . NAG G 3 . ? 20.506 -9.033 29.537 1.00 70.37 ? 511 NAG A C6 1 HETATM 5946 C C7 . NAG G 3 . ? 24.289 -3.610 28.820 1.00 67.56 ? 511 NAG A C7 1 HETATM 5947 C C8 . NAG G 3 . ? 24.666 -2.496 27.883 1.00 65.68 ? 511 NAG A C8 1 HETATM 5948 N N2 . NAG G 3 . ? 23.842 -4.702 28.215 1.00 66.17 ? 511 NAG A N2 1 HETATM 5949 O O3 . NAG G 3 . ? 24.895 -7.270 27.932 1.00 63.03 ? 511 NAG A O3 1 HETATM 5950 O O4 . NAG G 3 . ? 23.144 -9.378 27.783 1.00 69.13 ? 511 NAG A O4 1 HETATM 5951 O O5 . NAG G 3 . ? 21.232 -6.817 29.627 1.00 69.77 ? 511 NAG A O5 1 HETATM 5952 O O6 . NAG G 3 . ? 21.325 -9.809 30.369 1.00 71.17 ? 511 NAG A O6 1 HETATM 5953 O O7 . NAG G 3 . ? 24.410 -3.481 30.054 1.00 70.28 ? 511 NAG A O7 1 HETATM 5954 C C1 . NAG H 3 . ? 23.933 -10.461 28.317 1.00 69.96 ? 512 NAG A C1 1 HETATM 5955 C C2 . NAG H 3 . ? 23.667 -11.695 27.457 1.00 71.15 ? 512 NAG A C2 1 HETATM 5956 C C3 . NAG H 3 . ? 24.574 -12.870 27.792 1.00 69.98 ? 512 NAG A C3 1 HETATM 5957 C C4 . NAG H 3 . ? 26.032 -12.468 27.737 1.00 69.64 ? 512 NAG A C4 1 HETATM 5958 C C5 . NAG H 3 . ? 26.231 -11.226 28.629 1.00 70.11 ? 512 NAG A C5 1 HETATM 5959 C C6 . NAG H 3 . ? 27.634 -10.635 28.471 1.00 72.62 ? 512 NAG A C6 1 HETATM 5960 C C7 . NAG H 3 . ? 21.636 -12.364 26.350 1.00 76.59 ? 512 NAG A C7 1 HETATM 5961 C C8 . NAG H 3 . ? 20.450 -13.274 26.453 1.00 75.95 ? 512 NAG A C8 1 HETATM 5962 N N2 . NAG H 3 . ? 22.266 -12.087 27.493 1.00 74.64 ? 512 NAG A N2 1 HETATM 5963 O O3 . NAG H 3 . ? 24.390 -13.843 26.800 1.00 71.20 ? 512 NAG A O3 1 HETATM 5964 O O4 . NAG H 3 . ? 26.861 -13.593 28.016 1.00 67.15 ? 512 NAG A O4 1 HETATM 5965 O O5 . NAG H 3 . ? 25.317 -10.181 28.300 1.00 70.67 ? 512 NAG A O5 1 HETATM 5966 O O6 . NAG H 3 . ? 27.802 -10.103 27.163 1.00 74.26 ? 512 NAG A O6 1 HETATM 5967 O O7 . NAG H 3 . ? 21.993 -11.909 25.253 1.00 78.42 ? 512 NAG A O7 1 HETATM 5968 C C17 . PBS I 4 . ? 9.293 -4.285 8.041 1.00 93.76 ? 601 PBS A C17 1 HETATM 5969 C C16 . PBS I 4 . ? 10.088 -5.411 8.707 1.00 92.02 ? 601 PBS A C16 1 HETATM 5970 C C15 . PBS I 4 . ? 9.602 -5.654 10.131 1.00 91.01 ? 601 PBS A C15 1 HETATM 5971 C C14 . PBS I 4 . ? 10.701 -5.294 11.129 1.00 88.38 ? 601 PBS A C14 1 HETATM 5972 C C13 . PBS I 4 . ? 10.245 -5.581 12.554 1.00 85.06 ? 601 PBS A C13 1 HETATM 5973 C C12 . PBS I 4 . ? 11.392 -5.340 13.524 1.00 81.21 ? 601 PBS A C12 1 HETATM 5974 C C11 . PBS I 4 . ? 11.598 -3.837 13.739 1.00 79.64 ? 601 PBS A C11 1 HETATM 5975 C C10 . PBS I 4 . ? 11.898 -3.492 15.175 1.00 74.14 ? 601 PBS A C10 1 HETATM 5976 C C9 . PBS I 4 . ? 11.652 -1.987 15.320 1.00 80.05 ? 601 PBS A C9 1 HETATM 5977 C C8 . PBS I 4 . ? 12.729 -1.249 16.144 1.00 78.33 ? 601 PBS A C8 1 HETATM 5978 C C7 . PBS I 4 . ? 13.748 -0.622 15.214 1.00 77.84 ? 601 PBS A C7 1 HETATM 5979 C C6 . PBS I 4 . ? 14.263 0.779 15.630 1.00 77.71 ? 601 PBS A C6 1 HETATM 5980 C C5 . PBS I 4 . ? 14.534 1.522 14.308 1.00 77.14 ? 601 PBS A C5 1 HETATM 5981 C C4 . PBS I 4 . ? 15.611 2.654 14.334 1.00 78.71 ? 601 PBS A C4 1 HETATM 5982 C C3 . PBS I 4 . ? 17.022 2.114 14.000 1.00 77.76 ? 601 PBS A C3 1 HETATM 5983 O O32 . PBS I 4 . ? 16.956 1.165 12.936 1.00 75.03 ? 601 PBS A O32 1 HETATM 5984 C C2 . PBS I 4 . ? 18.015 3.207 13.577 1.00 77.37 ? 601 PBS A C2 1 HETATM 5985 O O1 . PBS I 4 . ? 17.611 3.642 12.295 1.00 77.38 ? 601 PBS A O1 1 HETATM 5986 C C1 . PBS I 4 . ? 18.110 4.439 14.508 1.00 77.98 ? 601 PBS A C1 1 HETATM 5987 N N . PBS I 4 . ? 18.448 4.121 15.935 1.00 78.23 ? 601 PBS A N 1 HETATM 5988 C C18 . PBS I 4 . ? 17.929 4.848 16.942 1.00 78.55 ? 601 PBS A C18 1 HETATM 5989 O O2 . PBS I 4 . ? 17.161 5.787 16.766 1.00 78.58 ? 601 PBS A O2 1 HETATM 5990 C C19 . PBS I 4 . ? 18.316 4.485 18.369 1.00 78.18 ? 601 PBS A C19 1 HETATM 5991 C C20 . PBS I 4 . ? 17.560 3.306 18.933 1.00 79.55 ? 601 PBS A C20 1 HETATM 5992 C C21 . PBS I 4 . ? 16.142 3.570 19.431 1.00 80.39 ? 601 PBS A C21 1 HETATM 5993 C C22 . PBS I 4 . ? 15.377 2.241 19.227 1.00 81.15 ? 601 PBS A C22 1 HETATM 5994 C C23 . PBS I 4 . ? 14.570 1.838 20.463 1.00 84.54 ? 601 PBS A C23 1 HETATM 5995 C C24 . PBS I 4 . ? 13.216 1.212 20.106 1.00 85.93 ? 601 PBS A C24 1 HETATM 5996 C C25 . PBS I 4 . ? 12.247 1.272 21.287 1.00 87.24 ? 601 PBS A C25 1 HETATM 5997 C C . PBS I 4 . ? 19.134 5.442 13.950 1.00 78.29 ? 601 PBS A C 1 HETATM 5998 O OC1 . PBS I 4 . ? 20.400 4.737 13.859 1.00 79.30 ? 601 PBS A OC1 1 HETATM 5999 C CG1 . PBS I 4 . ? 21.670 5.461 13.657 1.00 79.50 ? 601 PBS A CG1 1 HETATM 6000 O OG . PBS I 4 . ? 21.860 6.407 14.682 1.00 80.93 ? 601 PBS A OG 1 HETATM 6001 C CG . PBS I 4 . ? 22.124 5.875 16.030 1.00 81.37 ? 601 PBS A CG 1 HETATM 6002 C CG5 . PBS I 4 . ? 22.094 7.117 16.923 1.00 82.59 ? 601 PBS A CG5 1 HETATM 6003 O OG6 . PBS I 4 . ? 20.704 7.319 17.245 1.00 83.79 ? 601 PBS A OG6 1 HETATM 6004 C CG4 . PBS I 4 . ? 23.365 4.965 16.123 1.00 80.29 ? 601 PBS A CG4 1 HETATM 6005 O OG5 . PBS I 4 . ? 24.617 5.680 15.965 1.00 81.77 ? 601 PBS A OG5 1 HETATM 6006 C CG3 . PBS I 4 . ? 23.246 3.912 15.031 1.00 79.68 ? 601 PBS A CG3 1 HETATM 6007 O OG4 . PBS I 4 . ? 24.460 3.173 15.000 1.00 76.11 ? 601 PBS A OG4 1 HETATM 6008 C CG2 . PBS I 4 . ? 22.913 4.526 13.639 1.00 80.04 ? 601 PBS A CG2 1 HETATM 6009 O OG3 . PBS I 4 . ? 22.655 3.459 12.730 1.00 79.97 ? 601 PBS A OG3 1 HETATM 6010 C C27 . R16 J 5 . ? 8.592 2.109 22.071 1.00 87.41 ? 701 R16 A C27 1 HETATM 6011 C C28 . R16 J 5 . ? 8.643 3.626 22.443 1.00 87.47 ? 701 R16 A C28 1 HETATM 6012 C C29 . R16 J 5 . ? 7.525 4.453 21.737 1.00 85.82 ? 701 R16 A C29 1 HETATM 6013 C C30 . R16 J 5 . ? 7.706 5.971 21.973 1.00 82.99 ? 701 R16 A C30 1 HETATM 6014 C C31 . R16 J 5 . ? 7.363 6.408 23.423 1.00 84.24 ? 701 R16 A C31 1 HETATM 6015 C C32 . R16 J 5 . ? 8.161 7.641 24.017 1.00 80.14 ? 701 R16 A C32 1 HETATM 6016 C C33 . R16 J 5 . ? 7.911 7.703 25.542 1.00 80.80 ? 701 R16 A C33 1 HETATM 6017 C C34 . R16 J 5 . ? 8.963 8.498 26.364 1.00 84.79 ? 701 R16 A C34 1 HETATM 6018 C C35 . R16 J 5 . ? 8.973 8.208 27.886 1.00 84.84 ? 701 R16 A C35 1 HETATM 6019 C C36 . R16 J 5 . ? 9.791 6.925 28.232 1.00 84.08 ? 701 R16 A C36 1 HETATM 6020 C C37 . R16 J 5 . ? 11.107 7.163 29.004 1.00 82.18 ? 701 R16 A C37 1 HETATM 6021 C C38 . R16 J 5 . ? 11.791 5.821 29.407 1.00 83.22 ? 701 R16 A C38 1 HETATM 6022 C C39 . R16 J 5 . ? 12.779 5.275 28.333 1.00 83.60 ? 701 R16 A C39 1 HETATM 6023 C C40 . R16 J 5 . ? 12.795 3.738 28.148 1.00 82.84 ? 701 R16 A C40 1 HETATM 6024 C C41 . R16 J 5 . ? 11.735 3.272 27.117 1.00 83.72 ? 701 R16 A C41 1 HETATM 6025 C C42 . R16 J 5 . ? 11.989 1.853 26.585 1.00 81.35 ? 701 R16 A C42 1 HETATM 6026 C C1 . NAG K 3 . ? 30.313 50.126 7.552 1.00 76.62 ? 501 NAG C C1 1 HETATM 6027 C C2 . NAG K 3 . ? 29.689 50.642 6.251 1.00 78.09 ? 501 NAG C C2 1 HETATM 6028 C C3 . NAG K 3 . ? 30.680 51.099 5.166 1.00 78.34 ? 501 NAG C C3 1 HETATM 6029 C C4 . NAG K 3 . ? 31.859 51.908 5.709 1.00 77.91 ? 501 NAG C C4 1 HETATM 6030 C C5 . NAG K 3 . ? 32.369 51.344 7.050 1.00 78.35 ? 501 NAG C C5 1 HETATM 6031 C C6 . NAG K 3 . ? 33.221 52.388 7.758 1.00 80.43 ? 501 NAG C C6 1 HETATM 6032 C C7 . NAG K 3 . ? 27.529 49.933 5.484 1.00 77.39 ? 501 NAG C C7 1 HETATM 6033 C C8 . NAG K 3 . ? 26.830 49.161 4.405 1.00 77.69 ? 501 NAG C C8 1 HETATM 6034 N N2 . NAG K 3 . ? 28.804 49.632 5.714 1.00 77.81 ? 501 NAG C N2 1 HETATM 6035 O O3 . NAG K 3 . ? 29.993 51.931 4.246 1.00 79.69 ? 501 NAG C O3 1 HETATM 6036 O O4 . NAG K 3 . ? 32.862 52.043 4.700 1.00 76.50 ? 501 NAG C O4 1 HETATM 6037 O O5 . NAG K 3 . ? 31.324 51.023 7.976 1.00 77.77 ? 501 NAG C O5 1 HETATM 6038 O O6 . NAG K 3 . ? 32.385 53.322 8.436 1.00 83.24 ? 501 NAG C O6 1 HETATM 6039 O O7 . NAG K 3 . ? 26.930 50.800 6.113 1.00 75.72 ? 501 NAG C O7 1 HETATM 6040 C C1 . NAG L 3 . ? 49.001 32.555 25.640 1.00 68.10 ? 511 NAG C C1 1 HETATM 6041 C C2 . NAG L 3 . ? 50.518 32.458 25.579 1.00 66.44 ? 511 NAG C C2 1 HETATM 6042 C C3 . NAG L 3 . ? 50.896 31.211 24.769 1.00 67.90 ? 511 NAG C C3 1 HETATM 6043 C C4 . NAG L 3 . ? 50.231 29.955 25.344 1.00 69.51 ? 511 NAG C C4 1 HETATM 6044 C C5 . NAG L 3 . ? 48.726 30.272 25.470 1.00 70.87 ? 511 NAG C C5 1 HETATM 6045 C C6 . NAG L 3 . ? 47.808 29.167 25.986 1.00 71.76 ? 511 NAG C C6 1 HETATM 6046 C C7 . NAG L 3 . ? 51.691 34.609 25.699 1.00 66.08 ? 511 NAG C C7 1 HETATM 6047 C C8 . NAG L 3 . ? 52.208 35.772 24.900 1.00 64.15 ? 511 NAG C C8 1 HETATM 6048 N N2 . NAG L 3 . ? 51.083 33.651 24.998 1.00 64.96 ? 511 NAG C N2 1 HETATM 6049 O O3 . NAG L 3 . ? 52.299 31.053 24.656 1.00 66.29 ? 511 NAG C O3 1 HETATM 6050 O O4 . NAG L 3 . ? 50.484 28.861 24.466 1.00 71.09 ? 511 NAG C O4 1 HETATM 6051 O O5 . NAG L 3 . ? 48.542 31.393 26.307 1.00 69.55 ? 511 NAG C O5 1 HETATM 6052 O O6 . NAG L 3 . ? 48.330 28.745 27.211 1.00 72.35 ? 511 NAG C O6 1 HETATM 6053 O O7 . NAG L 3 . ? 51.857 34.599 26.930 1.00 67.87 ? 511 NAG C O7 1 HETATM 6054 C C1 . NAG M 3 . ? 51.284 27.763 24.974 1.00 71.15 ? 512 NAG C C1 1 HETATM 6055 C C2 . NAG M 3 . ? 51.100 26.558 24.038 1.00 72.03 ? 512 NAG C C2 1 HETATM 6056 C C3 . NAG M 3 . ? 52.063 25.391 24.338 1.00 71.71 ? 512 NAG C C3 1 HETATM 6057 C C4 . NAG M 3 . ? 53.497 25.873 24.518 1.00 72.47 ? 512 NAG C C4 1 HETATM 6058 C C5 . NAG M 3 . ? 53.497 27.030 25.526 1.00 72.60 ? 512 NAG C C5 1 HETATM 6059 C C6 . NAG M 3 . ? 54.903 27.570 25.837 1.00 74.91 ? 512 NAG C C6 1 HETATM 6060 C C7 . NAG M 3 . ? 48.986 25.853 22.989 1.00 74.94 ? 512 NAG C C7 1 HETATM 6061 C C8 . NAG M 3 . ? 47.727 25.087 23.255 1.00 75.20 ? 512 NAG C C8 1 HETATM 6062 N N2 . NAG M 3 . ? 49.707 26.142 24.072 1.00 73.01 ? 512 NAG C N2 1 HETATM 6063 O O3 . NAG M 3 . ? 52.102 24.458 23.278 1.00 71.91 ? 512 NAG C O3 1 HETATM 6064 O O4 . NAG M 3 . ? 54.351 24.796 24.889 1.00 70.51 ? 512 NAG C O4 1 HETATM 6065 O O5 . NAG M 3 . ? 52.661 28.070 25.044 1.00 73.01 ? 512 NAG C O5 1 HETATM 6066 O O6 . NAG M 3 . ? 55.515 28.221 24.736 1.00 74.58 ? 512 NAG C O6 1 HETATM 6067 O O7 . NAG M 3 . ? 49.287 26.169 21.832 1.00 75.91 ? 512 NAG C O7 1 HETATM 6068 C C17 . PBS N 4 . ? 36.157 33.421 4.446 1.00 86.02 ? 