data_3SDC # _entry.id 3SDC # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3SDC RCSB RCSB066065 WWPDB D_1000066065 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 3SCM . unspecified PDB 3SDA . unspecified PDB 3SDD . unspecified PDB 3SDX . unspecified # _pdbx_database_status.entry_id 3SDC _pdbx_database_status.status_code REL _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site PDBJ _pdbx_database_status.recvd_initial_deposition_date 2011-06-09 _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Clarke, A.J.' 1 'Rossjohn, J.' 2 # _citation.id primary _citation.title 'Recognition of beta-linked self glycolipids mediated by natural killer T cell antigen receptors' _citation.journal_abbrev Nat.Immunol. _citation.journal_volume 12 _citation.page_first 827 _citation.page_last 833 _citation.year 2011 _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 21804559 _citation.pdbx_database_id_DOI 10.1038/ni.2076 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Pellicci, D.G.' 1 primary 'Clarke, A.J.' 2 primary 'Patel, O.' 3 primary 'Mallevaey, T.' 4 primary 'Beddoe, T.' 5 primary 'Le Nours, J.' 6 primary 'Uldrich, A.P.' 7 primary 'McCluskey, J.' 8 primary 'Besra, G.S.' 9 primary 'Porcelli, S.A.' 10 primary 'Gapin, L.' 11 primary 'Godfrey, D.I.' 12 primary 'Rossjohn, J.' 13 # _cell.length_a 94.350 _cell.length_b 94.350 _cell.length_c 287.860 _cell.angle_alpha 90.000 _cell.angle_beta 90.000 _cell.angle_gamma 90.000 _cell.entry_id 3SDC _cell.pdbx_unique_axis ? _cell.Z_PDB 8 _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.space_group_name_H-M 'P 41 21 2' _symmetry.entry_id 3SDC _symmetry.Int_Tables_number 92 _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _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 'Antigen-presenting glycoprotein CD1d1' 34662.012 1 ? ? 'extracellular domain, UNP residues 19-297' ? 2 polymer man Beta-2-microglobulin 11660.350 1 ? ? 'extracellular domain, UNP residues 21-119' ? 3 polymer man 'NKT TCR Valpha14 chain' 22779.180 1 ? ? ? 'chimera of Mouse variable domain and human constant domain' 4 polymer man 'NKT TCR autoreactive-Vbeta6 chain' 27635.912 1 ? ? ? 'chimera of Mouse variable domain and human constant domain' 5 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 4 ? ? ? ? 6 non-polymer syn ;N-[(2S,3R,4E)-1-{[alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]hexacosanamide ; 1164.588 1 ? ? ? ? 7 water nat water 18.015 37 ? ? ? ? # 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 ADETWYLQATLDVEAGEEAGLACRVKHSSLGGQDIILYWGSLHHILDAQKMVWNHRHHHHHH ; ;SEAQQKNYTFRCLQMSSFANRSWSRTDSVVWLGDLQTHRWSNDSATISFTKPWSQGKLSNQQWEKLQHMFQVYRVSFTRD IQELVKMMSPKEDYPIEIQLSAGCEMYPGNASESFLHVAFQGKYVVRFWGTSWQTVPGAPSWLDLPIKVLNADQGTSATV QMLLNDTCPLFVRGLLEAGKSDLEKQEKPVAWLSSVPSSAHGHRQLVCHVSGFYPKPVWVMWMRGDQEQQGTHRGDFLPN ADETWYLQATLDVEAGEEAGLACRVKHSSLGGQDIILYWGSLHHILDAQKMVWNHRHHHHHH ; A ? 2 'polypeptide(L)' no no ;IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDWSFYILAHTEFTPTETDTYAC RVKHASMAEPKTVYWDRDM ; ;IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDWSFYILAHTEFTPTETDTYAC RVKHASMAEPKTVYWDRDM ; B ? 3 'polypeptide(L)' no no ;TQVEQSPQSLVVRQGENSVLQCNYSVTPDNHLRWFKQDTGKGLVSLTVLVDQKDKTSNGRYSATLDKDAKHSTLHITATL LDDTATYICVVGDRGSALGRLHFGAGTQLIVIPDIQNPDPAVYQLRDSKSSDKSVCLFTDFDSQTNVSQSKDSDVYITDK CVLDMRSMDFKSNSAVAWSNKSDFACANAFNNSIIPEDTFFPSPESS ; ;TQVEQSPQSLVVRQGENSVLQCNYSVTPDNHLRWFKQDTGKGLVSLTVLVDQKDKTSNGRYSATLDKDAKHSTLHITATL LDDTATYICVVGDRGSALGRLHFGAGTQLIVIPDIQNPDPAVYQLRDSKSSDKSVCLFTDFDSQTNVSQSKDSDVYITDK CVLDMRSMDFKSNSAVAWSNKSDFACANAFNNSIIPEDTFFPSPESS ; C ? 4 'polypeptide(L)' no no ;HMGGIITQTPKFLIGQEGQKLTLKCQQNFNHDTMYWYRQDSGKGLRLIYYSYGAGSTEKGDLSEGYDASREKKSSFSLTV TSAQKNEMAVFLCASGSLLDVREVFFGKGTRLTVVEDLKNVFPPEVAVFEPSEAEISHTQKATLVCLATGFYPDHVELSW WVNGKEVHSGVCTDPQPLKEQPALNDSRYALSSRLRVSATFWQNPRNHFRCQVQFYGLSENDEWTQDRAKPVTQIVSAEA WGRAD ; ;HMGGIITQTPKFLIGQEGQKLTLKCQQNFNHDTMYWYRQDSGKGLRLIYYSYGAGSTEKGDLSEGYDASREKKSSFSLTV TSAQKNEMAVFLCASGSLLDVREVFFGKGTRLTVVEDLKNVFPPEVAVFEPSEAEISHTQKATLVCLATGFYPDHVELSW WVNGKEVHSGVCTDPQPLKEQPALNDSRYALSSRLRVSATFWQNPRNHFRCQVQFYGLSENDEWTQDRAKPVTQIVSAEA WGRAD ; 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 GLY n 1 281 SER n 1 282 LEU n 1 283 HIS n 1 284 HIS n 1 285 ILE n 1 286 LEU n 1 287 ASP n 1 288 ALA n 1 289 GLN n 1 290 LYS n 1 291 MET n 1 292 VAL n 1 293 TRP n 1 294 ASN n 1 295 HIS n 1 296 ARG n 1 297 HIS n 1 298 HIS n 1 299 HIS n 1 300 HIS n 1 301 HIS n 1 302 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 3 1 THR n 3 2 GLN n 3 3 VAL n 3 4 GLU n 3 5 GLN n 3 6 SER n 3 7 PRO n 3 8 GLN n 3 9 SER n 3 10 LEU n 3 11 VAL n 3 12 VAL n 3 13 ARG n 3 14 GLN n 3 15 GLY n 3 16 GLU n 3 17 ASN n 3 18 SER n 3 19 VAL n 3 20 LEU n 3 21 GLN n 3 22 CYS n 3 23 ASN n 3 24 TYR n 3 25 SER n 3 26 VAL n 3 27 THR n 3 28 PRO n 3 29 ASP n 3 30 ASN n 3 31 HIS n 3 32 LEU n 3 33 ARG n 3 34 TRP n 3 35 PHE n 3 36 LYS n 3 37 GLN n 3 38 ASP n 3 39 THR n 3 40 GLY n 3 41 LYS n 3 42 GLY n 3 43 LEU n 3 44 VAL n 3 45 SER n 3 46 LEU n 3 47 THR n 3 48 VAL n 3 49 LEU n 3 50 VAL n 3 51 ASP n 3 52 GLN n 3 53 LYS n 3 54 ASP n 3 55 LYS n 3 56 THR n 3 57 SER n 3 58 ASN n 3 59 GLY n 3 60 ARG n 3 61 TYR n 3 62 SER n 3 63 ALA n 3 64 THR n 3 65 LEU n 3 66 ASP n 3 67 LYS n 3 68 ASP n 3 69 ALA n 3 70 LYS n 3 71 HIS n 3 72 SER n 3 73 THR n 3 74 LEU n 3 75 HIS n 3 76 ILE n 3 77 THR n 3 78 ALA n 3 79 THR n 3 80 LEU n 3 81 LEU n 3 82 ASP n 3 83 ASP n 3 84 THR n 3 85 ALA n 3 86 THR n 3 87 TYR n 3 88 ILE n 3 89 CYS n 3 90 VAL n 3 91 VAL n 3 92 GLY n 3 93 ASP n 3 94 ARG n 3 95 GLY n 3 96 SER n 3 97 ALA n 3 98 LEU n 3 99 GLY n 3 100 ARG n 3 101 LEU n 3 102 HIS n 3 103 PHE n 3 104 GLY n 3 105 ALA n 3 106 GLY n 3 107 THR n 3 108 GLN n 3 109 LEU n 3 110 ILE n 3 111 VAL n 3 112 ILE n 3 113 PRO n 3 114 ASP n 3 115 ILE n 3 116 GLN n 3 117 ASN n 3 118 PRO n 3 119 ASP n 3 120 PRO n 3 121 ALA n 3 122 VAL n 3 123 TYR n 3 124 GLN n 3 125 LEU n 3 126 ARG n 3 127 ASP n 3 128 SER n 3 129 LYS n 3 130 SER n 3 131 SER n 3 132 ASP n 3 133 LYS n 3 134 SER n 3 135 VAL n 3 136 CYS n 3 137 LEU n 3 138 PHE n 3 139 THR n 3 140 ASP n 3 141 PHE n 3 142 ASP n 3 143 SER n 3 144 GLN n 3 145 THR n 3 146 ASN n 3 147 VAL n 3 148 SER n 3 149 GLN n 3 150 SER n 3 151 LYS n 3 152 ASP n 3 153 SER n 3 154 ASP n 3 155 VAL n 3 156 TYR n 3 157 ILE n 3 158 THR n 3 159 ASP n 3 160 LYS n 3 161 CYS n 3 162 VAL n 3 163 LEU n 3 164 ASP n 3 165 MET n 3 166 ARG n 3 167 SER n 3 168 MET n 3 169 ASP n 3 170 PHE n 3 171 LYS n 3 172 SER n 3 173 ASN n 3 174 SER n 3 175 ALA n 3 176 VAL n 3 177 ALA n 3 178 TRP n 3 179 SER n 3 180 ASN n 3 181 LYS n 3 182 SER n 3 183 ASP n 3 184 PHE n 3 185 ALA n 3 186 CYS n 3 187 ALA n 3 188 ASN