602 PBS C C17 1 HETATM 6069 C C16 . PBS N 4 . ? 37.194 33.086 5.512 1.00 84.26 ? 602 PBS C C16 1 HETATM 6070 C C15 . PBS N 4 . ? 36.557 32.971 6.894 1.00 84.43 ? 602 PBS C C15 1 HETATM 6071 C C14 . PBS N 4 . ? 37.620 32.639 7.948 1.00 84.37 ? 602 PBS C C14 1 HETATM 6072 C C13 . PBS N 4 . ? 37.208 33.048 9.354 1.00 83.18 ? 602 PBS C C13 1 HETATM 6073 C C12 . PBS N 4 . ? 38.471 33.341 10.147 1.00 82.90 ? 602 PBS C C12 1 HETATM 6074 C C11 . PBS N 4 . ? 38.198 34.408 11.210 1.00 81.78 ? 602 PBS C C11 1 HETATM 6075 C C10 . PBS N 4 . ? 39.482 34.905 11.828 1.00 80.75 ? 602 PBS C C10 1 HETATM 6076 C C9 . PBS N 4 . ? 39.364 36.377 12.287 1.00 81.17 ? 602 PBS C C9 1 HETATM 6077 C C8 . PBS N 4 . ? 40.730 37.079 12.174 1.00 78.71 ? 602 PBS C C8 1 HETATM 6078 C C7 . PBS N 4 . ? 40.674 38.521 12.689 1.00 79.30 ? 602 PBS C C7 1 HETATM 6079 C C6 . PBS N 4 . ? 41.920 39.327 12.325 1.00 77.42 ? 602 PBS C C6 1 HETATM 6080 C C5 . PBS N 4 . ? 41.796 39.976 10.948 1.00 78.15 ? 602 PBS C C5 1 HETATM 6081 C C4 . PBS N 4 . ? 42.790 41.129 10.726 1.00 76.28 ? 602 PBS C C4 1 HETATM 6082 C C3 . PBS N 4 . ? 44.218 40.582 10.673 1.00 76.71 ? 602 PBS C C3 1 HETATM 6083 O O32 . PBS N 4 . ? 44.216 39.430 9.817 1.00 74.85 ? 602 PBS C O32 1 HETATM 6084 C C2 . PBS N 4 . ? 45.251 41.625 10.230 1.00 76.13 ? 602 PBS C C2 1 HETATM 6085 O O1 . PBS N 4 . ? 44.822 42.172 8.992 1.00 79.73 ? 602 PBS C O1 1 HETATM 6086 C C1 . PBS N 4 . ? 45.405 42.815 11.205 1.00 76.39 ? 602 PBS C C1 1 HETATM 6087 N N . PBS N 4 . ? 45.821 42.419 12.574 1.00 76.57 ? 602 PBS C N 1 HETATM 6088 C C18 . PBS N 4 . ? 45.294 42.962 13.675 1.00 76.71 ? 602 PBS C C18 1 HETATM 6089 O O2 . PBS N 4 . ? 44.418 43.828 13.656 1.00 79.45 ? 602 PBS C O2 1 HETATM 6090 C C19 . PBS N 4 . ? 45.830 42.458 15.025 1.00 75.91 ? 602 PBS C C19 1 HETATM 6091 C C20 . PBS N 4 . ? 44.887 41.458 15.705 1.00 75.80 ? 602 PBS C C20 1 HETATM 6092 C C21 . PBS N 4 . ? 43.588 42.054 16.224 1.00 75.97 ? 602 PBS C C21 1 HETATM 6093 C C22 . PBS N 4 . ? 42.875 41.069 17.182 1.00 73.70 ? 602 PBS C C22 1 HETATM 6094 C C23 . PBS N 4 . ? 41.868 40.211 16.438 1.00 75.25 ? 602 PBS C C23 1 HETATM 6095 C C24 . PBS N 4 . ? 41.015 39.424 17.414 1.00 74.45 ? 602 PBS C C24 1 HETATM 6096 C C25 . PBS N 4 . ? 39.549 39.543 17.040 1.00 72.87 ? 602 PBS C C25 1 HETATM 6097 C C . PBS N 4 . ? 46.422 43.822 10.667 1.00 76.27 ? 602 PBS C C 1 HETATM 6098 O OC1 . PBS N 4 . ? 47.718 43.240 10.896 1.00 76.55 ? 602 PBS C OC1 1 HETATM 6099 C CG1 . PBS N 4 . ? 48.879 44.009 10.544 1.00 77.36 ? 602 PBS C CG1 1 HETATM 6100 O OG . PBS N 4 . ? 49.172 44.915 11.614 1.00 79.90 ? 602 PBS C OG 1 HETATM 6101 C CG . PBS N 4 . ? 49.428 44.315 12.918 1.00 80.30 ? 602 PBS C CG 1 HETATM 6102 C CG5 . PBS N 4 . ? 49.684 45.480 13.898 1.00 83.37 ? 602 PBS C CG5 1 HETATM 6103 O OG6 . PBS N 4 . ? 48.608 45.567 14.854 1.00 87.58 ? 602 PBS C OG6 1 HETATM 6104 C CG4 . PBS N 4 . ? 50.616 43.352 12.832 1.00 78.72 ? 602 PBS C CG4 1 HETATM 6105 O OG5 . PBS N 4 . ? 51.820 44.082 12.638 1.00 78.82 ? 602 PBS C OG5 1 HETATM 6106 C CG3 . PBS N 4 . ? 50.426 42.363 11.663 1.00 78.89 ? 602 PBS C CG3 1 HETATM 6107 O OG4 . PBS N 4 . ? 51.566 41.504 11.529 1.00 75.13 ? 602 PBS C OG4 1 HETATM 6108 C CG2 . PBS N 4 . ? 50.080 43.074 10.332 1.00 77.50 ? 602 PBS C CG2 1 HETATM 6109 O OG3 . PBS N 4 . ? 49.704 42.103 9.363 1.00 78.07 ? 602 PBS C OG3 1 HETATM 6110 C C27 . R16 O 5 . ? 35.998 40.999 18.628 1.00 85.55 ? 702 R16 C C27 1 HETATM 6111 C C28 . R16 O 5 . ? 34.812 41.960 18.897 1.00 87.97 ? 702 R16 C C28 1 HETATM 6112 C C29 . R16 O 5 . ? 34.992 43.381 18.285 1.00 86.91 ? 702 R16 C C29 1 HETATM 6113 C C30 . R16 O 5 . ? 35.726 44.343 19.246 1.00 86.56 ? 702 R16 C C30 1 HETATM 6114 C C31 . R16 O 5 . ? 34.775 45.066 20.245 1.00 86.97 ? 702 R16 C C31 1 HETATM 6115 C C32 . R16 O 5 . ? 35.474 45.938 21.320 1.00 84.38 ? 702 R16 C C32 1 HETATM 6116 C C33 . R16 O 5 . ? 35.692 45.237 22.693 1.00 84.54 ? 702 R16 C C33 1 HETATM 6117 C C34 . R16 O 5 . ? 35.754 46.237 23.891 1.00 82.52 ? 702 R16 C C34 1 HETATM 6118 C C35 . R16 O 5 . ? 37.150 46.350 24.547 1.00 82.60 ? 702 R16 C C35 1 HETATM 6119 C C36 . R16 O 5 . ? 37.514 45.174 25.476 1.00 82.28 ? 702 R16 C C36 1 HETATM 6120 C C37 . R16 O 5 . ? 39.032 45.095 25.724 1.00 84.31 ? 702 R16 C C37 1 HETATM 6121 C C38 . R16 O 5 . ? 39.530 43.680 26.095 1.00 83.64 ? 702 R16 C C38 1 HETATM 6122 C C39 . R16 O 5 . ? 40.394 43.053 24.978 1.00 83.09 ? 702 R16 C C39 1 HETATM 6123 C C40 . R16 O 5 . ? 40.013 41.573 24.715 1.00 84.33 ? 702 R16 C C40 1 HETATM 6124 C C41 . R16 O 5 . ? 39.184 41.400 23.429 1.00 83.58 ? 702 R16 C C41 1 HETATM 6125 C C42 . R16 O 5 . ? 38.864 39.934 23.196 1.00 82.96 ? 702 R16 C C42 1 HETATM 6126 O O . HOH P 6 . ? 4.238 9.718 17.571 1.00 42.32 ? 702 HOH A O 1 HETATM 6127 O O . HOH P 6 . ? 4.816 -6.670 25.666 1.00 48.36 ? 703 HOH A O 1 HETATM 6128 O O . HOH P 6 . ? -16.766 -12.944 42.346 1.00 56.61 ? 704 HOH A O 1 HETATM 6129 O O . HOH P 6 . ? 0.598 -5.505 14.936 1.00 43.89 ? 705 HOH A O 1 HETATM 6130 O O . HOH P 6 . ? 12.971 -11.409 3.356 1.00 39.75 ? 706 HOH A O 1 HETATM 6131 O O . HOH P 6 . ? 20.167 -2.936 16.032 1.00 46.98 ? 707 HOH A O 1 HETATM 6132 O O . HOH P 6 . ? 4.324 -14.783 14.709 1.00 61.92 ? 708 HOH A O 1 HETATM 6133 O O . HOH P 6 . ? -8.903 -8.007 42.825 1.00 60.51 ? 709 HOH A O 1 HETATM 6134 O O . HOH P 6 . ? -1.263 -12.411 10.761 1.00 61.27 ? 710 HOH A O 1 HETATM 6135 O O . HOH P 6 . ? 12.415 -17.762 14.093 1.00 63.98 ? 711 HOH A O 1 HETATM 6136 O O . HOH P 6 . ? -25.198 -19.650 35.957 1.00 67.90 ? 712 HOH A O 1 HETATM 6137 O O . HOH P 6 . ? -22.583 1.516 47.954 1.00 64.59 ? 713 HOH A O 1 HETATM 6138 O O . HOH P 6 . ? 8.219 0.654 1.322 1.00 58.24 ? 714 HOH A O 1 HETATM 6139 O O . HOH P 6 . ? -16.122 -14.668 38.914 1.00 73.71 ? 715 HOH A O 1 HETATM 6140 O O . HOH P 6 . ? -23.883 -20.224 45.518 1.00 61.67 ? 716 HOH A O 1 HETATM 6141 O O . HOH P 6 . ? 11.183 -18.853 11.778 1.00 71.89 ? 717 HOH A O 1 HETATM 6142 O O . HOH P 6 . ? 2.569 -11.423 3.266 1.00 65.85 ? 718 HOH A O 1 HETATM 6143 O O . HOH P 6 . ? 19.820 1.400 35.979 1.00 68.27 ? 719 HOH A O 1 HETATM 6144 O O . HOH P 6 . ? 12.010 -16.295 3.465 1.00 47.57 ? 720 HOH A O 1 HETATM 6145 O O . HOH P 6 . ? -23.216 -21.742 47.423 1.00 58.25 ? 721 HOH A O 1 HETATM 6146 O O . HOH P 6 . ? 2.755 -16.623 11.343 1.00 72.41 ? 722 HOH A O 1 HETATM 6147 O O . HOH P 6 . ? 11.288 19.292 25.995 1.00 62.21 ? 723 HOH A O 1 HETATM 6148 O O . HOH P 6 . ? 4.215 -15.401 18.781 1.00 52.15 ? 724 HOH A O 1 HETATM 6149 O O . HOH P 6 . ? -2.062 -14.801 12.310 1.00 66.92 ? 725 HOH A O 1 HETATM 6150 O O . HOH P 6 . ? -4.995 7.198 33.621 1.00 45.90 ? 726 HOH A O 1 HETATM 6151 O O . HOH P 6 . ? 5.723 16.526 14.227 1.00 70.21 ? 727 HOH A O 1 HETATM 6152 O O . HOH P 6 . ? -37.009 -5.729 49.027 1.00 65.51 ? 728 HOH A O 1 HETATM 6153 O O . HOH P 6 . ? 13.988 18.572 38.417 1.00 68.65 ? 729 HOH A O 1 HETATM 6154 O O . HOH P 6 . ? 14.394 -14.107 5.574 1.00 57.51 ? 730 HOH A O 1 HETATM 6155 O O . HOH P 6 . ? -15.537 9.581 35.296 1.00 67.19 ? 731 HOH A O 1 HETATM 6156 O O . HOH P 6 . ? 6.427 16.526 35.682 1.00 56.97 ? 732 HOH A O 1 HETATM 6157 O O . HOH P 6 . ? -24.978 -17.467 39.106 1.00 72.25 ? 733 HOH A O 1 HETATM 6158 O O . HOH P 6 . ? -17.898 -15.582 35.642 1.00 59.91 ? 734 HOH A O 1 HETATM 6159 O O . HOH P 6 . ? -2.067 -6.546 0.582 1.00 72.79 ? 735 HOH A O 1 HETATM 6160 O O . HOH P 6 . ? -33.404 -4.006 38.670 1.00 54.78 ? 736 HOH A O 1 HETATM 6161 O O . HOH P 6 . ? 12.590 20.001 28.542 1.00 70.42 ? 737 HOH A O 1 HETATM 6162 O O . HOH P 6 . ? 16.001 20.448 36.847 1.00 54.79 ? 738 HOH A O 1 HETATM 6163 O O . HOH P 6 . ? 10.920 20.198 19.678 1.00 57.25 ? 739 HOH A O 1 HETATM 6164 O O . HOH P 6 . ? 10.829 -21.117 13.750 1.00 64.09 ? 740 HOH A O 1 HETATM 6165 O O . HOH P 6 . ? -3.494 -4.167 9.133 1.00 64.02 ? 741 HOH A O 1 HETATM 6166 O O . HOH P 6 . ? -2.623 -9.096 2.167 1.00 70.35 ? 742 HOH A O 1 HETATM 6167 O O . HOH P 6 . ? 2.274 -11.528 0.739 1.00 69.77 ? 743 HOH A O 1 HETATM 6168 O O . HOH P 6 . ? -14.105 -11.393 56.394 1.00 61.11 ? 744 HOH A O 1 HETATM 6169 O O . HOH P 6 . ? 6.276 8.085 2.878 1.00 70.65 ? 745 HOH A O 1 HETATM 6170 O O . HOH P 6 . ? -30.860 -20.474 38.396 1.00 65.26 ? 746 HOH A O 1 HETATM 6171 O O . HOH P 6 . ? -16.590 -15.321 41.390 1.00 70.85 ? 747 HOH A O 1 HETATM 6172 O O . HOH P 6 . ? -17.900 -20.508 47.483 1.00 60.82 ? 748 HOH A O 1 HETATM 6173 O O . HOH P 6 . ? -9.349 3.428 34.754 1.00 67.57 ? 749 HOH A O 1 HETATM 6174 O O . HOH P 6 . ? -16.397 -11.922 54.391 1.00 57.39 ? 750 HOH A O 1 HETATM 6175 O O . HOH P 6 . ? 2.357 18.380 33.243 1.00 53.62 ? 751 HOH A O 1 HETATM 6176 O O . HOH Q 6 . ? -27.545 -4.807 33.752 1.00 48.39 ? 100 HOH B O 1 HETATM 6177 O O . HOH Q 6 . ? -13.916 7.450 17.275 1.00 51.75 ? 101 HOH B O 1 HETATM 6178 O O . HOH Q 6 . ? -21.295 10.685 19.206 1.00 51.44 ? 102 HOH B O 1 HETATM 6179 O O . HOH Q 6 . ? -32.727 4.996 34.777 1.00 51.92 ? 103 HOH B O 1 HETATM 6180 O O . HOH Q 6 . ? -25.929 -1.653 28.936 1.00 47.19 ? 104 HOH B O 1 HETATM 6181 O O . HOH Q 6 . ? -28.019 9.429 37.195 1.00 44.49 ? 105 HOH B O 1 HETATM 6182 O O . HOH Q 6 . ? -26.374 15.812 30.487 1.00 64.89 ? 106 HOH B O 1 HETATM 6183 O O . HOH Q 6 . ? -8.816 -0.583 30.492 1.00 49.71 ? 107 HOH B O 1 HETATM 6184 O O . HOH Q 6 . ? -16.207 12.274 19.436 1.00 53.15 ? 108 HOH B O 1 HETATM 6185 O O . HOH Q 6 . ? -14.858 9.721 16.123 1.00 56.53 ? 109 HOH B O 1 HETATM 6186 O O . HOH Q 6 . ? -6.935 11.988 23.929 1.00 64.36 ? 110 HOH B O 1 HETATM 6187 O O . HOH Q 6 . ? -33.993 12.959 19.196 1.00 65.91 ? 111 HOH B O 1 HETATM 6188 O O . HOH Q 6 . ? -14.668 14.196 30.854 1.00 54.61 ? 112 HOH B O 1 HETATM 6189 O O . HOH Q 6 . ? -12.690 9.489 14.656 1.00 74.06 ? 113 HOH B O 1 HETATM 6190 O O . HOH Q 6 . ? -14.694 -7.937 6.677 1.00 65.82 ? 114 HOH B O 1 HETATM 6191 O O . HOH Q 6 . ? -9.061 3.312 28.650 1.00 61.77 ? 115 HOH B O 1 HETATM 6192 O O . HOH Q 6 . ? -33.399 13.656 21.759 1.00 54.20 ? 116 HOH B O 1 HETATM 6193 O O . HOH Q 6 . ? -7.573 1.550 30.402 1.00 50.11 ? 