n 3 189 ALA n 3 190 PHE n 3 191 ASN n 3 192 ASN n 3 193 SER n 3 194 ILE n 3 195 ILE n 3 196 PRO n 3 197 GLU n 3 198 ASP n 3 199 THR n 3 200 PHE n 3 201 PHE n 3 202 PRO n 3 203 SER n 3 204 PRO n 3 205 GLU n 3 206 SER n 3 207 SER n 4 1 HIS n 4 2 MET n 4 3 GLY n 4 4 GLY n 4 5 ILE n 4 6 ILE n 4 7 THR n 4 8 GLN n 4 9 THR n 4 10 PRO n 4 11 LYS n 4 12 PHE n 4 13 LEU n 4 14 ILE n 4 15 GLY n 4 16 GLN n 4 17 GLU n 4 18 GLY n 4 19 GLN n 4 20 LYS n 4 21 LEU n 4 22 THR n 4 23 LEU n 4 24 LYS n 4 25 CYS n 4 26 GLN n 4 27 GLN n 4 28 ASN n 4 29 PHE n 4 30 ASN n 4 31 HIS n 4 32 ASP n 4 33 THR n 4 34 MET n 4 35 TYR n 4 36 TRP n 4 37 TYR n 4 38 ARG n 4 39 GLN n 4 40 ASP n 4 41 SER n 4 42 GLY n 4 43 LYS n 4 44 GLY n 4 45 LEU n 4 46 ARG n 4 47 LEU n 4 48 ILE n 4 49 TYR n 4 50 TYR n 4 51 SER n 4 52 TYR n 4 53 GLY n 4 54 ALA n 4 55 GLY n 4 56 SER n 4 57 THR n 4 58 GLU n 4 59 LYS n 4 60 GLY n 4 61 ASP n 4 62 LEU n 4 63 SER n 4 64 GLU n 4 65 GLY n 4 66 TYR n 4 67 ASP n 4 68 ALA n 4 69 SER n 4 70 ARG n 4 71 GLU n 4 72 LYS n 4 73 LYS n 4 74 SER n 4 75 SER n 4 76 PHE n 4 77 SER n 4 78 LEU n 4 79 THR n 4 80 VAL n 4 81 THR n 4 82 SER n 4 83 ALA n 4 84 GLN n 4 85 LYS n 4 86 ASN n 4 87 GLU n 4 88 MET n 4 89 ALA n 4 90 VAL n 4 91 PHE n 4 92 LEU n 4 93 CYS n 4 94 ALA n 4 95 SER n 4 96 GLY n 4 97 SER n 4 98 LEU n 4 99 LEU n 4 100 ASP n 4 101 VAL n 4 102 ARG n 4 103 GLU n 4 104 VAL n 4 105 PHE n 4 106 PHE n 4 107 GLY n 4 108 LYS n 4 109 GLY n 4 110 THR n 4 111 ARG n 4 112 LEU n 4 113 THR n 4 114 VAL n 4 115 VAL n 4 116 GLU n 4 117 ASP n 4 118 LEU n 4 119 LYS n 4 120 ASN n 4 121 VAL n 4 122 PHE n 4 123 PRO n 4 124 PRO n 4 125 GLU n 4 126 VAL n 4 127 ALA n 4 128 VAL n 4 129 PHE n 4 130 GLU n 4 131 PRO n 4 132 SER n 4 133 GLU n 4 134 ALA n 4 135 GLU n 4 136 ILE n 4 137 SER n 4 138 HIS n 4 139 THR n 4 140 GLN n 4 141 LYS n 4 142 ALA n 4 143 THR n 4 144 LEU n 4 145 VAL n 4 146 CYS n 4 147 LEU n 4 148 ALA n 4 149 THR n 4 150 GLY n 4 151 PHE n 4 152 TYR n 4 153 PRO n 4 154 ASP n 4 155 HIS n 4 156 VAL n 4 157 GLU n 4 158 LEU n 4 159 SER n 4 160 TRP n 4 161 TRP n 4 162 VAL n 4 163 ASN n 4 164 GLY n 4 165 LYS n 4 166 GLU n 4 167 VAL n 4 168 HIS n 4 169 SER n 4 170 GLY n 4 171 VAL n 4 172 CYS n 4 173 THR n 4 174 ASP n 4 175 PRO n 4 176 GLN n 4 177 PRO n 4 178 LEU n 4 179 LYS n 4 180 GLU n 4 181 GLN n 4 182 PRO n 4 183 ALA n 4 184 LEU n 4 185 ASN n 4 186 ASP n 4 187 SER n 4 188 ARG n 4 189 TYR n 4 190 ALA n 4 191 LEU n 4 192 SER n 4 193 SER n 4 194 ARG n 4 195 LEU n 4 196 ARG n 4 197 VAL n 4 198 SER n 4 199 ALA n 4 200 THR n 4 201 PHE n 4 202 TRP n 4 203 GLN n 4 204 ASN n 4 205 PRO n 4 206 ARG n 4 207 ASN n 4 208 HIS n 4 209 PHE n 4 210 ARG n 4 211 CYS n 4 212 GLN n 4 213 VAL n 4 214 GLN n 4 215 PHE n 4 216 TYR n 4 217 GLY n 4 218 LEU n 4 219 SER n 4 220 GLU n 4 221 ASN n 4 222 ASP n 4 223 GLU n 4 224 TRP n 4 225 THR n 4 226 GLN n 4 227 ASP n 4 228 ARG n 4 229 ALA n 4 230 LYS n 4 231 PRO n 4 232 VAL n 4 233 THR n 4 234 GLN n 4 235 ILE n 4 236 VAL n 4 237 SER n 4 238 ALA n 4 239 GLU n 4 240 ALA n 4 241 TRP n 4 242 GLY n 4 243 ARG n 4 244 ALA n 4 245 ASP 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 ? ? ? mouse ? 'Cd1.1, Cd1d1' ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? ? 'Trichoplusia ni' 7111 ? ? ? ? ? ? ? ? Hi5 ? ? ? ? ? baculovirus ? ? ? 'pFastBac dual' ? ? 2 1 sample ? ? ? mouse ? B2m ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? ? 'Trichoplusia ni' 7111 ? ? ? ? ? ? ? ? Hi5 ? ? ? ? ? baculovirus ? ? ? 'pFastBac dual' ? ? 3 1 sample ? ? ? 'mouse, human' ? ? ? ? ? ? ? ? 'Mus musculus , Homo sapiens' '10090, 9606' ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? ? ? ? ? ? RIL ? ? ? ? ? ? ? plasmid ? ? ? pET30b ? ? 4 1 sample ? ? ? 'mouse, human' ? ? ? ? ? ? ? ? 'Mus musculus , Homo sapiens' '10090, 9606' ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? ? ? ? ? ? RIL ? ? ? ? ? ? ? plasmid ? ? ? pET30b ? ? # 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 UNP CD1D1_MOUSE P11609 1 ;SEAQQKNYTFRCLQMSSFANRSWSRTDSVVWLGDLQTHRWSNDSATISFTKPWSQGKLSNQQWEKLQHMFQVYRVSFTRD IQELVKMMSPKEDYPIEIQLSAGCEMYPGNASESFLHVAFQGKYVVRFWGTSWQTVPGAPSWLDLPIKVLNADQGTSATV QMLLNDTCPLFVRGLLEAGKSDLEKQEKPVAWLSSVPSSADGHRQLVCHVSGFYPKPVWVMWMRGDQEQQGTHRGDFLPN ADETWYLQATLDVEAGEEAGLACRVKHSSLGGQDIILYW ; 19 ? 2 UNP B2MG_MOUSE P01887 2 ;IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDWSFYILAHTEFTPTETDTYAC RVKHDSMAEPKTVYWDRDM ; 21 ? 3 PDB 3SDC 3SDC 3 ? ? ? 4 PDB 3SDC 3SDC 4 ? ? ? # 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 3SDC A 1 ? 279 ? P11609 19 ? 297 ? 1 279 2 2 3SDC B 1 ? 99 ? P01887 21 ? 119 ? 1 99 3 3 3SDC C 1 ? 207 ? 3SDC 1 ? 210 ? 1 210 4 4 3SDC D 1 ? 245 ? 3SDC -1 ? 247 ? -1 247 # 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 3SDC HIS A 201 ? UNP P11609 ASP 219 'SEE REMARK 999' 201 1 1 3SDC GLY A 280 ? UNP P11609 ? ? 'EXPRESSION TAG' 280 2 1 3SDC SER A 281 ? UNP P11609 ? ? 'EXPRESSION TAG' 281 3 1 3SDC LEU A 282 ? UNP P11609 ? ? 'EXPRESSION TAG' 282 4 1 3SDC HIS A 283 ? UNP P11609 ? ? 'EXPRESSION TAG' 283 5 1 3SDC HIS A 284 ? UNP P11609 ? ? 'EXPRESSION TAG' 284 6 1 3SDC ILE A 285 ? UNP P11609 ? ? 'EXPRESSION TAG' 285 7 1 3SDC LEU A 286 ? UNP P11609 ? ? 'EXPRESSION TAG' 286 8 1 3SDC ASP A 287 ? UNP P11609 ? ? 'EXPRESSION TAG' 287 9 1 3SDC ALA A 288 ? UNP P11609 ? ? 'EXPRESSION TAG' 288 10 1 3SDC GLN A 289 ? UNP P11609 ? ? 'EXPRESSION TAG' 289 11 1 3SDC LYS A 290 ? UNP P11609 ? ? 'EXPRESSION TAG' 290 12 1 3SDC MET A 291 ? UNP P11609 ? ? 'EXPRESSION TAG' 291 13 1 3SDC VAL A 292 ? UNP P11609 ? ? 'EXPRESSION TAG' 292 14 1 3SDC TRP A 293 ? UNP P11609 ? ? 'EXPRESSION TAG' 293 15 1 3SDC ASN A 294 ? UNP P11609 ? ? 'EXPRESSION TAG' 294 16 1 3SDC HIS A 295 ? UNP P11609 ? ? 'EXPRESSION TAG' 295 17 1 3SDC ARG A 296 ? UNP P11609 ? ? 'EXPRESSION TAG' 296 18 1 3SDC HIS A 297 ? UNP P11609 ? ? 'EXPRESSION TAG' 297 19 1 3SDC HIS A 298 ? UNP P11609 ? ? 'EXPRESSION TAG' 298 20 1 3SDC HIS A 299 ? UNP P11609 ? ? 'EXPRESSION TAG' 299 21 1 3SDC HIS A 300 ? UNP P11609 ? ? 'EXPRESSION TAG' 300 22 1 3SDC HIS A 301 ? UNP P11609 ? ? 'EXPRESSION TAG' 301 23 1 3SDC HIS A 302 ? UNP P11609 ? ? 'EXPRESSION TAG' 302 24 2 3SDC ALA B 85 ? UNP P01887 ASP 105 'SEE REMARK 999' 85 25 # 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 3GB non-polymer . ;N-[(2S,3R,4E)-1-{[alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]hexacosanamide ; Globotrihexosylceramide 'C62 H117 N O18' 1164.588 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 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 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.crystals_number 1 _exptl.entry_id 3SDC _exptl.method 'X-RAY DIFFRACTION' # _exptl_crystal.id 