117 HOH B O 1 HETATM 6194 O O . HOH Q 6 . ? -29.092 -5.178 35.617 1.00 54.65 ? 118 HOH B O 1 HETATM 6195 O O . HOH Q 6 . ? -13.775 -6.164 28.787 1.00 55.95 ? 119 HOH B O 1 HETATM 6196 O O . HOH Q 6 . ? -19.790 14.873 27.819 1.00 64.75 ? 120 HOH B O 1 HETATM 6197 O O . HOH Q 6 . ? -30.662 6.044 20.803 1.00 52.80 ? 121 HOH B O 1 HETATM 6198 O O . HOH Q 6 . ? -23.072 10.763 42.413 1.00 51.86 ? 122 HOH B O 1 HETATM 6199 O O . HOH Q 6 . ? -33.869 15.180 24.278 1.00 84.11 ? 123 HOH B O 1 HETATM 6200 O O . HOH R 6 . ? 31.610 47.988 14.453 1.00 46.38 ? 703 HOH C O 1 HETATM 6201 O O . HOH R 6 . ? 27.957 32.881 11.733 1.00 48.25 ? 704 HOH C O 1 HETATM 6202 O O . HOH R 6 . ? 18.266 34.238 45.081 1.00 58.78 ? 705 HOH C O 1 HETATM 6203 O O . HOH R 6 . ? 18.004 29.976 39.560 1.00 46.44 ? 706 HOH C O 1 HETATM 6204 O O . HOH R 6 . ? 21.093 46.510 23.999 1.00 53.02 ? 707 HOH C O 1 HETATM 6205 O O . HOH R 6 . ? 34.219 53.953 33.323 1.00 55.85 ? 708 HOH C O 1 HETATM 6206 O O . HOH R 6 . ? 45.760 52.124 31.810 1.00 82.05 ? 709 HOH C O 1 HETATM 6207 O O . HOH R 6 . ? 3.703 27.156 51.219 1.00 67.07 ? 710 HOH C O 1 HETATM 6208 O O . HOH R 6 . ? 24.134 33.008 6.398 1.00 57.23 ? 711 HOH C O 1 HETATM 6209 O O . HOH R 6 . ? 32.698 45.868 15.474 1.00 52.56 ? 712 HOH C O 1 HETATM 6210 O O . HOH R 6 . ? 27.973 25.417 15.974 1.00 53.99 ? 713 HOH C O 1 HETATM 6211 O O . HOH R 6 . ? 43.702 23.914 11.922 1.00 57.73 ? 714 HOH C O 1 HETATM 6212 O O . HOH R 6 . ? 47.844 26.381 9.838 1.00 53.63 ? 715 HOH C O 1 HETATM 6213 O O . HOH R 6 . ? 39.984 47.776 33.552 1.00 57.69 ? 716 HOH C O 1 HETATM 6214 O O . HOH R 6 . ? 8.828 23.196 31.699 1.00 58.11 ? 717 HOH C O 1 HETATM 6215 O O . HOH R 6 . ? 25.679 26.223 15.013 1.00 54.74 ? 718 HOH C O 1 HETATM 6216 O O . HOH R 6 . ? 10.832 44.869 41.582 1.00 48.61 ? 719 HOH C O 1 HETATM 6217 O O . HOH R 6 . ? 41.837 24.319 2.341 1.00 50.33 ? 720 HOH C O 1 HETATM 6218 O O . HOH R 6 . ? 30.422 21.597 7.452 1.00 61.57 ? 721 HOH C O 1 HETATM 6219 O O . HOH R 6 . ? 22.409 44.853 29.924 1.00 42.95 ? 722 HOH C O 1 HETATM 6220 O O . HOH R 6 . ? 37.826 17.997 10.330 1.00 65.60 ? 723 HOH C O 1 HETATM 6221 O O . HOH R 6 . ? 39.028 55.278 34.597 1.00 74.23 ? 724 HOH C O 1 HETATM 6222 O O . HOH R 6 . ? 10.768 25.198 39.810 1.00 74.13 ? 725 HOH C O 1 HETATM 6223 O O . HOH R 6 . ? 23.525 52.874 16.702 1.00 65.11 ? 726 HOH C O 1 HETATM 6224 O O . HOH R 6 . ? 4.176 16.426 44.870 1.00 69.40 ? 727 HOH C O 1 HETATM 6225 O O . HOH R 6 . ? 1.473 18.398 41.448 1.00 67.65 ? 728 HOH C O 1 HETATM 6226 O O . HOH R 6 . ? 45.999 25.085 12.142 1.00 50.18 ? 729 HOH C O 1 HETATM 6227 O O . HOH R 6 . ? 13.045 23.203 43.991 1.00 53.04 ? 730 HOH C O 1 HETATM 6228 O O . HOH R 6 . ? 29.989 26.665 8.069 1.00 66.77 ? 731 HOH C O 1 HETATM 6229 O O . HOH R 6 . ? 13.564 34.326 50.286 1.00 53.80 ? 732 HOH C O 1 HETATM 6230 O O . HOH R 6 . ? 15.825 23.693 43.879 1.00 57.13 ? 733 HOH C O 1 HETATM 6231 O O . HOH R 6 . ? 30.979 56.081 25.351 1.00 61.47 ? 734 HOH C O 1 HETATM 6232 O O . HOH R 6 . ? 22.001 51.232 15.717 1.00 72.78 ? 735 HOH C O 1 HETATM 6233 O O . HOH R 6 . ? 32.921 55.264 11.364 1.00 59.90 ? 736 HOH C O 1 HETATM 6234 O O . HOH R 6 . ? 13.506 21.723 45.674 1.00 77.69 ? 737 HOH C O 1 HETATM 6235 O O . HOH R 6 . ? 21.012 31.603 37.293 1.00 63.67 ? 738 HOH C O 1 HETATM 6236 O O . HOH R 6 . ? 9.342 21.910 51.198 1.00 83.86 ? 739 HOH C O 1 HETATM 6237 O O . HOH R 6 . ? 23.489 45.186 -1.164 1.00 66.17 ? 740 HOH C O 1 HETATM 6238 O O . HOH R 6 . ? 15.372 24.767 41.940 1.00 65.15 ? 741 HOH C O 1 HETATM 6239 O O . HOH R 6 . ? -2.084 37.847 41.557 1.00 57.21 ? 742 HOH C O 1 HETATM 6240 O O . HOH R 6 . ? 0.478 20.044 52.794 1.00 54.52 ? 743 HOH C O 1 HETATM 6241 O O . HOH R 6 . ? 34.817 22.724 1.588 1.00 75.89 ? 744 HOH C O 1 HETATM 6242 O O . HOH R 6 . ? 31.184 23.273 11.101 1.00 64.92 ? 745 HOH C O 1 HETATM 6243 O O . HOH R 6 . ? 26.172 38.203 11.228 1.00 64.43 ? 746 HOH C O 1 HETATM 6244 O O . HOH R 6 . ? 41.746 19.806 2.891 1.00 63.73 ? 747 HOH C O 1 HETATM 6245 O O . HOH R 6 . ? 17.322 26.244 43.146 1.00 63.28 ? 748 HOH C O 1 HETATM 6246 O O . HOH R 6 . ? 26.239 27.446 4.275 1.00 69.26 ? 749 HOH C O 1 HETATM 6247 O O . HOH R 6 . ? 8.124 18.970 49.177 1.00 55.85 ? 750 HOH C O 1 HETATM 6248 O O . HOH R 6 . ? 31.944 21.135 12.814 1.00 74.91 ? 751 HOH C O 1 HETATM 6249 O O . HOH R 6 . ? 29.037 27.602 -1.166 1.00 69.26 ? 752 HOH C O 1 HETATM 6250 O O . HOH R 6 . ? 30.329 27.569 1.150 1.00 69.31 ? 753 HOH C O 1 HETATM 6251 O O . HOH R 6 . ? 29.846 17.864 9.528 1.00 67.35 ? 754 HOH C O 1 HETATM 6252 O O . HOH R 6 . ? 12.511 45.403 39.933 1.00 50.43 ? 755 HOH C O 1 HETATM 6253 O O . HOH R 6 . ? 47.554 35.309 12.836 1.00 50.31 ? 756 HOH C O 1 HETATM 6254 O O . HOH R 6 . ? 28.902 26.295 5.163 1.00 60.16 ? 757 HOH C O 1 HETATM 6255 O O . HOH R 6 . ? 9.692 32.096 31.842 1.00 42.14 ? 758 HOH C O 1 HETATM 6256 O O . HOH R 6 . ? 26.464 21.888 9.467 1.00 56.16 ? 759 HOH C O 1 HETATM 6257 O O . HOH R 6 . ? 9.425 18.930 44.418 1.00 68.13 ? 760 HOH C O 1 HETATM 6258 O O . HOH R 6 . ? 16.108 27.778 41.784 1.00 60.67 ? 761 HOH C O 1 HETATM 6259 O O . HOH R 6 . ? 25.490 21.301 13.214 1.00 83.03 ? 762 HOH C O 1 HETATM 6260 O O . HOH R 6 . ? 17.937 41.910 32.000 1.00 56.92 ? 763 HOH C O 1 HETATM 6261 O O . HOH R 6 . ? 24.724 24.282 13.362 1.00 62.69 ? 764 HOH C O 1 HETATM 6262 O O . HOH R 6 . ? 0.099 40.422 42.218 1.00 60.61 ? 765 HOH C O 1 HETATM 6263 O O . HOH R 6 . ? 30.941 26.661 3.405 1.00 81.56 ? 766 HOH C O 1 HETATM 6264 O O . HOH R 6 . ? 9.962 20.741 39.724 1.00 61.90 ? 767 HOH C O 1 HETATM 6265 O O . HOH R 6 . ? 25.395 24.611 10.723 1.00 78.49 ? 768 HOH C O 1 HETATM 6266 O O . HOH S 6 . ? -0.710 47.582 34.194 1.00 48.18 ? 100 HOH D O 1 HETATM 6267 O O . HOH S 6 . ? -5.533 43.166 31.162 1.00 53.07 ? 101 HOH D O 1 HETATM 6268 O O . HOH S 6 . ? 13.546 32.057 25.506 1.00 55.95 ? 102 HOH D O 1 HETATM 6269 O O . HOH S 6 . ? -2.118 33.120 32.103 1.00 56.13 ? 103 HOH D O 1 HETATM 6270 O O . HOH S 6 . ? 21.116 51.641 20.541 1.00 64.29 ? 104 HOH D O 1 HETATM 6271 O O . HOH S 6 . ? 10.479 30.131 4.081 1.00 64.53 ? 105 HOH D O 1 HETATM 6272 O O . HOH S 6 . ? -0.231 33.631 30.247 1.00 59.16 ? 106 HOH D O 1 HETATM 6273 O O . HOH S 6 . ? 15.673 32.915 26.566 1.00 61.56 ? 107 HOH D O 1 HETATM 6274 O O . HOH S 6 . ? 7.655 52.976 24.700 1.00 57.29 ? 108 HOH D O 1 HETATM 6275 O O . HOH S 6 . ? 22.030 47.942 17.766 1.00 56.17 ? 109 HOH D O 1 HETATM 6276 O O . HOH S 6 . ? 10.246 29.432 17.098 1.00 65.17 ? 110 HOH D O 1 HETATM 6277 O O . HOH S 6 . ? 13.141 34.358 2.128 1.00 72.56 ? 111 HOH D O 1 HETATM 6278 O O . HOH S 6 . ? 12.650 29.941 3.214 1.00 73.92 ? 112 HOH D O 1 HETATM 6279 O O . HOH S 6 . ? -0.399 52.352 17.952 1.00 66.23 ? 113 HOH D O 1 HETATM 6280 O O . HOH S 6 . ? -9.802 50.062 31.276 1.00 59.36 ? 114 HOH D O 1 HETATM 6281 O O . HOH S 6 . ? 6.896 31.574 18.494 1.00 52.63 ? 115 HOH D O 1 HETATM 6282 O O . HOH S 6 . ? -6.338 52.768 28.950 1.00 69.98 ? 116 HOH D O 1 HETATM 6283 O O . HOH S 6 . ? 16.522 50.891 23.494 1.00 64.15 ? 117 HOH D O 1 HETATM 6284 O O . HOH S 6 . ? 14.875 52.443 26.569 1.00 66.42 ? 118 HOH D O 1 HETATM 6285 O O . HOH S 6 . ? 0.746 47.653 36.432 1.00 54.62 ? 119 HOH D O 1 HETATM 6286 O O . HOH S 6 . ? -5.020 54.168 27.325 1.00 76.68 ? 120 HOH D O 1 HETATM 6287 O O . HOH S 6 . ? 6.362 49.016 16.274 1.00 55.15 ? 121 HOH D O 1 HETATM 6288 O O . HOH S 6 . ? 4.154 53.108 30.379 1.00 59.68 ? 122 HOH D O 1 HETATM 6289 O O . HOH S 6 . ? -1.474 51.809 25.091 1.00 58.52 ? 123 HOH D O 1 HETATM 6290 O O . HOH S 6 . ? -3.040 55.717 27.356 1.00 74.10 ? 124 HOH D O 1 # 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.ndb_seq_num _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 _pdbx_poly_seq_scheme.hetero A 1 1 SER 1 1 ? ? ? A . n A 1 2 GLU 2 2 ? ? ? A . n A 1 3 ALA 3 3 ? ? ? A . n A 1 4 GLN 4 4 ? ? ? A . n A 1 5 GLN 5 5 ? ? ? A . n A 1 6 LYS 6 6 ? ? ? A . n A 1 7 ASN 7 7 ? ? ? A . n A 1 8 TYR 8 8 8 TYR TYR A . n A 1 9 THR 9 9 9 THR THR A . n A 1 10 PHE 10 10 10 PHE PHE A . n A 1 11 ARG 11 11 11 ARG ARG A . n A 1 12 CYS 12 12 12 CYS CYS A . n A 1 13 LEU 13 13 13 LEU LEU A . n A 1 14 GLN 14 14 14 GLN GLN A . n A 1 15 MET 15 15 15 MET MET A . n A 1 16 SER 16 16 16 SER SER A . n A 1 17 SER 17 17 17 SER SER A . n A 1 18 PHE 18 18 18 PHE PHE A . n A 1 19 ALA 19 19 19 ALA ALA A . n A 1 20 ASN 20 20 20 ASN ASN A . n A 1 21 ARG 21 21 21 ARG ARG A . n A 1 22 SER 22 22 22 SER SER A . n A 1 23 TRP 23 23 23 TRP TRP A . n A 1 24 SER 24 24 24 SER SER A . n A 1 25 ARG 25 25 25 ARG ARG A . n A 1 26 THR 26 26 26 THR THR A . n A 1 27 ASP 27 27 27 ASP ASP A . n A 1 28 SER 28 28 28 SER SER A . n A 1 29 VAL 29 29 29 VAL VAL A . n A 1 30 VAL 30 30 30 VAL VAL A . n A 1 31 TRP 31 31 31 TRP TRP A . n A 1 32 LEU 32 32 32 LEU LEU A . n A 1 33 GLY 33 33 33 GLY GLY A . n A 1 34 ASP 34 34 34 ASP ASP A . n A 1 35 LEU 35 35 35 LEU LEU A . n A 1 36 GLN 36 36 36 GLN GLN A . n A 1 37 THR 37 37 37 THR THR A . n A 1 38 HIS 38 38 38 HIS HIS A . n A 1 39 ARG 39 39 39 ARG ARG A . n A 1 40 TRP 40 40 40 TRP TRP A . n A 1 41 SER 41 41 41 SER SER A . n A 1 42 ASN 42 42 42 ASN ASN A . n A 1 43 ASP 43 43 43 ASP ASP A . n A 1 44 SER 44 44 44 SER SER A . n A 1 45 ALA 45 45 45 ALA ALA A . n A 1 46 THR 46 46 46 THR THR A . n A 1 47 ILE 47 47 47 ILE ILE A . n A 1 48 SER 48 48 48 SER SER A . n A 1 49 PHE 49 49 49 PHE PHE A . n A 1 50 THR 50 50 50 THR THR A . n A 1 51 LYS 51 51 51 LYS LYS A . n A 1 52 PRO 52 52 52 PRO PRO A . n A 1 53 TRP 53 53 53 TRP TRP A . n A 1 54 SER 54 54 54 SER SER A . n A 1 55 GLN 55 55 55 GLN GLN A . n A 1 56 GLY 56 56 56 GLY GLY A . n A 1 57 LYS 57 57 57 LYS LYS A . n A 1 58 LEU 58 58 58 LEU LEU A . n A 1 59 SER 59 59 59 SER SER A . n A 1 60 ASN 60 60 60 ASN ASN A . n A 1 61 GLN 61 61 61 GLN GLN A . n A 1 62 GLN 62 62 62 GLN GLN A . n A 1 63 TRP 63 63 63 TRP TRP A . n A 1 64 GLU 64 64 64 GLU GLU A . n A 1 65 LYS 65 65 65 LYS LYS A . n A 1 66 LEU 66 66 66 LEU LEU A . n A 1 67 GLN 67 67 67 GLN GLN A . n