1 _exptl_crystal.pdbx_mosaicity 0.620 _exptl_crystal.pdbx_mosaicity_esd ? _exptl_crystal.density_Matthews 3.31 _exptl_crystal.density_diffrn ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_percent_sol 62.85 _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.pH 6.1 _exptl_crystal_grow.temp 293 _exptl_crystal_grow.pdbx_details '13.5% PEG 6000, 0.1M Sodium citrate, pH 6.1, vapor diffusion, hanging drop, temperature 293K' _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp 213 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'ADSC QUANTUM 315r' _diffrn_detector.pdbx_collection_date 2011-03-10 _diffrn_detector.details mirrors # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.monochromator graphite _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength . _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'AUSTRALIAN SYNCHROTRON BEAMLINE MX2' _diffrn_source.pdbx_wavelength_list ? _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_site 'Australian Synchrotron' _diffrn_source.pdbx_synchrotron_beamline MX2 # _reflns.entry_id 3SDC _reflns.d_resolution_high 3.100 _reflns.d_resolution_low 89.657 _reflns.number_all 23961 _reflns.number_obs 23961 _reflns.pdbx_netI_over_sigmaI 6.900 _reflns.pdbx_Rsym_value 0.222 _reflns.pdbx_redundancy 5.600 _reflns.percent_possible_obs 98.400 _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.pdbx_Rmerge_I_obs ? _reflns.B_iso_Wilson_estimate ? _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 # loop_ _reflns_shell.d_res_high _reflns_shell.d_res_low _reflns_shell.number_measured_obs _reflns_shell.number_measured_all _reflns_shell.number_unique_obs _reflns_shell.pdbx_rejects _reflns_shell.Rmerge_I_obs _reflns_shell.meanI_over_sigI_obs _reflns_shell.pdbx_Rsym_value _reflns_shell.pdbx_chi_squared _reflns_shell.pdbx_redundancy _reflns_shell.percent_possible_obs _reflns_shell.pdbx_netI_over_sigmaI_obs _reflns_shell.number_possible _reflns_shell.number_unique_all _reflns_shell.Rmerge_F_all _reflns_shell.Rmerge_F_obs _reflns_shell.Rmerge_I_all _reflns_shell.meanI_over_sigI_all _reflns_shell.percent_possible_all _reflns_shell.pdbx_Rrim_I_all _reflns_shell.pdbx_Rpim_I_all _reflns_shell.pdbx_ordinal _reflns_shell.pdbx_diffrn_id 3.100 3.270 ? 20743 ? ? 0.010 0.800 1.028 ? 6.000 ? 1.700 ? 3451 ? ? 1.124 ? 99.100 1.124 0.447 1 1 3.270 3.470 ? 19226 ? ? 0.010 1.200 0.650 ? 5.900 ? 2.700 ? 3263 ? ? 0.712 ? 99.100 0.712 0.285 2 1 3.470 3.710 ? 17902 ? ? 0.010 1.800 0.436 ? 5.800 ? 4.000 ? 3090 ? ? 0.479 ? 98.900 0.479 0.194 3 1 3.710 4.000 ? 16390 ? ? 0.010 2.600 0.297 ? 5.700 ? 5.500 ? 2865 ? ? 0.326 ? 98.700 0.326 0.133 4 1 4.000 4.380 ? 14830 ? ? 0.010 4.000 0.190 ? 5.600 ? 8.200 ? 2650 ? ? 0.210 ? 98.700 0.210 0.086 5 1 4.380 4.900 ? 13175 ? ? 0.010 5.600 0.134 ? 5.400 ? 10.400 ? 2421 ? ? 0.148 ? 98.300 0.148 0.061 6 1 4.900 5.660 ? 11304 ? ? 0.010 5.400 0.138 ? 5.300 ? 9.900 ? 2123 ? ? 0.153 ? 97.600 0.153 0.064 7 1 5.660 6.930 ? 9128 ? ? 0.010 5.200 0.140 ? 5.000 ? 9.100 ? 1824 ? ? 0.156 ? 97.800 0.156 0.067 8 1 6.930 9.800 ? 7581 ? ? 0.010 7.800 0.085 ? 5.400 ? 14.400 ? 1413 ? ? 0.094 ? 95.500 0.094 0.039 9 1 9.800 66.716 ? 5071 ? ? 0.010 6.700 0.077 ? 5.900 ? 19.900 ? 861 ? ? 0.084 ? 96.100 0.084 0.034 10 1 # _refine.entry_id 3SDC _refine.ls_d_res_high 3.1000 _refine.ls_d_res_low 66.72 _refine.pdbx_ls_sigma_F 0.000 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_percent_reflns_obs 97.5200 _refine.ls_number_reflns_obs 23951 _refine.ls_number_reflns_all ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_R_Free_selection_details RANDOM _refine.details ;HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS U VALUES: REFINED INDIVIDUALLY ; _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.2429 _refine.ls_R_factor_R_work 0.2402 _refine.ls_wR_factor_R_work ? _refine.ls_R_factor_R_free 0.2921 _refine.ls_wR_factor_R_free ? _refine.ls_percent_reflns_R_free 5.1000 _refine.ls_number_reflns_R_free 1225 _refine.ls_R_factor_R_free_error ? _refine.B_iso_mean 62.6847 _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.pdbx_isotropic_thermal_model ? _refine.aniso_B[1][1] -0.6200 _refine.aniso_B[2][2] -0.6200 _refine.aniso_B[3][3] 1.2300 _refine.aniso_B[1][2] -0.0000 _refine.aniso_B[1][3] 0.0000 _refine.aniso_B[2][3] 0.0000 _refine.correlation_coeff_Fo_to_Fc 0.8860 _refine.correlation_coeff_Fo_to_Fc_free 0.8530 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.pdbx_overall_ESU_R_Free 0.5040 _refine.overall_SU_ML 0.4250 _refine.overall_SU_B 24.7910 _refine.solvent_model_details MASK _refine.pdbx_solvent_vdw_probe_radii 1.4000 _refine.pdbx_solvent_ion_probe_radii 0.8000 _refine.pdbx_solvent_shrinkage_radii 0.8000 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.overall_FOM_work_R_set 0.7502 _refine.B_iso_max 188.080 _refine.B_iso_min 19.620 _refine.pdbx_overall_phase_error ? _refine.occupancy_max 1.000 _refine.occupancy_min 0.000 _refine.pdbx_ls_sigma_I ? _refine.ls_redundancy_reflns_obs ? _refine.ls_R_factor_R_free_error_details ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.overall_FOM_free_R_set ? _refine.pdbx_diffrn_id 1 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_overall_ESU_R ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 6516 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 137 _refine_hist.number_atoms_solvent 37 _refine_hist.number_atoms_total 6690 _refine_hist.d_res_high 3.1000 _refine_hist.d_res_low 66.72 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.type _refine_ls_restr.number _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' r_bond_refined_d 6797 0.008 0.022 ? ? 'X-RAY DIFFRACTION' r_angle_refined_deg 9219 1.209 1.933 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_1_deg 808 6.213 5.000 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_2_deg 311 36.241 24.566 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_3_deg 1094 17.292 15.000 ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_4_deg 29 17.438 15.000 ? ? 'X-RAY DIFFRACTION' r_chiral_restr 1010 0.080 0.200 ? ? 'X-RAY DIFFRACTION' r_gen_planes_refined 5122 0.004 0.021 ? ? 'X-RAY DIFFRACTION' r_mcbond_it 4076 0.429 1.500 ? ? 'X-RAY DIFFRACTION' r_mcangle_it 6584 0.801 2.000 ? ? 'X-RAY DIFFRACTION' r_scbond_it 2721 0.753 3.000 ? ? 