A 1 68 HIS 68 68 68 HIS HIS A . n A 1 69 MET 69 69 69 MET MET A . n A 1 70 PHE 70 70 70 PHE PHE A . n A 1 71 GLN 71 71 71 GLN GLN A . n A 1 72 VAL 72 72 72 VAL VAL A . n A 1 73 TYR 73 73 73 TYR TYR A . n A 1 74 ARG 74 74 74 ARG ARG A . n A 1 75 VAL 75 75 75 VAL VAL A . n A 1 76 SER 76 76 76 SER SER A . n A 1 77 PHE 77 77 77 PHE PHE A . n A 1 78 THR 78 78 78 THR THR A . n A 1 79 ARG 79 79 79 ARG ARG A . n A 1 80 ASP 80 80 80 ASP ASP A . n A 1 81 ILE 81 81 81 ILE ILE A . n A 1 82 GLN 82 82 82 GLN GLN A . n A 1 83 GLU 83 83 83 GLU GLU A . n A 1 84 LEU 84 84 84 LEU LEU A . n A 1 85 VAL 85 85 85 VAL VAL A . n A 1 86 LYS 86 86 86 LYS LYS A . n A 1 87 MET 87 87 87 MET MET A . n A 1 88 MET 88 88 88 MET MET A . n A 1 89 SER 89 89 89 SER SER A . n A 1 90 PRO 90 90 90 PRO PRO A . n A 1 91 LYS 91 91 91 LYS LYS A . n A 1 92 GLU 92 92 92 GLU GLU A . n A 1 93 ASP 93 93 93 ASP ASP A . n A 1 94 TYR 94 94 94 TYR TYR A . n A 1 95 PRO 95 95 95 PRO PRO A . n A 1 96 ILE 96 96 96 ILE ILE A . n A 1 97 GLU 97 97 97 GLU GLU A . n A 1 98 ILE 98 98 98 ILE ILE A . n A 1 99 GLN 99 99 99 GLN GLN A . n A 1 100 LEU 100 100 100 LEU LEU A . n A 1 101 SER 101 101 101 SER SER A . n A 1 102 ALA 102 102 102 ALA ALA A . n A 1 103 GLY 103 103 103 GLY GLY A . n A 1 104 CYS 104 104 104 CYS CYS A . n A 1 105 GLU 105 105 105 GLU GLU A . n A 1 106 MET 106 106 106 MET MET A . n A 1 107 TYR 107 107 107 TYR TYR A . n A 1 108 PRO 108 108 108 PRO PRO A . n A 1 109 GLY 109 109 ? ? ? A . n A 1 110 ASN 110 110 ? ? ? A . n A 1 111 ALA 111 111 ? ? ? A . n A 1 112 SER 112 112 112 SER SER A . n A 1 113 GLU 113 113 113 GLU GLU A . n A 1 114 SER 114 114 114 SER SER A . n A 1 115 PHE 115 115 115 PHE PHE A . n A 1 116 LEU 116 116 116 LEU LEU A . n A 1 117 HIS 117 117 117 HIS HIS A . n A 1 118 VAL 118 118 118 VAL VAL A . n A 1 119 ALA 119 119 119 ALA ALA A . n A 1 120 PHE 120 120 120 PHE PHE A . n A 1 121 GLN 121 121 121 GLN GLN A . n A 1 122 GLY 122 122 122 GLY GLY A . n A 1 123 LYS 123 123 123 LYS LYS A . n A 1 124 TYR 124 124 124 TYR TYR A . n A 1 125 VAL 125 125 125 VAL VAL A . n A 1 126 VAL 126 126 126 VAL VAL A . n A 1 127 ARG 127 127 127 ARG ARG A . n A 1 128 PHE 128 128 128 PHE PHE A . n A 1 129 TRP 129 129 129 TRP TRP A . n A 1 130 GLY 130 130 130 GLY GLY A . n A 1 131 THR 131 131 131 THR THR A . n A 1 132 SER 132 132 132 SER SER A . n A 1 133 TRP 133 133 133 TRP TRP A . n A 1 134 GLN 134 134 134 GLN GLN A . n A 1 135 THR 135 135 135 THR THR A . n A 1 136 VAL 136 136 136 VAL VAL A . n A 1 137 PRO 137 137 137 PRO PRO A . n A 1 138 GLY 138 138 138 GLY GLY A . n A 1 139 ALA 139 139 139 ALA ALA A . n A 1 140 PRO 140 140 140 PRO PRO A . n A 1 141 SER 141 141 141 SER SER A . n A 1 142 TRP 142 142 142 TRP TRP A . n A 1 143 LEU 143 143 143 LEU LEU A . n A 1 144 ASP 144 144 144 ASP ASP A . n A 1 145 LEU 145 145 145 LEU LEU A . n A 1 146 PRO 146 146 146 PRO PRO A . n A 1 147 ILE 147 147 147 ILE ILE A . n A 1 148 LYS 148 148 148 LYS LYS A . n A 1 149 VAL 149 149 149 VAL VAL A . n A 1 150 LEU 150 150 150 LEU LEU A . n A 1 151 ASN 151 151 151 ASN ASN A . n A 1 152 ALA 152 152 152 ALA ALA A . n A 1 153 ASP 153 153 153 ASP ASP A . n A 1 154 GLN 154 154 154 GLN GLN A . n A 1 155 GLY 155 155 155 GLY GLY A . n A 1 156 THR 156 156 156 THR THR A . n A 1 157 SER 157 157 157 SER SER A . n A 1 158 ALA 158 158 158 ALA ALA A . n A 1 159 THR 159 159 159 THR THR A . n A 1 160 VAL 160 160 160 VAL VAL A . n A 1 161 GLN 161 161 161 GLN GLN A . n A 1 162 MET 162 162 162 MET MET A . n A 1 163 LEU 163 163 163 LEU LEU A . n A 1 164 LEU 164 164 164 LEU LEU A . n A 1 165 ASN 165 165 165 ASN ASN A . n A 1 166 ASP 166 166 166 ASP ASP A . n A 1 167 THR 167 167 167 THR THR A . n A 1 168 CYS 168 168 168 CYS CYS A . n A 1 169 PRO 169 169 169 PRO PRO A . n A 1 170 LEU 170 170 170 LEU LEU A . n A 1 171 PHE 171 171 171 PHE PHE A . n A 1 172 VAL 172 172 172 VAL VAL A . n A 1 173 ARG 173 173 173 ARG ARG A . n A 1 174 GLY 174 174 174 GLY GLY A . n A 1 175 LEU 175 175 175 LEU LEU A . n A 1 176 LEU 176 176 176 LEU LEU A . n A 1 177 GLU 177 177 177 GLU GLU A . n A 1 178 ALA 178 178 178 ALA ALA A . n A 1 179 GLY 179 179 179 GLY GLY A . n A 1 180 LYS 180 180 180 LYS LYS A . n A 1 181 SER 181 181 181 SER SER A . n A 1 182 ASP 182 182 182 ASP ASP A . n A 1 183 LEU 183 183 183 LEU LEU A . n A 1 184 GLU 184 184 184 GLU GLU A . n A 1 185 LYS 185 185 185 LYS LYS A . n A 1 186 GLN 186 186 186 GLN GLN A . n A 1 187 GLU 187 187 187 GLU GLU A . n A 1 188 LYS 188 188 188 LYS LYS A . n A 1 189 PRO 189 189 189 PRO PRO A . n A 1 190 VAL 190 190 190 VAL VAL A . n A 1 191 ALA 191 191 191 ALA ALA A . n A 1 192 TRP 192 192 192 TRP TRP A . n A 1 193 LEU 193 193 193 LEU LEU A . n A 1 194 SER 194 194 194 SER SER A . n A 1 195 SER 195 195 195 SER SER A . n A 1 196 VAL 196 196 196 VAL VAL A . n A 1 197 PRO 197 197 197 PRO PRO A . n A 1 198 SER 198 198 ? ? ? A . n A 1 199 SER 199 199 ? ? ? A . n A 1 200 ALA 200 200 ? ? ? A . n A 1 201 HIS 201 201 ? ? ? A . n A 1 202 GLY 202 202 202 GLY GLY A . n A 1 203 HIS 203 203 203 HIS HIS A . n A 1 204 ARG 204 204 204 ARG ARG A . n A 1 205 GLN 205 205 205 GLN GLN A . n A 1 206 LEU 206 206 206 LEU LEU A . n A 1 207 VAL 207 207 207 VAL VAL A . n A 1 208 CYS 208 208 208 CYS CYS A . n A 1 209 HIS 209 209 209 HIS HIS A . n A 1 210 VAL 210 210 210 VAL VAL A . n A 1 211 SER 211 211 211 SER SER A . n A 1 212 GLY 212 212 212 GLY GLY A . n A 1 213 PHE 213 213 213 PHE PHE A . n A 1 214 TYR 214 214 214 TYR TYR A . n A 1 215 PRO 215 215 215 PRO PRO A . n A 1 216 LYS 216 216 216 LYS LYS A . n A 1 217 PRO 217 217 217 PRO PRO A . n A 1 218 VAL 218 218 218 VAL VAL A . n A 1 219 TRP 219 219 219 TRP TRP A . n A 1 220 VAL 220 220 220 VAL VAL A . n A 1 221 MET 221 221 221 MET MET A . n A 1 222 TRP 222 222 222 TRP TRP A . n A 1 223 MET 223 223 223 MET MET A . n A 1 224 ARG 224 224 224 ARG ARG A . n A 1 225 GLY 225 225 225 GLY GLY A . n A 1 226 ASP 226 226 226 ASP ASP A . n A 1 227 GLN 227 227 227 GLN GLN A . n A 1 228 GLU 228 228 228 GLU GLU A . n A 1 229 GLN 229 229 229 GLN GLN A . n A 1 230 GLN 230 230 230 GLN GLN A . n A 1 231 GLY 231 231 231 GLY GLY A . n A 1 232 THR 232 232 232 THR THR A . n A 1 233 HIS 233 233 233 HIS HIS A . n A 1 234 ARG 234 234 234 ARG ARG A . n A 1 235 GLY 235 235 235 GLY GLY A . n A 1 236 ASP 236 236 236 ASP ASP A . n A 1 237 PHE 237 237 237 PHE PHE A . n A 1 238 LEU 238 238 238 LEU LEU A . n A 1 239 PRO 239 239 239 PRO PRO A . n A 1 240 ASN 240 240 240 ASN ASN A . n A 1 241 ALA 241 241 241 ALA ALA A . n A 1 242 ASP 242 242 242 ASP ASP A . n A 1 243 GLU 243 243 243 GLU GLU A . n A 1 244 THR 244 244 244 THR THR A . n A 1 245 TRP 245 245 245 TRP TRP A . n A 1 246 TYR 246 246 246 TYR TYR A . n A 1 247 LEU 247 247 247 LEU LEU A . n A 1 248 GLN 248 248 248 GLN GLN A . n A 1 249 ALA 249 249 249 ALA ALA A . n A 1 250 THR 250 250 250 THR THR A . n A 1 251 LEU 251 251 251 LEU LEU A . n A 1 252 ASP 252 252 252 ASP ASP A . n A 1 253 VAL 253 253 253 VAL VAL A . n A 1 254 GLU 254 254 254 GLU GLU A . n A 1 255 ALA 255 255 255 ALA ALA A . n A 1 256 GLY 256 256 256 GLY GLY A . n A 1 257 GLU 257 257 257 GLU GLU A . n A 1 258 GLU 258 258 258 GLU GLU A . n A 1 259 ALA 259 259 259 ALA ALA A . n A 1 260 GLY 260 260 260 GLY GLY A . n A 1 261 LEU 261 261 261 LEU LEU A . n A 1 262 ALA 262 262 262 ALA ALA A . n A 1 263 CYS 263 263 263 CYS CYS A . n A 1 264 ARG 264 264 264 ARG ARG A . n A 1 265 VAL 265 265 265 VAL VAL A . n A 1 266 LYS 266 266 266 LYS LYS A . n A 1 267 HIS 267 267 267 HIS HIS A . n A 1 268 SER 268 268 268 SER SER A . n A 1 269 SER 269 269 269 SER SER A . n A 1 270 LEU 270 270 270 LEU LEU A . n A 1 271 GLY 271 271 271 GLY GLY A . n A 1 272 GLY 272 272 272 GLY GLY A . n A 1 273 GLN 273 273 273 GLN GLN A . n A 1 274 ASP 274 274 274 ASP ASP A . n A 1 275 ILE 275 275 275 ILE ILE A . n A 1 276 ILE 276 276 276 ILE ILE A . n A 1 277 LEU 277 277 277 LEU LEU A . n A 1 278 TYR 278 278 278 TYR TYR A . n A 1 279 TRP 279 279 279 TRP TRP A . n A 1 280 HIS 280 280 ? ? ? A . n A 1 281 HIS 281 281 ? ? ? A . n A 1 282 HIS 282 282 ? ? ? A . n A 1 283 HIS 283 283 ? ? ? A . n A 1 284 HIS 284 284 ? ? ? A . n A 1 285 HIS 285 285 ? ? ? A . n B 2 1 ILE 1 1 ? ? ? B . n B 2 2 GLN 2 2 2 GLN GLN B . n B 2 3 LYS 3 3 3 LYS LYS B . n B 2 4 THR 4 4 4 THR THR B . n B 2 5 PRO 5 5 5 PRO PRO B . n B 2 6 GLN 6 6 6 GLN GLN B . n B 2 7 ILE 7 7 7 ILE ILE B . n B 2 8 GLN 8 8 8 GLN GLN B . n B 2 9 VAL 9 9 9 VAL VAL B . n B 2 10 TYR 10 10 10 TYR TYR B . n B 2 11 SER 11 11 11 SER SER B . n B 2 12 ARG 12 12 12 ARG ARG B . n B 2 13 HIS 13 13 13 HIS HIS B . n B 2 14 PRO 14 14 14 PRO PRO B . n B 2 15 PRO 15 15 15 PRO PRO B . n B 2 16 GLU 16 16 16 GLU GLU B . n B 2 17 ASN 17 17 17 ASN ASN B . n B 2 18 GLY 18 18 18 GLY GLY B . n B 2 19 LYS 19 19 19 LYS LYS B . n B 2 20 PRO 20 20 20 PRO PRO B . n B 2 21 ASN 21 21 21 ASN ASN B . n B 2 22 ILE 22 22 22 ILE ILE B . n B 2 23 LEU 23 23 23 LEU LEU B . n B 2 24 ASN 24 24 24 ASN ASN B . n B 2 25 CYS 25 25 25 CYS CYS B . n B 2 26 TYR 26 26 26 TYR TYR B . n B 2 27 VAL 27 27 27 VAL VAL B . n B 2 28 THR 28 28 28 THR THR B . n B 2 29 GLN 29 29 29 GLN GLN B . n B 2 30 PHE 30 30 30 PHE PHE B . n B 2 31 HIS 31 31 31 HIS HIS B . n B 2 32 PRO 32 32 32 PRO PRO B . n B 2 33 PRO 33 33 33 PRO PRO B . n B 2 34 HIS 34 34 34 HIS HIS B . n B 2 35 ILE 35 35 35 ILE ILE B . n B 2 36 GLU 36 36 36 GLU GLU B . n B 2 37 ILE 37 37 37 ILE ILE B . n B 2 38 GLN 38 38 38 GLN GLN B . n B 2 39 MET 39 39 39 MET MET B . n B 2 40 LEU 40 40 40 LEU LEU B . n B 2 41 LYS 41 41 41 LYS LYS B . n B 2 42 ASN 42 42 42 ASN ASN B . n B 2 43 GLY 43 43 43 GLY GLY B . n B 2 44 LYS 44 44 44 LYS LYS B . n B 2 45 LYS 45 45 45 LYS LYS B . n B 2 46 ILE 46 46 46 ILE ILE B . n B 2 47 PRO 47 47 47 PRO PRO B . n B 2 48 LYS 48 48 48 LYS LYS B . n B 2 49 VAL 49 49 49 VAL VAL B . n B 2 50 GLU 50 50 50 GLU GLU B . n B 2 51 MET 51 51 51 MET MET B . n B 2 52 SER 52 52 52 SER SER B . n B 2 53 ASP 53 53 53 ASP ASP B . n B 2 54 MET 54 54 54 MET MET B . n B 2 55 SER 55 55 55 SER SER B . n B 2 56 PHE 56 56 