'X-RAY DIFFRACTION' r_scangle_it 2635 1.380 4.500 ? ? # _refine_ls_shell.d_res_high 3.1000 _refine_ls_shell.d_res_low 3.1800 _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.percent_reflns_obs 98.6500 _refine_ls_shell.number_reflns_R_work 1661 _refine_ls_shell.R_factor_all ? _refine_ls_shell.R_factor_R_work 0.3260 _refine_ls_shell.R_factor_R_free 0.4020 _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 89 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.number_reflns_all 1750 _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.redundancy_reflns_obs ? # _struct.entry_id 3SDC _struct.title 'Crystal structure of autoreactive-Valpha14-Vbeta6 NKT TCR in complex with CD1d-globotrihexosylceramide' _struct.pdbx_descriptor 'Antigen-presenting glycoprotein CD1d1, Beta-2-microglobulin, NKT TCR Valpha14 chain, NKT TCR autoreactive-Vbeta6 chain' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3SDC _struct_keywords.text 'CD1d, autoimmunity, self-recognition, NKT, IMMUNE SYSTEM' _struct_keywords.pdbx_keywords '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 3 ? D N N 4 ? E N N 5 ? F N N 5 ? G N N 5 ? H N N 5 ? I N N 6 ? J N N 7 ? K N N 7 ? L N N 7 ? M N N 7 ? # _struct_biol.id 1 _struct_biol.details ? # 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 LYS A 51 ? GLY A 56 ? LYS A 51 GLY A 56 5 ? 6 HELX_P HELX_P2 2 SER A 59 ? MET A 88 ? SER A 59 MET A 88 1 ? 30 HELX_P HELX_P3 3 PRO A 140 ? TRP A 142 ? PRO A 140 TRP A 142 5 ? 3 HELX_P HELX_P4 4 LEU A 143 ? ALA A 152 ? LEU A 143 ALA A 152 1 ? 10 HELX_P HELX_P5 5 ASP A 153 ? ASP A 166 ? ASP A 153 ASP A 166 1 ? 14 HELX_P HELX_P6 6 ASP A 166 ? GLY A 179 ? ASP A 166 GLY A 179 1 ? 14 HELX_P HELX_P7 7 GLY A 179 ? GLU A 184 ? GLY A 179 GLU A 184 1 ? 6 HELX_P HELX_P8 8 HIS A 267 ? GLY A 271 ? HIS A 267 GLY A 271 5 ? 5 HELX_P HELX_P9 9 SER A 281 ? LYS A 290 ? SER A 281 LYS A 290 1 ? 10 HELX_P HELX_P10 10 LEU C 81 ? ALA C 85 ? LEU C 82 ALA C 86 5 ? 5 HELX_P HELX_P11 11 ASP D 117 ? VAL D 121 ? ASP D 119 VAL D 123 5 ? 5 HELX_P HELX_P12 12 SER D 132 ? GLN D 140 ? SER D 134 GLN D 142 1 ? 9 HELX_P HELX_P13 13 ALA D 199 ? ASN D 204 ? ALA D 201 ASN D 206 1 ? 6 # _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 ? ? ? ? ? ? ? 2.037 ? disulf2 disulf ? ? A CYS 208 SG ? ? ? 1_555 A CYS 263 SG ? ? A CYS 208 A CYS 263 1_555 ? ? ? ? ? ? ? 2.029 ? disulf3 disulf ? ? B CYS 25 SG ? ? ? 1_555 B CYS 80 SG ? ? B CYS 25 B CYS 80 1_555 ? ? ? ? ? ? ? 2.028 ? disulf4 disulf ? ? C CYS 22 SG ? ? ? 1_555 C CYS 89 SG ? ? C CYS 22 C CYS 90 1_555 ? ? ? ? ? ? ? 2.040 ? disulf5 disulf ? ? C CYS 136 SG ? ? ? 1_555 C CYS 186 SG ? ? C CYS 139 C CYS 189 1_555 ? ? ? ? ? ? ? 2.044 ? disulf6 disulf ? ? C CYS 161 SG ? ? ? 1_555 D CYS 172 SG ? ? C CYS 164 D CYS 174 1_555 ? ? ? ? ? ? ? 2.032 ? disulf7 disulf ? ? D CYS 25 SG ? ? ? 1_555 D CYS 93 SG ? ? D CYS 23 D CYS 91 1_555 ? ? ? ? ? ? ? 2.027 ? disulf8 disulf ? ? D CYS 146 SG ? ? ? 1_555 D CYS 211 SG ? ? D CYS 148 D CYS 213 1_555 ? ? ? ? ? ? ? 2.030 ? covale1 covale ? ? A ASN 165 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 165 A NAG 305 1_555 ? ? ? ? ? ? ? 1.438 ? covale2 covale ? ? A ASN 20 ND2 ? ? ? 1_555 H NAG . C1 ? ? A ASN 20 A NAG 303 1_555 ? ? ? ? ? ? ? 1.454 ? covale3 covale ? ? A ASN 42 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 42 A NAG 304 1_555 ? ? ? ? ? ? ? 1.455 ? covale4 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 305 A NAG 306 1_555 ? ? ? ? ? ? ? 