56 PHE PHE B . n B 2 57 SER 57 57 57 SER SER B . n B 2 58 LYS 58 58 58 LYS LYS B . n B 2 59 ASP 59 59 59 ASP ASP B . n B 2 60 TRP 60 60 60 TRP TRP B . n B 2 61 SER 61 61 61 SER SER B . n B 2 62 PHE 62 62 62 PHE PHE B . n B 2 63 TYR 63 63 63 TYR TYR B . n B 2 64 ILE 64 64 64 ILE ILE B . n B 2 65 LEU 65 65 65 LEU LEU B . n B 2 66 ALA 66 66 66 ALA ALA B . n B 2 67 HIS 67 67 67 HIS HIS B . n B 2 68 THR 68 68 68 THR THR B . n B 2 69 GLU 69 69 69 GLU GLU B . n B 2 70 PHE 70 70 70 PHE PHE B . n B 2 71 THR 71 71 71 THR THR B . n B 2 72 PRO 72 72 72 PRO PRO B . n B 2 73 THR 73 73 73 THR THR B . n B 2 74 GLU 74 74 74 GLU GLU B . n B 2 75 THR 75 75 75 THR THR B . n B 2 76 ASP 76 76 76 ASP ASP B . n B 2 77 THR 77 77 77 THR THR B . n B 2 78 TYR 78 78 78 TYR TYR B . n B 2 79 ALA 79 79 79 ALA ALA B . n B 2 80 CYS 80 80 80 CYS CYS B . n B 2 81 ARG 81 81 81 ARG ARG B . n B 2 82 VAL 82 82 82 VAL VAL B . n B 2 83 LYS 83 83 83 LYS LYS B . n B 2 84 HIS 84 84 84 HIS HIS B . n B 2 85 ALA 85 85 85 ALA ALA B . n B 2 86 SER 86 86 86 SER SER B . n B 2 87 MET 87 87 87 MET MET B . n B 2 88 ALA 88 88 88 ALA ALA B . n B 2 89 GLU 89 89 89 GLU GLU B . n B 2 90 PRO 90 90 90 PRO PRO B . n B 2 91 LYS 91 91 91 LYS LYS B . n B 2 92 THR 92 92 92 THR THR B . n B 2 93 VAL 93 93 93 VAL VAL B . n B 2 94 TYR 94 94 94 TYR TYR B . n B 2 95 TRP 95 95 95 TRP TRP B . n B 2 96 ASP 96 96 96 ASP ASP B . n B 2 97 ARG 97 97 97 ARG ARG B . n B 2 98 ASP 98 98 98 ASP ASP B . n B 2 99 MET 99 99 99 MET MET B . n C 1 1 SER 1 1 ? ? ? C . n C 1 2 GLU 2 2 ? ? ? C . n C 1 3 ALA 3 3 ? ? ? C . n C 1 4 GLN 4 4 ? ? ? C . n C 1 5 GLN 5 5 ? ? ? C . n C 1 6 LYS 6 6 ? ? ? C . n C 1 7 ASN 7 7 7 ASN ASN C . n C 1 8 TYR 8 8 8 TYR TYR C . n C 1 9 THR 9 9 9 THR THR C . n C 1 10 PHE 10 10 10 PHE PHE C . n C 1 11 ARG 11 11 11 ARG ARG C . n C 1 12 CYS 12 12 12 CYS CYS C . n C 1 13 LEU 13 13 13 LEU LEU C . n C 1 14 GLN 14 14 14 GLN GLN C . n C 1 15 MET 15 15 15 MET MET C . n C 1 16 SER 16 16 16 SER SER C . n C 1 17 SER 17 17 17 SER SER C . n C 1 18 PHE 18 18 18 PHE PHE C . n C 1 19 ALA 19 19 19 ALA ALA C . n C 1 20 ASN 20 20 20 ASN ASN C . n C 1 21 ARG 21 21 21 ARG ARG C . n C 1 22 SER 22 22 22 SER SER C . n C 1 23 TRP 23 23 23 TRP TRP C . n C 1 24 SER 24 24 24 SER SER C . n C 1 25 ARG 25 25 25 ARG ARG C . n C 1 26 THR 26 26 26 THR THR C . n C 1 27 ASP 27 27 27 ASP ASP C . n C 1 28 SER 28 28 28 SER SER C . n C 1 29 VAL 29 29 29 VAL VAL C . n C 1 30 VAL 30 30 30 VAL VAL C . n C 1 31 TRP 31 31 31 TRP TRP C . n C 1 32 LEU 32 32 32 LEU LEU C . n C 1 33 GLY 33 33 33 GLY GLY C . n C 1 34 ASP 34 34 34 ASP ASP C . n C 1 35 LEU 35 35 35 LEU LEU C . n C 1 36 GLN 36 36 36 GLN GLN C . n C 1 37 THR 37 37 37 THR THR C . n C 1 38 HIS 38 38 38 HIS HIS C . n C 1 39 ARG 39 39 39 ARG ARG C . n C 1 40 TRP 40 40 40 TRP TRP C . n C 1 41 SER 41 41 41 SER SER C . n C 1 42 ASN 42 42 42 ASN ASN C . n C 1 43 ASP 43 43 43 ASP ASP C . n C 1 44 SER 44 44 44 SER SER C . n C 1 45 ALA 45 45 45 ALA ALA C . n C 1 46 THR 46 46 46 THR THR C . n C 1 47 ILE 47 47 47 ILE ILE C . n C 1 48 SER 48 48 48 SER SER C . n C 1 49 PHE 49 49 49 PHE PHE C . n C 1 50 THR 50 50 50 THR THR C . n C 1 51 LYS 51 51 51 LYS LYS C . n C 1 52 PRO 52 52 52 PRO PRO C . n C 1 53 TRP 53 53 53 TRP TRP C . n C 1 54 SER 54 54 54 SER SER C . n C 1 55 GLN 55 55 55 GLN GLN C . n C 1 56 GLY 56 56 56 GLY GLY C . n C 1 57 LYS 57 57 57 LYS LYS C . n C 1 58 LEU 58 58 58 LEU LEU C . n C 1 59 SER 59 59 59 SER SER C . n C 1 60 ASN 60 60 60 ASN ASN C . n C 1 61 GLN 61 61 61 GLN GLN C . n C 1 62 GLN 62 62 62 GLN GLN C . n C 1 63 TRP 63 63 63 TRP TRP C . n C 1 64 GLU 64 64 64 GLU GLU C . n C 1 65 LYS 65 65 65 LYS LYS C . n C 1 66 LEU 66 66 66 LEU LEU C . n C 1 67 GLN 67 67 67 GLN GLN C . n C 1 68 HIS 68 68 68 HIS HIS C . n C 1 69 MET 69 69 69 MET MET C . n C 1 70 PHE 70 70 70 PHE PHE C . n C 1 71 GLN 71 71 71 GLN GLN C . n C 1 72 VAL 72 72 72 VAL VAL C . n C 1 73 TYR 73 73 73 TYR TYR C . n C 1 74 ARG 74 74 74 ARG ARG C . n C 1 75 VAL 75 75 75 VAL VAL C . n C 1 76 SER 76 76 76 SER SER C . n C 1 77 PHE 77 77 77 PHE PHE C . n C 1 78 THR 78 78 78 THR THR C . n C 1 79 ARG 79 79 79 ARG ARG C . n C 1 80 ASP 80 80 80 ASP ASP C . n C 1 81 ILE 81 81 81 ILE ILE C . n C 1 82 GLN 82 82 82 GLN GLN C . n C 1 83 GLU 83 83 83 GLU GLU C . n C 1 84 LEU 84 84 84 LEU LEU C . n C 1 85 VAL 85 85 85 VAL VAL C . n C 1 86 LYS 86 86 86 LYS LYS C . n C 1 87 MET 87 87 87 MET MET C . n C 1 88 MET 88 88 88 MET MET C . n C 1 89 SER 89 89 89 SER SER C . n C 1 90 PRO 90 90 90 PRO PRO C . n C 1 91 LYS 91 91 91 LYS LYS C . n C 1 92 GLU 92 92 92 GLU GLU C . n C 1 93 ASP 93 93 93 ASP ASP C . n C 1 94 TYR 94 94 94 TYR TYR C . n C 1 95 PRO 95 95 95 PRO PRO C . n C 1 96 ILE 96 96 96 ILE ILE C . n C 1 97 GLU 97 97 97 GLU GLU C . n C 1 98 ILE 98 98 98 ILE ILE C . n C 1 99 GLN 99 99 99 GLN GLN C . n C 1 100 LEU 100 100 100 LEU LEU C . n C 1 101 SER 101 101 101 SER SER C . n C 1 102 ALA 102 102 102 ALA ALA C . n C 1 103 GLY 103 103 103 GLY GLY C . n C 1 104 CYS 104 104 104 CYS CYS C . n C 1 105 GLU 105 105 105 GLU GLU C . n C 1 106 MET 106 106 106 MET MET C . n C 1 107 TYR 107 107 107 TYR TYR C . n C 1 108 PRO 108 108 ? ? ? C . n C 1 109 GLY 109 109 ? ? ? C . n C 1 110 ASN 110 110 ? ? ? C . n C 1 111 ALA 111 111 ? ? ? C . n C 1 112 SER 112 112 112 SER SER C . n C 1 113 GLU 113 113 113 GLU GLU C . n C 1 114 SER 114 114 114 SER SER C . n C 1 115 PHE 115 115 115 PHE PHE C . n C 1 116 LEU 116 116 116 LEU LEU C . n C 1 117 HIS 117 117 117 HIS HIS C . n C 1 118 VAL 118 118 118 VAL VAL C . n C 1 119 ALA 119 119 119 ALA ALA C . n C 1 120 PHE 120 120 120 PHE PHE C . n C 1 121 GLN 121 121 121 GLN GLN C . n C 1 122 GLY 122 122 122 GLY GLY C . n C 1 123 LYS 123 123 123 LYS LYS C . n C 1 124 TYR 124 124 124 TYR TYR C . n C 1 125 VAL 125 125 125 VAL VAL C . n C 1 126 VAL 126 126 126 VAL VAL C . n C 1 127 ARG 127 127 127 ARG ARG C . n C 1 128 PHE 128 128 128 PHE PHE C . n C 1 129 TRP 129 129 129 TRP TRP C . n C 1 130 GLY 130 130 130 GLY GLY C . n C 1 131 THR 131 131 131 THR THR C . n C 1 132 SER 132 132 132 SER SER C . n C 1 133 TRP 133 133 133 TRP TRP C . n C 1 134 GLN 134 134 134 GLN GLN C . n C 1 135 THR 135 135 135 THR THR C . n C 1 136 VAL 136 136 136 VAL VAL C . n C 1 137 PRO 137 137 137 PRO PRO C . n C 1 138 GLY 138 138 138 GLY GLY C . n C 1 139 ALA 139 139 139 ALA ALA C . n C 1 140 PRO 140 140 140 PRO PRO C . n C 1 141 SER 141 141 141 SER SER C . n C 1 142 TRP 142 142 142 TRP TRP C . n C 1 143 LEU 143 143 143 LEU LEU C . n C 1 144 ASP 144 144 144 ASP ASP C . n C 1 145 LEU 145 145 145 LEU LEU C . n C 1 146 PRO 146 146 146 PRO PRO C . n C 1 147 ILE 147 147 147 ILE ILE C . n C 1 148 LYS 148 148 148 LYS LYS C . n C 1 149 VAL 149 149 149 VAL VAL C . n C 1 150 LEU 150 150 150 LEU LEU C . n C 1 151 ASN 151 151 151 ASN ASN C . n C 1 152 ALA 152 152 152 ALA ALA C . n C 1 153 ASP 153 153 153 ASP ASP C . n C 1 154 GLN 154 154 154 GLN GLN C . n C 1 155 GLY 155 155 155 GLY GLY C . n C 1 156 THR 156 156 156 THR THR C . n C 1 157 SER 157 157 157 SER SER C . n C 1 158 ALA 158 158 158 ALA ALA C . n C 1 159 THR 159 159 159 THR THR C . n C 1 160 VAL 160 160 160 VAL VAL C . n C 1 161 GLN 161 161 161 GLN GLN C . n C 1 162 MET 162 162 162 MET MET C . n C 1 163 LEU 163 163 163 LEU LEU C . n C 1 164 LEU 164 164 164 LEU LEU C . n C 1 165 ASN 165 165 165 ASN ASN C . n C 1 166 ASP 166 166 166 ASP ASP C . n C 1 167 THR 167 167 167 THR THR C . n C 1 168 CYS 168 168 168 CYS CYS C . n C 1 169 PRO 169 169 169 PRO PRO C . n C 1 170 LEU 170 170 170 LEU LEU C . n C 1 171 PHE 171 171 171 PHE PHE C . n C 1 172 VAL 172 172 172 VAL VAL C . n C 1 173 ARG 173 173 173 ARG ARG C . n C 1 174 GLY 174 174 174 GLY GLY C . n C 1 175 LEU 175 175 175 LEU LEU C . n C 1 176 LEU 176 176 176 LEU LEU C . n C 1 177 GLU 177 177 177 GLU GLU C . n C 1 178 ALA 178 178 178 ALA ALA C . n C 1 179 GLY 179 179 179 GLY GLY C . n C 1 180 LYS 180 180 180 LYS LYS C . n C 1 181 SER 181 181 181 SER SER C . n C 1 182 ASP 182 182 182 ASP ASP C . n C 1 183 LEU 183 183 183 LEU LEU C . n C 1 184 GLU 184 184 184 GLU GLU C . n C 1 185 LYS 185 185 185 LYS LYS C . n C 1 186 GLN 186 186 186 GLN GLN C . n C 1 187 GLU 187 187 187 GLU GLU C . n C 1 188 LYS 188 188 188 LYS LYS C . n C 1 189 PRO 189 189 189 PRO PRO C . n C 1 190 VAL 190 190 190 VAL VAL C . n C 1 191 ALA 191 191 191 ALA ALA C . n C 1 192 TRP 192 192 192 TRP TRP C . n C 1 193 LEU 193 193 193 LEU LEU C . n C 1 194 SER 194 194 194 SER SER C . n C 1 195 SER 195 195 195 SER SER C . n C 1 196 VAL 196 196 196 VAL VAL C . n C 1 197 PRO 197 197 197 PRO PRO C . n C 1 198 SER 198 198 ? ? ? C . n C 1 199 SER 199 199 ? ? ? C . n C 1 200 ALA 200 200 ? ? ? C . n C 1 201 HIS 201 201 201 HIS HIS C . n C 1 202 GLY 202 202 202 GLY GLY C . n C 1 203 HIS 203 203 203 HIS HIS C . n C 1 204 ARG 204 204 204 ARG ARG C . n C 1 205 GLN 205 205 205 GLN GLN C . n C 1 206 LEU 206 206 206 LEU LEU C . n C 1 207 VAL 207 207 207 VAL VAL C . n C 1 208 CYS 208 208 208 CYS CYS C . n C 1 209 HIS 209 209 209 HIS HIS C . n C 1 210 VAL 210 210 210 VAL VAL C . n C 1 211 SER 211 211 211 SER SER C . n C 1 212 GLY 212 212 212 GLY GLY C . n C 1 213 PHE 213 213 213 PHE PHE C . n C 1 214 TYR 214 214 214 TYR TYR C . n C 1 215 PRO 215 215 215 PRO PRO C . n C 1 216 LYS 216 216 216 LYS LYS C . n C 1 217 PRO 217 217 217 PRO PRO C . n C 1 218 VAL 218 218 218 VAL VAL C . n C 1 219 TRP 219 219 219 TRP TRP C . n C 1 220 VAL 220 220 220 VAL VAL C . n C 1 221 MET 221 221 221 MET MET C . n C 1 222 TRP 222 222 222 TRP TRP C . n C 1 223 MET 223 223 223 MET MET C . n C 1 224 ARG 224 224 224 ARG ARG C . n C 1 225 GLY 225 225 225 GLY GLY C . n C 1 226 ASP 226 226 226 ASP ASP C . n C 1 227 GLN 227 227 227 GLN GLN C . n C 1 228 GLU 228 228 228 GLU GLU C . n C 1 229 GLN 229 229 229 GLN GLN C . n C 1 230 GLN 230 230 230 GLN GLN C . n C 1 231 GLY 231 231 231 GLY GLY C . n C 1 232 THR 232 232 232 THR THR C . n C 1 233 HIS 233 233 233 HIS HIS C . n C 1 234 ARG 234 234 234 ARG ARG C . n C 1 235 GLY 235 235 235 GLY GLY C . n C 1 236 ASP 236 236 236 ASP ASP C . n C 1 237 PHE 237 237 237 PHE PHE C . n C 1 238 LEU 238 238 238 LEU LEU C . n C 1 239 PRO 239 239 239 PRO PRO C . n C 1 240 ASN 240 240 240 ASN ASN C . n C 1 241 ALA 241 241 241 ALA ALA C . n C 1 242 ASP 242 242 242 ASP ASP C . n C 1 243 GLU 243 243 243 GLU GLU C . n C 1 244 THR 244 244 244 THR THR C . n C 1 245 TRP 245 245 245 TRP TRP C . n C 1 246 TYR 246 246 246 TYR TYR C . n C 1 247 LEU 247 247 247 LEU LEU C . n C 1 248 GLN 248 248 248 GLN GLN C . n C 1 249 ALA 249 249 249 ALA ALA C . n C 1 250 THR 250 250 250 THR THR C . n C 1 251 LEU 251 251 251 LEU LEU C . n C 1 252 ASP 252 252 252 ASP ASP C . n C 1 253 VAL 253 253 253 VAL VAL C . n C 1 254 GLU 254 254 254 GLU GLU C . n C 1 255 ALA 255 255 255 ALA ALA C . n C 1 256 GLY 256 256 256 GLY GLY C . n C 1 257 GLU 257 257 257 GLU GLU C . n C 1 258 GLU 258 258 258 GLU GLU C . n C 1 259 ALA 259 259 259 ALA ALA C . n C 1 260 GLY 260 260 260 GLY GLY C . n C 1 261 LEU 261 261 261 LEU LEU C . n C 1 262 ALA 262 262 262 ALA ALA C . n C 1 263 CYS 263 263 263 CYS CYS C . n C 1 264 ARG 264 264 264 ARG ARG C . n C 1 265 VAL 265 265 265 VAL VAL C . n C 1 266 LYS 266 266 266 LYS LYS C . n C 1 267 HIS 267 267 267 HIS HIS C . n C 1 268 SER 268 268 268 SER SER C . n C 1 269 SER 269 269 269 SER SER C . n C 1 270 LEU 270 270 270 LEU LEU C . n C 1 271 GLY 271 271 271 GLY GLY C . n C 1 272 GLY 272 272 272 GLY GLY C . n C 1 273 GLN 273 273 273 GLN GLN C . n C 1 274 ASP 274 274 274 ASP ASP C . n C 1 275 ILE 275 275 275 ILE ILE C . n C 1 276 ILE 276 276 276 ILE ILE C . n C 1 277 LEU 277 277 277 LEU LEU C . n C 1 278 TYR 278 278 278 TYR TYR C . n C 1 279 TRP 279 279 279 TRP TRP C . n C 1 280 HIS 280 280 ? ? ? C . n C 1 281 HIS 281 281 ? ? ? C . n C 1 282 HIS 282 282 ? ? ? C . n C 1 283 HIS 283 283 ? ? ? C . n C 1 284 HIS 284 284 ? ? ? C . n C 1 285 HIS 285 285 ? ? ? C . n D 2 1 ILE 1 1 ? ? ? D . n D 2 2 GLN 2 2 2 GLN GLN D . n D 2 3 LYS 3 3 3 LYS LYS D . n D 2 4 THR 4 4 4 THR THR D . n D 2 5 PRO 5 5 5 PRO PRO D . n D 2 6 GLN 6 6 6 GLN GLN D . n D 2 7 ILE 7 7 7 ILE ILE D . n D 2 8 GLN 8 8 8 GLN GLN D . n D 2 9 VAL 9 9 9 VAL VAL D . n D 2 10 TYR 10 10 10 TYR TYR D . n D 2 11 SER 11 11 11 SER SER D . n D 2 12 ARG 12 12 12 ARG ARG D . n D 2 13 HIS 13 13 13 HIS HIS D . n D 2 14 PRO 14 14 14 PRO PRO D . n D 2 15 PRO 15 15 15 PRO PRO D . n D 2 16 GLU 16 16 16 GLU GLU D . n D 2 17 ASN 17 17 17 ASN ASN D . n D 2 18 GLY 18 18 18 GLY GLY D . n D 2 19 LYS 19 19 19 LYS LYS D . n D 2 20 PRO 20 20 20 PRO PRO D . n D 2 21 ASN 21 21 21 ASN ASN D . n D 2 22 ILE 22 22 22 ILE ILE D . n D 2 23 LEU 23 23 23 LEU LEU D . n D 2 24 ASN 24 24 24 ASN ASN D . n D 2 25 CYS 25 25 25 CYS CYS D . n D 2 26 TYR 26 26 26 TYR TYR D . n D 2 27 VAL 27 27 27 VAL VAL D . n D 2 28 THR 28 28 28 THR THR D . n D 2 29 GLN 29 29 29 GLN GLN D . n D 2 30 PHE 30 30 30 PHE PHE D . n D 2 31 HIS 31 31 31 HIS HIS D . n D 2 32 PRO 32 32 32 PRO PRO D . n D 2 33 PRO 33 33 33 PRO PRO D . n D 2 34 HIS 34 34 34 HIS HIS D . n D 2 35 ILE 35 35 35 ILE ILE D . n D 2 36 GLU 36 36 36 GLU GLU D . n D 2 37 ILE 37 37 37 ILE ILE D . n D 2 38 GLN 38 38 38 GLN GLN D . n D 2 39 MET 39 39 39 MET MET D . n D 2 40 LEU 40 40 40 LEU LEU D . n D 2 41 LYS 41 41 41 LYS LYS D . n D 2 42 ASN 42 42 42 ASN ASN D . n D 2 43 GLY 43 43 43 GLY GLY D . n D 2 44 LYS 44 44 44 LYS LYS D . n D 2 45 LYS 45 45 45 LYS LYS D . n D 2 46 ILE 46 46 46 ILE ILE D . n D 2 47 PRO 47 47 47 PRO PRO D . n D 2 48 LYS 48 48 48 LYS LYS D . n D 2 49 VAL 49 49 49 VAL VAL D . n D 2 50 GLU 50 50 50 GLU GLU D . n D 2 51 MET 51 51 51 MET MET D . n D 2 52 SER 52 52 52 SER SER D . n D 2 53 ASP 53 53 53 ASP ASP D . n D 2 54 MET 54 54 54 MET MET D . n D 2 55 SER 55 55 55 SER SER D . n D 2 56 PHE 56 56 56 PHE PHE D . n D 2 57 SER 57 57 57 SER SER D . n D 2 58 LYS 58 58 58 LYS LYS D . n D 2 59 ASP 59 59 59 ASP ASP D . n D 2 60 TRP 60 60 60 TRP TRP D . n D 2 61 SER 61 61 61 SER SER D . n D 2 62 PHE 62 62 62 PHE PHE D . n D 2 63 TYR 63 63 63 TYR TYR D . n D 2 64 ILE 64 64 64 ILE ILE D . n D 2 65 LEU 65 65 65 LEU LEU D . n D 2 66 ALA 66 66 66 ALA ALA D . n D 2 67 HIS 67 67 67 HIS HIS D . n D 2 68 THR 68 68 68 THR THR D . n D 2 69 GLU 69 69 69 GLU GLU D . n D 2 70 PHE 70 70 70 PHE PHE D . n D 2 71 THR 71 71 71 THR THR D . n D 2 72 PRO 72 72 72 PRO PRO D . n D 2 73 THR 73 73 73 THR THR D . n D 2 74 GLU 74 74 74 GLU GLU D . n D 2 75 THR 75 75 75 THR THR D . n D 2 76 ASP 76 76 76 ASP ASP D . n D 2 77 THR 77 77 77 THR THR D . n D 2 78 TYR 78 78 78 TYR TYR D . n D 2 79 ALA 79 79 79 ALA ALA D . n D 2 80 CYS 80 80 80 CYS CYS D . n D 2 81 ARG 81 81 81 ARG ARG D . n D 2 82 VAL 82 82 82 VAL VAL D . n D 2 83 LYS 83 83 83 LYS LYS D . n D 2 84 HIS 84 84 84 HIS HIS D . n D 2 85 ALA 85 85 85 ALA ALA D . n D 2 86 SER 86 86 86 SER SER D . n D 2 87 MET 87 87 87 MET MET D . n D 2 88 ALA 88 88 88 ALA ALA D . n D 2 89 GLU 89 89 89 GLU GLU D . n D 2 90 PRO 90 90 90 PRO PRO D . n D 2 91 LYS 91 91 91 LYS LYS D . n D 2 92 THR 92 92 92 THR THR D . n D 2 93 VAL 93 93 93 VAL VAL D . n D 2 94 TYR 94 94 94 TYR TYR D . n D 2 95 TRP 95 95 95 TRP TRP D . n D 2 96 ASP 96 96 96 ASP ASP D . n D 2 97 ARG 97 97 97 ARG ARG D . n D 2 98 ASP 98 98 98 ASP ASP D . n D 2 99 MET 99 99 99 MET MET D . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code E 3 NAG 1 500 500 NAG NAG A . F 3 NAG 1 501 501 NAG NAG A . G 3 NAG 1 511 511 NAG NAG A . H 3 NAG 2 512 512 NAG NAG A . I 4 PBS 1 601 601 PBS PBS A . J 5 R16 1 701 701 R16 R16 A . K 3 NAG 1 501 501 NAG NAG C . L 3 NAG 1 511 511 NAG NAG C . M 3 NAG 2 512 512 NAG NAG C . N 4 PBS 1 602 602 PBS PBS C . O 5 R16 1 702 702 R16 R16 C . P 6 HOH 1 702 1 HOH HOH A . P 6 HOH 2 703 3 HOH HOH A . P 6 HOH 3 704 10 HOH HOH A . P 6 HOH 4 705 19 HOH HOH A . P 6 HOH 5 706 22 HOH HOH A . P 6 HOH 6 707 25 HOH HOH A . P 6 HOH 7 708 31 HOH HOH A . P 6 HOH 8 709 42 HOH HOH A . P 6 HOH 9 710 51 HOH HOH A . P 6 HOH 10 711 52 HOH HOH A . P 6 HOH 11 712 56 HOH HOH A . P 6 HOH 12 713 57 HOH HOH A . P 6 HOH 13 714 59 HOH HOH A . P 6 HOH 14 715 64 HOH HOH A . P 6 HOH 15 716 65 HOH HOH A . P 6 HOH 16 717 67 HOH HOH A . P 6 HOH 17 718 70 HOH HOH A . P 6 HOH 18 719 75 HOH HOH A . P 6 HOH 19 720 79 HOH HOH A . P 6 HOH 20 721 82 HOH HOH A . P 6 HOH 21 722 85 HOH HOH A . P 6 HOH 22 723 86 HOH HOH A . P 6 HOH 23 724 88 HOH HOH A . P 6 HOH 24 725 94 HOH HOH A . P 6 HOH 25 726 95 HOH HOH A . P 6 HOH 26 727 99 HOH HOH A . P 6 HOH 27 728 100 HOH HOH A . P 6 HOH 28 729 101 HOH HOH A . P 6 HOH 29 730 109 HOH HOH A . P 6 HOH 30 731 114 HOH HOH A . P 6 HOH 31 732 116 HOH HOH A . P 6 HOH 32 733 117 HOH HOH A . P 6 HOH 33 734 119 HOH HOH A . P 6 HOH 34 735 121 HOH HOH A . P 6 HOH 35 736 122 HOH HOH A . P 6 HOH 36 737 123 HOH HOH A . P 6 HOH 37 738 124 HOH HOH A . P 6 HOH 38 739 125 HOH HOH A . P 6 HOH 39 740 127 HOH HOH A . P 6 HOH 40 741 130 HOH HOH A . P 6 HOH 41 742 134 HOH HOH A . P 6 HOH 42 743 140 HOH HOH A . P 6 HOH 43 744 141 HOH HOH A . P 6 HOH 44 745 148 HOH HOH A . P 6 HOH 45 746 149 HOH HOH A . P 6 HOH 46 747 151 HOH HOH A . P 6 HOH 47 748 155 HOH HOH A . P 6 HOH 48 749 162 HOH HOH A . P 6 HOH 49 750 164 HOH HOH A . P 6 HOH 50 751 165 HOH HOH A . Q 6 HOH 1 100 2 HOH HOH B . Q 6 HOH 2 101 5 HOH HOH B . Q 6 HOH 3 102 6 HOH HOH B . Q 6 HOH 4 103 7 HOH HOH B . Q 6 HOH 5 104 8 HOH HOH B . Q 6 HOH 6 105 14 HOH HOH B . Q 6 HOH 7 106 20 HOH HOH B . Q 6 HOH 8 107 33 HOH HOH B . Q 6 HOH 9 108 34 HOH HOH B . Q 6 HOH 10 109 35 HOH HOH B . Q 6 HOH 11 110 38 HOH HOH B . Q 6 HOH 12 111 39 HOH HOH B . Q 6 HOH 13 112 41 HOH HOH B . Q 6 HOH 14 113 50 HOH HOH B . Q 6 HOH 15 114 60 HOH HOH B . Q 6 HOH 16 115 77 HOH HOH B . Q 6 HOH 17 116 91 HOH HOH B . Q 6 HOH 18 117 92 HOH HOH B . Q 6 HOH 19 118 107 HOH HOH B . Q 6 HOH 20 119 111 HOH HOH B . Q 6 HOH 21 120 132 HOH HOH B . Q 6 HOH 22 121 150 HOH HOH B . Q 6 HOH 23 122 163 HOH HOH B . Q 6 HOH 24 123 166 HOH HOH B . R 6 HOH 1 703 9 HOH HOH C . R 6 HOH 2 704 11 HOH HOH C . R 6 HOH 3 705 13 HOH HOH C . R 6 HOH 4 706 17 HOH HOH C . R 6 HOH 5 707 18 HOH HOH C . R 6 HOH 6 708 21 HOH HOH C . R 6 HOH 7 709 24 HOH HOH C . R 6 HOH 8 710 27 HOH HOH C . R 6 HOH 9 711 28 HOH HOH C . R 6 HOH 10 712 29 HOH HOH C . R 6 HOH 11 713 30 HOH HOH C . R 6 HOH 12 714 32 HOH HOH C . R 6 HOH 13 715 36 HOH HOH C . R 6 HOH 14 716 40 HOH HOH C . R 6 HOH 15 717 43 HOH HOH C . R 6 HOH 16 718 45 HOH HOH C . R 6 HOH 17 719 46 HOH HOH C . R 6 HOH 18 720 49 HOH HOH C . R 6 HOH 19 721 53 HOH HOH C . R 6 HOH 20 722 54 HOH HOH C . R 6 HOH 21 723 55 HOH HOH C . R 6 HOH 22 724 58 HOH HOH C . R 6 HOH 23 725 66 HOH HOH C . R 6 HOH 24 726 68 HOH HOH C . R 6 HOH 25 727 69 HOH HOH C . R 6 HOH 26 728 72 HOH HOH C . R 6 HOH 27 729 73 HOH HOH C . R 6 HOH 28 730 74 HOH HOH C . R 6 HOH 29 731 76 HOH HOH C . R 6 HOH 30 732 80 HOH HOH C . R 6 HOH 31 733 81 HOH HOH C . R 6 HOH 32 734 84 HOH HOH C . R 6 HOH 33 735 89 HOH HOH C . R 6 HOH 34 736 93 HOH HOH C . R 6 HOH 35 737 97 HOH HOH C . R 6 HOH 36 738 98 HOH HOH C . R 6 HOH 37 739 102 HOH HOH C . R 6 HOH 38 740 105 HOH HOH C . R 6 HOH 39 741 110 HOH HOH C . R 6 HOH 40 742 112 HOH HOH C . R 6 HOH 41 743 113 HOH HOH C . R 6 HOH 42 744 115 HOH HOH C . R 6 HOH 43 745 118 HOH HOH C . R 6 HOH 44 746 126 HOH HOH C . R 6 HOH 45 747 128 HOH HOH C . R 6 HOH 46 748 129 HOH HOH C . R 6 HOH 47 749 131 HOH HOH C . R 6 HOH 48 750 133 HOH HOH C . R 6 HOH 49 751 135 HOH HOH C . R 6 HOH 50 752 136 HOH HOH C . R 6 HOH 51 753 137 HOH HOH C . R 6 HOH 52 754 138 HOH HOH C . R 6 HOH 53 755 139 HOH HOH C . R 6 HOH 54 756 142 HOH HOH C . R 6 HOH 55 757 143 HOH HOH C . R 6 HOH 56 758 144 HOH HOH C . R 6 HOH 57 759 145 HOH HOH C . R 6 HOH 58 760 146 HOH HOH C . R 6 HOH 59 761 147 HOH HOH C . R 6 HOH 60 762 152 HOH HOH C . R 6 HOH 61 763 153 HOH HOH C . R 6 HOH 62 764 154 HOH HOH C . R 6 HOH 63 765 156 HOH HOH C . R 6 HOH 64 766 157 HOH HOH C . R 6 HOH 65 767 158 HOH HOH C . R 6 HOH 66 768 159 HOH HOH C . S 6 HOH 1 100 4 HOH HOH D . S 6 HOH 2 101 12 HOH HOH D . S 6 HOH 3 102 15 HOH HOH D . S 6 HOH 4 103 16 HOH HOH D . S 6 HOH 5 104 23 HOH HOH D . S 6 HOH 6 105 26 HOH HOH D . S 6 HOH 7 106 37 HOH HOH D . S 6 HOH 8 107 44 HOH HOH D . S 6 HOH 9 108 47 HOH HOH D . S 6 HOH 10 109 48 HOH HOH D . S 6 HOH 11 110 61 HOH HOH D . S 6 HOH 12 111 62 HOH HOH D . S 6 HOH 13 112 63 HOH HOH D . S 6 HOH 14 113 71 HOH HOH D . S 6 HOH 15 114 78 HOH HOH D . S 6 HOH 16 115 83 HOH HOH D . S 6 HOH 17 116 87 HOH HOH D . S 6 HOH 18 117 90 HOH HOH D . S 6 HOH 19 118 96 HOH HOH D . S 6 HOH 20 119 103 HOH HOH D . S 6 HOH 21 120 104 HOH HOH D . S 6 HOH 22 121 106 HOH HOH D . S 6 HOH 23 122 120 HOH HOH D . S 6 HOH 24 123 160 HOH HOH D . S 6 HOH 25 124 161 HOH HOH D . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 20 A ASN 20 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 42 A ASN 42 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 165 A ASN 165 ? ASN 'GLYCOSYLATION SITE' 4 C ASN 42 C ASN 42 ? ASN 'GLYCOSYLATION SITE' 5 C ASN 165 C ASN 165 ? ASN 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PISA dimeric 2 2 author_and_software_defined_assembly PISA dimeric 2 3 software_defined_assembly PISA tetrameric 4 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,B,E,F,G,H,I,J,P,Q 2 1 C,D,K,L,M,N,O,R,S 3 1 A,B,E,F,G,H,I,J,P,Q 3 2 C,D,K,L,M,N,O,R,S # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 5780 ? 1 MORE -17 ? 1 'SSA (A^2)' 18460 ? 2 'ABSA (A^2)' 5360 ? 2 MORE -21 ? 2 'SSA (A^2)' 18510 ? 3 'ABSA (A^2)' 11990 ? 3 MORE -38 ? 3 'SSA (A^2)' 36130 ? # loop_ _pdbx_struct_oper_list.id _pdbx_struct_oper_list.type _pdbx_struct_oper_list.name _pdbx_struct_oper_list.symmetry_operation _pdbx_struct_oper_list.matrix[1][1] _pdbx_struct_oper_list.matrix[1][2] _pdbx_struct_oper_list.matrix[1][3] _pdbx_struct_oper_list.vector[1] _pdbx_struct_oper_list.matrix[2][1] _pdbx_struct_oper_list.matrix[2][2] _pdbx_struct_oper_list.matrix[2][3] _pdbx_struct_oper_list.vector[2] _pdbx_struct_oper_list.matrix[3][1] _pdbx_struct_oper_list.matrix[3][2] _pdbx_struct_oper_list.matrix[3][3] _pdbx_struct_oper_list.vector[3] 1 'identity operation' 1_555 x,y,z 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 2 'crystal symmetry operation' 2_645 -x+1,y-1/2,-z -1.0000000000 0.0000000000 0.0000000000 59.4510000000 0.0000000000 1.0000000000 0.0000000000 -38.5225000000 0.0000000000 0.0000000000 -1.0000000000 0.0000000000 # 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 2005-07-19 2 'Structure model' 1 1 2008-04-30 3 'Structure model' 1 2 2011-07-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # 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' 'Version format compliance' 2 3 'Structure model' Advisory 3 3 'Structure model' 'Version format compliance' # loop_ _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.pdbx_refine_id 1 ? refined 9.3252 1.6892 21.2058 -.3238 -.5038 -.3070 -.1282 -.0112 -.0851 5.7707 2.3160 2.1246 -.9734 -1.7664 1.2528 -.0062 -.3573 .2091 -.2264 -.0799 -.1010 -.0291 .1861 .0861 'X-RAY DIFFRACTION' 2 ? refined -20.5673 -6.5252 43.7986 -.3388 -.2765 -.3574 .0525 .0482 -.0554 6.0890 2.8682 6.7677 2.0857 -2.9288 -2.0525 -.5486 -.5566 -.6109 .1389 .0530 .0596 .7169 .5386 .4956 'X-RAY DIFFRACTION' 3 ? refined -19.2467 3.3138 23.9131 -.3091 -.4705 -.3313 -.1024 -.1009 -.0264 8.3686 1.4258 2.9125 -1.8918 -1.8051 1.5714 -.0322 .4887 .2014 -.2154 -.0211 .1131 -.0921 -.2963 .0533 'X-RAY DIFFRACTION' 4 ? refined 36.5954 39.8260 18.3967 -.3460 -.4286 -.2589 -.0750 .0372 .0099 4.3337 2.4328 2.8370 -.5661 -1.5626 1.1670 .0979 -.2713 .3025 -.1409 -.1212 -.0279 -.0188 .1156 .0234 'X-RAY DIFFRACTION' 5 ? refined 6.1104 31.0647 40.3175 -.3212 -.2550 -.3299 -.0786 .0534 -.2036 5.0009 3.6228 4.7959 2.1453 -1.8113 -1.9363 -.2365 -.1139 -.4260 -.0227 .0411 .0121 .5254 .1707 .1954 'X-RAY DIFFRACTION' 6 ? refined 8.0163 41.3866 20.5717 -.3304 -.4579 -.2349 -.0908 -.0350 -.0241 7.2435 1.5108 2.9623 -1.3498 -.9347 1.3996 -.0448 .5214 .3105 -.0619 -.0581 .2476 -.0343 -.1327 .1029 'X-RAY DIFFRACTION' # loop_ _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.selection_details 1 1 A 8 A 8 A 185 A 185 ? 'X-RAY DIFFRACTION' ? 2 1 A 500 E ? A 501 F ? ? 'X-RAY DIFFRACTION' ? 3 1 A 511 G ? A 512 G ? ? 'X-RAY DIFFRACTION' ? 4 1 A 601 J ? A 601 J ? ? 'X-RAY DIFFRACTION' ? 5 1 A 701 L ? A 701 L ? ? 'X-RAY DIFFRACTION' ? 6 2 A 186 A 186 A 279 A 279 ? 'X-RAY DIFFRACTION' ? 7 3 B 2 B 2 B 99 B 99 ? 'X-RAY DIFFRACTION' ? 8 4 C 7 C 7 C 185 C 185 ? 'X-RAY DIFFRACTION' ? 9 4 C 501 H ? C 501 H ? ? 'X-RAY DIFFRACTION' ? 10 4 C 511 I ? C 512 I ? ? 'X-RAY DIFFRACTION' ? 11 4 C 602 K ? C 602 K ? ? 'X-RAY DIFFRACTION' ? 12 4 C 702 M ? C 702 M ? ? 'X-RAY DIFFRACTION' ? 13 5 C 186 C 186 C 279 C 279 ? 'X-RAY DIFFRACTION' ? 14 6 D 2 D 2 D 99 D 99 ? 'X-RAY DIFFRACTION' ? # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal REFMAC refinement 5.2.0003 ? 1 HKL-2000 'data reduction' . ? 2 CCP4 'data scaling' '(TRUNCATE)' ? 3 MOLREP phasing . ? 4 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O B ASP 96 ? ? N B ASP 98 ? ? 2.05 2 1 ND2 C ASN 165 ? ? C2 C NAG 511 ? ? 2.16 # _pdbx_validate_symm_contact.id 1 _pdbx_validate_symm_contact.PDB_model_num 1 _pdbx_validate_symm_contact.auth_atom_id_1 CG _pdbx_validate_symm_contact.auth_asym_id_1 A _pdbx_validate_symm_contact.auth_comp_id_1 MET _pdbx_validate_symm_contact.auth_seq_id_1 162 _pdbx_validate_symm_contact.PDB_ins_code_1 ? _pdbx_validate_symm_contact.label_alt_id_1 ? _pdbx_validate_symm_contact.site_symmetry_1 1_555 _pdbx_validate_symm_contact.auth_atom_id_2 NH2 _pdbx_validate_symm_contact.auth_asym_id_2 B _pdbx_validate_symm_contact.auth_comp_id_2 ARG _pdbx_validate_symm_contact.auth_seq_id_2 97 _pdbx_validate_symm_contact.PDB_ins_code_2 ? _pdbx_validate_symm_contact.label_alt_id_2 ? _pdbx_validate_symm_contact.site_symmetry_2 1_655 _pdbx_validate_symm_contact.dist 1.99 # loop_ _pdbx_validate_rmsd_bond.id _pdbx_validate_rmsd_bond.PDB_model_num _pdbx_validate_rmsd_bond.auth_atom_id_1 _pdbx_validate_rmsd_bond.auth_asym_id_1 _pdbx_validate_rmsd_bond.auth_comp_id_1 _pdbx_validate_rmsd_bond.auth_seq_id_1 _pdbx_validate_rmsd_bond.PDB_ins_code_1 _pdbx_validate_rmsd_bond.label_alt_id_1 _pdbx_validate_rmsd_bond.auth_atom_id_2 _pdbx_validate_rmsd_bond.auth_asym_id_2 _pdbx_validate_rmsd_bond.auth_comp_id_2 _pdbx_validate_rmsd_bond.auth_seq_id_2 _pdbx_validate_rmsd_bond.PDB_ins_code_2 _pdbx_validate_rmsd_bond.label_alt_id_2 _pdbx_validate_rmsd_bond.bond_value _pdbx_validate_rmsd_bond.bond_target_value _pdbx_validate_rmsd_bond.bond_deviation _pdbx_validate_rmsd_bond.bond_standard_deviation _pdbx_validate_rmsd_bond.linker_flag 1 1 CA A GLN 62 ? ? CB A GLN 62 ? ? 1.205 1.535 -0.330 0.022 N 2 1 CA A GLU 105 ? ? CB A GLU 105 ? ? 1.319 1.535 -0.216 0.022 N 3 1 CA A GLU 184 ? ? CB A GLU 184 ? ? 1.142 1.535 -0.393 0.022 N 4 1 CA A ALA 255 ? ? CB A ALA 255 ? ? 1.273 1.520 -0.247 0.021 N 5 1 CA A GLU 257 ? ? CB A GLU 257 ? ? 1.387 1.535 -0.148 0.022 N 6 1 CA B LYS 3 ? ? CB B LYS 3 ? ? 1.181 1.535 -0.354 0.022 N 7 1 CA B LYS 83 ? ? CB B LYS 83 ? ? 1.348 1.535 -0.187 0.022 N 8 1 CA B GLU 89 ? ? CB B GLU 89 ? ? 1.723 1.535 0.188 0.022 N 9 1 CA C GLN 61 ? ? CB C GLN 61 ? ? 1.673 1.535 0.138 0.022 N 10 1 CA C ARG 79 ? ? CB C ARG 79 ? ? 1.372 1.535 -0.163 0.022 N 11 1 CA C LYS 91 ? ? CB C LYS 91 ? ? 1.020 1.535 -0.515 0.022 N 12 1 CA C ARG 173 ? ? CB C ARG 173 ? ? 1.312 1.535 -0.223 0.022 N 13 1 CA C LYS 188 ? ? CB C LYS 188 ? ? 1.401 1.535 -0.134 0.022 N 14 1 CA C GLU 257 ? ? CB C GLU 257 ? ? 1.302 1.535 -0.233 0.022 N 15 1 CA C GLN 273 ? ? CB C GLN 273 ? ? 1.101 1.535 -0.434 0.022 N 16 1 CA D GLU 16 ? ? CB D GLU 16 ? ? 1.694 1.535 0.159 0.022 N 17 1 CA D LYS 48 ? ? CB D LYS 48 ? ? 1.307 1.535 -0.228 0.022 N 18 1 CA D LYS 58 ? ? CB D LYS 58 ? ? 1.372 1.535 -0.163 0.022 N # loop_ _pdbx_validate_rmsd_angle.id _pdbx_validate_rmsd_angle.PDB_model_num _pdbx_validate_rmsd_angle.auth_atom_id_1 _pdbx_validate_rmsd_angle.auth_asym_id_1 _pdbx_validate_rmsd_angle.auth_comp_id_1 _pdbx_validate_rmsd_angle.auth_seq_id_1 _pdbx_validate_rmsd_angle.PDB_ins_code_1 _pdbx_validate_rmsd_angle.label_alt_id_1 _pdbx_validate_rmsd_angle.auth_atom_id_2 _pdbx_validate_rmsd_angle.auth_asym_id_2 _pdbx_validate_rmsd_angle.auth_comp_id_2 _pdbx_validate_rmsd_angle.auth_seq_id_2 _pdbx_validate_rmsd_angle.PDB_ins_code_2 _pdbx_validate_rmsd_angle.label_alt_id_2 _pdbx_validate_rmsd_angle.auth_atom_id_3 _pdbx_validate_rmsd_angle.auth_asym_id_3 _pdbx_validate_rmsd_angle.auth_comp_id_3 _pdbx_validate_rmsd_angle.auth_seq_id_3 _pdbx_validate_rmsd_angle.PDB_ins_code_3 _pdbx_validate_rmsd_angle.label_alt_id_3 _pdbx_validate_rmsd_angle.angle_value _pdbx_validate_rmsd_angle.angle_target_value _pdbx_validate_rmsd_angle.angle_deviation _pdbx_validate_rmsd_angle.angle_standard_deviation _pdbx_validate_rmsd_angle.linker_flag 1 1 CB A GLN 62 ? ? CA A GLN 62 ? ? C A GLN 62 ? ? 126.49 110.40 16.09 2.00 N 2 1 N A GLN 62 ? ? CA A GLN 62 ? ? CB A GLN 62 ? ? 121.75 110.60 11.15 1.80 N 3 1 N A GLU 105 ? ? CA A GLU 105 ? ? CB A GLU 105 ? ? 121.83 110.60 11.23 1.80 N 4 1 CB A GLU 184 ? ? CA A GLU 184 ? ? C A GLU 184 ? ? 133.92 110.40 23.52 2.00 N 5 1 CA A GLU 184 ? ? CB A GLU 184 ? ? CG A GLU 184 ? ? 127.85 113.40 14.45 2.20 N 6 1 CB A ASP 252 ? ? CG A ASP 252 ? ? OD2 A ASP 252 ? ? 124.71 118.30 6.41 0.90 N 7 1 N A GLU 257 ? ? CA A GLU 257 ? ? CB A GLU 257 ? ? 130.24 110.60 19.64 1.80 N 8 1 CB B LYS 3 ? ? CA B LYS 3 ? ? C B LYS 3 ? ? 123.92 110.40 13.52 2.00 N 9 1 CB B ASP 96 ? ? CG B ASP 96 ? ? OD2 B ASP 96 ? ? 123.96 118.30 5.66 0.90 N 10 1 CB C ASP 43 ? ? CG C ASP 43 ? ? OD2 C ASP 43 ? ? 124.08 118.30 5.78 0.90 N 11 1 N C GLN 62 ? ? CA C GLN 62 ? ? CB C GLN 62 ? ? 131.69 110.60 21.09 1.80 N 12 1 N C ARG 79 ? ? CA C ARG 79 ? ? CB C ARG 79 ? ? 131.67 110.60 21.07 1.80 N 13 1 CB C ASP 153 ? ? CG C ASP 153 ? ? OD2 C ASP 153 ? ? 124.03 118.30 5.73 0.90 N 14 1 CB C GLU 257 ? ? CA C GLU 257 ? ? C C GLU 257 ? ? 128.96 110.40 18.56 2.00 N 15 1 N D LYS 3 ? ? CA D LYS 3 ? ? CB D LYS 3 ? ? 92.33 110.60 -18.27 1.80 N 16 1 N D LYS 48 ? ? CA D LYS 48 ? ? CB D LYS 48 ? ? 123.51 110.60 12.91 1.80 N 17 1 CB D ASP 96 ? ? CG D ASP 96 ? ? OD2 D ASP 96 ? ? 123.73 118.30 5.43 0.90 N # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 SER A 89 ? ? -57.01 -171.53 2 1 PRO A 90 ? ? 3.75 -82.37 3 1 GLU A 92 ? ? -50.12 78.05 4 1 TYR A 94 ? ? -90.07 -149.27 5 1 PRO A 95 ? ? -0.20 118.49 6 1 ASP A 166 ? ? -124.04 -52.54 7 1 LYS B 48 ? ? -95.19 51.80 8 1 TRP B 60 ? ? 81.93 -2.03 9 1 ARG B 97 ? ? -22.83 11.44 10 1 SER C 89 ? ? -61.38 -162.63 11 1 PRO C 90 ? ? -4.00 -91.22 12 1 TYR C 94 ? ? -79.82 -139.89 13 1 PRO C 95 ? ? 0.44 124.41 14 1 ASP C 166 ? ? -128.67 -54.49 15 1 ASP C 242 ? ? -97.88 30.25 16 1 HIS D 31 ? ? -172.70 132.78 17 1 PRO D 33 ? ? -66.36 2.28 18 1 TRP D 60 ? ? 78.09 -5.34 19 1 ALA D 88 ? ? -55.77 -70.66 20 1 ARG D 97 ? ? -36.91 28.34 # loop_ _pdbx_validate_peptide_omega.id _pdbx_validate_peptide_omega.PDB_model_num _pdbx_validate_peptide_omega.auth_comp_id_1 _pdbx_validate_peptide_omega.auth_asym_id_1 _pdbx_validate_peptide_omega.auth_seq_id_1 _pdbx_validate_peptide_omega.PDB_ins_code_1 _pdbx_validate_peptide_omega.label_alt_id_1 _pdbx_validate_peptide_omega.auth_comp_id_2 _pdbx_validate_peptide_omega.auth_asym_id_2 _pdbx_validate_peptide_omega.auth_seq_id_2 _pdbx_validate_peptide_omega.PDB_ins_code_2 _pdbx_validate_peptide_omega.label_alt_id_2 _pdbx_validate_peptide_omega.omega 1 1 TYR A 94 ? ? PRO A 95 ? ? -131.69 2 1 TYR C 94 ? ? PRO C 95 ? ? -132.14 # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 0 A ARG 21 ? CG ? A ARG 21 CG 2 1 Y 0 A ARG 21 ? CD ? A ARG 21 CD 3 1 Y 0 A ARG 21 ? NE ? A ARG 21 NE 4 1 Y 0 A ARG 21 ? CZ ? A ARG 21 CZ 5 1 Y 0 A ARG 21 ? NH1 ? A ARG 21 NH1 6 1 Y 0 A ARG 21 ? NH2 ? A ARG 21 NH2 7 1 Y 0 A GLN 62 ? CB ? A GLN 62 CB 8 1 Y 0 A GLN 62 ? CG ? A GLN 62 CG 9 1 Y 0 A GLN 62 ? CD ? A GLN 62 CD 10 1 Y 0 A GLN 62 ? OE1 ? A GLN 62 OE1 11 1 Y 0 A GLN 62 ? NE2 ? A GLN 62 NE2 12 1 Y 0 A GLU 105 ? CB ? A GLU 105 CB 13 1 Y 0 A GLU 105 ? CG ? A GLU 105 CG 14 1 Y 0 A GLU 105 ? CD ? A GLU 105 CD 15 1 Y 0 A GLU 105 ? OE1 ? A GLU 105 OE1 16 1 Y 0 A GLU 105 ? OE2 ? A GLU 105 OE2 17 1 Y 0 A GLU 113 ? CB ? A GLU 113 CB 18 1 Y 0 A GLU 113 ? CG ? A GLU 113 CG 19 1 Y 0 A GLU 113 ? CD ? A GLU 113 CD 20 1 Y 0 A GLU 113 ? OE1 ? A GLU 113 OE1 21 1 Y 0 A GLU 113 ? OE2 ? A GLU 113 OE2 22 1 Y 0 A LYS 180 ? CB ? A LYS 180 CB 23 1 Y 0 A LYS 180 ? CG ? A LYS 180 CG 24 1 Y 0 A LYS 180 ? CD ? A LYS 180 CD 25 1 Y 0 A LYS 180 ? CE ? A LYS 180 CE 26 1 Y 0 A LYS 180 ? NZ ? A LYS 180 NZ 27 1 Y 0 A GLU 184 ? CB ? A GLU 184 CB 28 1 Y 0 A GLU 184 ? CG ? A GLU 184 CG 29 1 Y 0 A GLU 184 ? CD ? A GLU 184 CD 30 1 Y 0 A GLU 184 ? OE1 ? A GLU 184 OE1 31 1 Y 0 A GLU 184 ? OE2 ? A GLU 184 OE2 32 1 Y 0 A GLU 254 ? CB ? A GLU 254 CB 33 1 Y 0 A GLU 254 ? CG ? A GLU 254 CG 34 1 Y 0 A GLU 254 ? CD ? A GLU 254 CD 35 1 Y 0 A GLU 254 ? OE1 ? A GLU 254 OE1 36 1 Y 0 A GLU 254 ? OE2 ? A GLU 254 OE2 37 1 Y 0 A ALA 255 ? CB ? A ALA 255 CB 38 1 Y 0 A GLU 257 ? CB ? A GLU 257 CB 39 1 Y 0 A GLU 257 ? CG ? A GLU 257 CG 40 1 Y 0 A GLU 257 ? CD ? A GLU 257 CD 41 1 Y 0 A GLU 257 ? OE1 ? A GLU 257 OE1 42 1 Y 0 A GLU 257 ? OE2 ? A GLU 257 OE2 43 1 Y 0 B LYS 3 ? CB ? B LYS 3 CB 44 1 Y 0 B LYS 3 ? CG ? B LYS 3 CG 45 1 Y 0 B LYS 3 ? CD ? B LYS 3 CD 46 1 Y 0 B LYS 3 ? CE ? B LYS 3 CE 47 1 Y 0 B LYS 3 ? NZ ? B LYS 3 NZ 48 1 Y 0 B GLU 16 ? CB ? B GLU 16 CB 49 1 Y 0 B GLU 16 ? CG ? B GLU 16 CG 50 1 Y 0 B GLU 16 ? CD ? B GLU 16 CD 51 1 Y 0 B GLU 16 ? OE1 ? B GLU 16 OE1 52 1 Y 0 B GLU 16 ? OE2 ? B GLU 16 OE2 53 1 Y 0 B LYS 19 ? CB ? B LYS 19 CB 54 1 Y 0 B LYS 19 ? CG ? B LYS 19 CG 55 1 Y 0 B LYS 19 ? CD ? B LYS 19 CD 56 1 Y 0 B LYS 19 ? CE ? B LYS 19 CE 57 1 Y 0 B LYS 19 ? NZ ? B LYS 19 NZ 58 1 Y 0 B LYS 58 ? CB ? B LYS 58 CB 59 1 Y 0 B LYS 58 ? CG ? B LYS 58 CG 60 1 Y 0 B LYS 58 ? CD ? B LYS 58 CD 61 1 Y 0 B LYS 58 ? CE ? B LYS 58 CE 62 1 Y 0 B LYS 58 ? NZ ? B LYS 58 NZ 63 1 Y 0 B LYS 83 ? CB ? B LYS 83 CB 64 1 Y 0 B LYS 83 ? CG ? B LYS 83 CG 65 1 Y 0 B LYS 83 ? CD ? B LYS 83 CD 66 1 Y 0 B LYS 83 ? CE ? B LYS 83 CE 67 1 Y 0 B LYS 83 ? NZ ? B LYS 83 NZ 68 1 Y 0 B GLU 89 ? CB ? B GLU 89 CB 69 1 Y 0 B GLU 89 ? CG ? B GLU 89 CG 70 1 Y 0 B GLU 89 ? CD ? B GLU 89 CD 71 1 Y 0 B GLU 89 ? OE1 ? B GLU 89 OE1 72 1 Y 0 B GLU 89 ? OE2 ? B GLU 89 OE2 73 1 Y 0 B ARG 97 ? CB ? B ARG 97 CB 74 1 Y 0 B ARG 97 ? CG ? B ARG 97 CG 75 1 Y 0 B ARG 97 ? CD ? B ARG 97 CD 76 1 Y 0 B ARG 97 ? NE ? B ARG 97 NE 77 1 Y 0 B ARG 97 ? CZ ? B ARG 97 CZ 78 1 Y 0 B ARG 97 ? NH1 ? B ARG 97 NH1 79 1 Y 0 B ARG 97 ? NH2 ? B ARG 97 NH2 80 1 Y 0 C ARG 21 ? CB ? C ARG 21 CB 81 1 Y 0 C ARG 21 ? CG ? C ARG 21 CG 82 1 Y 0 C ARG 21 ? CD ? C ARG 21 CD 83 1 Y 0 C ARG 21 ? NE ? C ARG 21 NE 84 1 Y 0 C ARG 21 ? CZ ? C ARG 21 CZ 85 1 Y 0 C ARG 21 ? NH1 ? C ARG 21 NH1 86 1 Y 0 C ARG 21 ? NH2 ? C ARG 21 NH2 87 1 Y 0 C GLN 61 ? CB ? C GLN 61 CB 88 1 Y 0 C GLN 61 ? CG ? C GLN 61 CG 89 1 Y 0 C GLN 61 ? CD ? C GLN 61 CD 90 1 Y 0 C GLN 61 ? OE1 ? C GLN 61 OE1 91 1 Y 0 C GLN 61 ? NE2 ? C GLN 61 NE2 92 1 Y 0 C GLN 62 ? CB ? C GLN 62 CB 93 1 Y 0 C GLN 62 ? CG ? C GLN 62 CG 94 1 Y 0 C GLN 62 ? CD ? C GLN 62 CD 95 1 Y 0 C GLN 62 ? OE1 ? C GLN 62 OE1 96 1 Y 0 C GLN 62 ? NE2 ? C GLN 62 NE2 97 1 Y 0 C ARG 79 ? CB ? C ARG 79 CB 98 1 Y 0 C ARG 79 ? CG ? C ARG 79 CG 99 1 Y 0 C ARG 79 ? CD ? C ARG 79 CD 100 1 Y 0 C ARG 79 ? NE ? C ARG 79 NE 101 1 Y 0 C ARG 79 ? CZ ? C ARG 79 CZ 102 1 Y 0 C ARG 79 ? NH1 ? C ARG 79 NH1 103 1 Y 0 C ARG 79 ? NH2 ? C ARG 79 NH2 104 1 Y 0 C LYS 91 ? CB ? C LYS 91 CB 105 1 Y 0 C LYS 91 ? CG ? C LYS 91 CG 106 1 Y 0 C LYS 91 ? CD ? C LYS 91 CD 107 1 Y 0 C LYS 91 ? CE ? C LYS 91 CE 108 1 Y 0 C LYS 91 ? NZ ? C LYS 91 NZ 109 1 Y 0 C GLU 105 ? CB ? C GLU 105 CB 110 1 Y 0 C GLU 105 ? CG ? C GLU 105 CG 111 1 Y 0 C GLU 105 ? CD ? C GLU 105 CD 112 1 Y 0 C GLU 105 ? OE1 ? C GLU 105 OE1 113 1 Y 0 C GLU 105 ? OE2 ? C GLU 105 OE2 114 1 Y 0 C GLU 113 ? CB ? C GLU 113 CB 115 1 Y 0 C GLU 113 ? CG ? C GLU 113 CG 116 1 Y 0 C GLU 113 ? CD ? C GLU 113 CD 117 1 Y 0 C GLU 113 ? OE1 ? C GLU 113 OE1 118 1 Y 0 C GLU 113 ? OE2 ? C GLU 113 OE2 119 1 Y 0 C ARG 173 ? CB ? C ARG 173 CB 120 1 Y 0 C ARG 173 ? CG ? C ARG 173 CG 121 1 Y 0 C ARG 173 ? CD ? C ARG 173 CD 122 1 Y 0 C ARG 173 ? NE ? C ARG 173 NE 123 1 Y 0 C ARG 173 ? CZ ? C ARG 173 CZ 124 1 Y 0 C ARG 173 ? NH1 ? C ARG 173 NH1 125 1 Y 0 C ARG 173 ? NH2 ? C ARG 173 NH2 126 1 Y 0 C LYS 188 ? CB ? C LYS 188 CB 127 1 Y 0 C LYS 188 ? CG ? C LYS 188 CG 128 1 Y 0 C LYS 188 ? CD ? C LYS 188 CD 129 1 Y 0 C LYS 188 ? CE ? C LYS 188 CE 130 1 Y 0 C LYS 188 ? NZ ? C LYS 188 NZ 131 1 Y 0 C GLU 243 ? CB ? C GLU 243 CB 132 1 Y 0 C GLU 243 ? CG ? C GLU 243 CG 133 1 Y 0 C GLU 243 ? CD ? C GLU 243 CD 134 1 Y 0 C GLU 243 ? OE1 ? C GLU 243 OE1 135 1 Y 0 C GLU 243 ? OE2 ? C GLU 243 OE2 136 1 Y 0 C GLU 257 ? CB ? C GLU 257 CB 137 1 Y 0 C GLU 257 ? CG ? C GLU 257 CG 138 1 Y 0 C GLU 257 ? CD ? C GLU 257 CD 139 1 Y 0 C GLU 257 ? OE1 ? C GLU 257 OE1 140 1 Y 0 C GLU 257 ? OE2 ? C GLU 257 OE2 141 1 Y 0 C GLN 273 ? CB ? C GLN 273 CB 142 1 Y 0 C GLN 273 ? CG ? C GLN 273 CG 143 1 Y 0 C GLN 273 ? CD ? C GLN 273 CD 144 1 Y 0 C GLN 273 ? OE1 ? C GLN 273 OE1 145 1 Y 0 C GLN 273 ? NE2 ? C GLN 273 NE2 146 1 Y 0 D LYS 3 ? CB ? D LYS 3 CB 147 1 Y 0 D LYS 3 ? CG ? D LYS 3 CG 148 1 Y 0 D LYS 3 ? CD ? D LYS 3 CD 149 1 Y 0 D LYS 3 ? CE ? D LYS 3 CE 150 1 Y 0 D LYS 3 ? NZ ? D LYS 3 NZ 151 1 Y 0 D GLU 16 ? CB ? D GLU 16 CB 152 1 Y 0 D GLU 16 ? CG ? D GLU 16 CG 153 1 Y 0 D GLU 16 ? CD ? D GLU 16 CD 154 1 Y 0 D GLU 16 ? OE1 ? D GLU 16 OE1 155 1 Y 0 D GLU 16 ? OE2 ? D GLU 16 OE2 156 1 Y 0 D LYS 19 ? CB ? D LYS 19 CB 157 1 Y 0 D LYS 19 ? CG ? D LYS 19 CG 158 1 Y 0 D LYS 19 ? CD ? D LYS 19 CD 159 1 Y 0 D LYS 19 ? CE ? D LYS 19 CE 160 1 Y 0 D LYS 19 ? NZ ? D LYS 19 NZ 161 1 Y 0 D LYS 48 ? CB ? D LYS 48 CB 162 1 Y 0 D LYS 48 ? CG ? D LYS 48 CG 163 1 Y 0 D LYS 48 ? CD ? D LYS 48 CD 164 1 Y 0 D LYS 48 ? CE ? D LYS 48 CE 165 1 Y 0 D LYS 48 ? NZ ? D LYS 48 NZ 166 1 Y 0 D LYS 58 ? CB ? D LYS 58 CB 167 1 Y 0 D LYS 58 ? CG ? D LYS 58 CG 168 1 Y 0 D LYS 58 ? CD ? D LYS 58 CD 169 1 Y 0 D LYS 58 ? CE ? D LYS 58 CE 170 1 Y 0 D LYS 58 ? NZ ? D LYS 58 NZ 171 1 Y 0 D GLU 89 ? CB ? D GLU 89 CB 172 1 Y 0 D GLU 89 ? CG ? D GLU 89 CG 173 1 Y 0 D GLU 89 ? CD ? D GLU 89 CD 174 1 Y 0 D GLU 89 ? OE1 ? D GLU 89 OE1 175 1 Y 0 D GLU 89 ? OE2 ? D GLU 89 OE2 176 1 Y 0 D ARG 97 ? CB ? D ARG 97 CB 177 1 Y 0 D ARG 97 ? CG ? D ARG 97 CG 178 1 Y 0 D ARG 97 ? CD ? D ARG 97 CD 179 1 Y 0 D ARG 97 ? NE ? D ARG 97 NE 180 1 Y 0 D ARG 97 ? CZ ? D ARG 97 CZ 181 1 Y 0 D ARG 97 ? NH1 ? D ARG 97 NH1 182 1 Y 0 D ARG 97 ? NH2 ? D ARG 97 NH2 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A SER 1 ? A SER 1 2 1 Y 1 A GLU 2 ? A GLU 2 3 1 Y 1 A ALA 3 ? A ALA 3 4 1 Y 1 A GLN 4 ? A GLN 4 5 1 Y 1 A GLN 5 ? A GLN 5 6 1 Y 1 A LYS 6 ? A LYS 6 7 1 Y 1 A ASN 7 ? A ASN 7 8 1 Y 1 A GLY 109 ? A GLY 109 9 1 Y 1 A ASN 110 ? A ASN 110 10 1 Y 1 A ALA 111 ? A ALA 111 11 1 Y 1 A SER 198 ? A SER 198 12 1 Y 1 A SER 199 ? A SER 199 13 1 Y 1 A ALA 200 ? A ALA 200 14 1 Y 1 A HIS 201 ? A HIS 201 15 1 Y 1 A HIS 280 ? A HIS 280 16 1 Y 1 A HIS 281 ? A HIS 281 17 1 Y 1 A HIS 282 ? A HIS 282 18 1 Y 1 A HIS 283 ? A HIS 283 19 1 Y 1 A HIS 284 ? A HIS 284 20 1 Y 1 A HIS 285 ? A HIS 285 21 1 Y 1 B ILE 1 ? B ILE 1 22 1 Y 1 C SER 1 ? C SER 1 23 1 Y 1 C GLU 2 ? C GLU 2 24 1 Y 1 C ALA 3 ? C ALA 3 25 1 Y 1 C GLN 4 ? C GLN 4 26 1 Y 1 C GLN 5 ? C GLN 5 27 1 Y 1 C LYS 6 ? C LYS 6 28 1 Y 1 C PRO 108 ? C PRO 108 29 1 Y 1 C GLY 109 ? C GLY 109 30 1 Y 1 C ASN 110 ? C ASN 110 31 1 Y 1 C ALA 111 ? C ALA 111 32 1 Y 1 C SER 198 ? C SER 198 33 1 Y 1 C SER 199 ? C SER 199 34 1 Y 1 C ALA 200 ? C ALA 200 35 1 Y 1 C HIS 280 ? C HIS 280 36 1 Y 1 C HIS 281 ? C HIS 281 37 1 Y 1 C HIS 282 ? C HIS 282 38 1 Y 1 C HIS 283 ? C HIS 283 39 1 Y 1 C HIS 284 ? C HIS 284 40 1 Y 1 C HIS 285 ? C HIS 285 41 1 Y 1 D ILE 1 ? D ILE 1 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 N-ACETYL-D-GLUCOSAMINE NAG 4 '(2S,3S,4R)-N-OCTANOYL-1-[(ALPHA-D-GALACTOPYRANOSYL)OXY]-2-AMINO-OCTADECANE-3,4-DIOL' PBS 5 HEXADECANE R16 6 water HOH #