1.464 ? # 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 94 A . ? TYR 94 A PRO 95 A ? PRO 95 A 1 4.12 2 GLY 109 A . ? GLY 109 A ASN 110 A ? ASN 110 A 1 -0.39 3 TYR 214 A . ? TYR 214 A PRO 215 A ? PRO 215 A 1 3.08 4 HIS 31 B . ? HIS 31 B PRO 32 B ? PRO 32 B 1 -2.25 5 SER 6 C . ? SER 6 C PRO 7 C ? PRO 7 C 1 -7.91 6 THR 27 C . ? THR 27 C PRO 28 C ? PRO 28 C 1 -6.27 7 LEU 125 C . ? LEU 128 C ARG 126 C ? ARG 129 C 1 2.16 8 ARG 126 C . ? ARG 129 C ASP 127 C ? ASP 130 C 1 27.60 9 SER 128 C . ? SER 131 C LYS 129 C ? LYS 132 C 1 6.29 10 THR 9 D . ? THR 7 D PRO 10 D ? PRO 8 D 1 3.10 11 ALA 54 D . ? ALA 52 D GLY 55 D ? GLY 53 D 1 -8.43 12 TYR 152 D . ? TYR 154 D PRO 153 D ? PRO 155 D 1 -1.65 # 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 ? 5 ? I ? 2 ? J ? 4 ? K ? 4 ? L ? 4 ? M ? 4 ? N ? 6 ? O ? 4 ? P ? 4 ? Q ? 4 ? R ? 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 I 1 2 ? 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 ? parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel N 4 5 ? anti-parallel N 5 6 ? anti-parallel O 1 2 ? parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel P 3 4 ? anti-parallel Q 1 2 ? anti-parallel Q 2 3 ? anti-parallel Q 3 4 ? anti-parallel R 1 2 ? anti-parallel R 2 3 ? anti-parallel R 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 SER A 24 ? LEU A 32 ? SER A 24 LEU A 32 A 4 THR A 9 ? PHE A 18 ? THR A 9 PHE A 18 A 5 ILE A 96 ? TYR A 107 ? ILE A 96 TYR A 107 A 6 ALA A 111 ? PHE A 120 ? ALA A 111 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 ? PRO A 197 ? VAL A 190 PRO A 197 B 2 HIS A 203 ? PHE A 213 ? HIS A 203 PHE A 213 B 3 TRP A 245 ? GLU A 254 ? TRP A 245 GLU A 254 B 4 HIS A 233 ? ARG A 234 ? HIS A 233 ARG A 234 C 1 VAL A 190 ? PRO A 197 ? VAL A 190 PRO A 197 C 2 HIS A 203 ? PHE A 213 ? HIS A 203 PHE A 213 C 3 TRP A 245 ? GLU A 254 ? TRP A 245 GLU A 254 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 TRP A 219 ? ARG A 224 ? TRP A 219 ARG A 224 D 3 LEU A 261 ? LYS A 266 ? LEU A 261 LYS A 266 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 GLU B 36 ? LYS B 41 ? GLU B 36 LYS B 41 G 3 TYR B 78 ? LYS B 83 ? TYR B 78 LYS B 83 G 4 LYS B 91 ? TYR B 94 ? LYS B 91 TYR B 94 H 1 VAL C 3 ? SER C 6 ? VAL C 3 SER C 6 H 2 SER C 18 ? TYR C 24 ? SER C 18 TYR C 24 H 3 HIS C 71 ? ILE C 76 ? HIS C 72 ILE C 77 H 4 TYR C 61 ? ASP C 66 ? TYR C 62 ASP C 67 H 5 LYS C 53 ? ASN C 58 ? LYS C 53 ASN C 58 I 1 SER C 9 ? ARG C 13 ? SER C 9 ARG C 13 I 2 GLN C 108 ? ILE C 112 ? GLN C 111 ILE C 115 J 1 VAL C 44 ? LEU C 49 ? VAL C 44 LEU C 49 J 2 HIS C 31 ? GLN C 37 ? HIS C 31 GLN C 37 J 3 THR C 86 ? GLY C 92 ? THR C 87 GLY C 93 J 4 LEU C 101 ? PHE C 103 ? LEU C 104 PHE C 106 K 1 ALA C 121 ? VAL C 122 ? ALA C 124 VAL C 125 K 2 LEU C 137 ? THR C 139 ? LEU C 140 THR C 142 K 3 PHE C 170 ? TRP C 178 ? PHE C 173 TRP C 181 K 4 TYR C 156 ? ILE C 157 ? TYR C 159 ILE C 160 L 1 ALA C 121 ? VAL C 122 ? ALA C 124 VAL C 125 L 2 LEU C 137 ? THR C 139 ? LEU C 140 THR C 142 L 3 PHE C 170 ? TRP C 178 ? PHE C 173 TRP C 181 L 4 CYS C 161 ? MET C 165 ? CYS C 164 MET C 168 M 1 ILE D 6 ? THR D 9 ? ILE D 4 THR D 7 M 2 LEU D 21 ? GLN D 27 ? LEU D 19 GLN D 25 M 3 SER D 75 ? VAL D 80 ? SER D 73 VAL D 78 M 4 TYR D 66 ? LYS D 72 ? TYR D 64 LYS D 70 N 1 PHE D 12 ? GLN D 16 ? PHE D 10 GLN D 14 N 2 THR D 110 ? VAL D 115 ? THR D 112 VAL D 117 N 3 MET D 88 ? GLY D 96 ? MET D 86 GLY D 94 N 4 THR D 33 ? GLN D 39 ? THR D 31 GLN D 37 N 5 ARG D 46 ? TYR D 50 ? ARG D 44 TYR D 48 N 6 GLU D 58 ? LYS D 59 ? GLU D 56 LYS D 57 O 1 PHE D 12 ? GLN D 16 ? PHE D 10 GLN D 14 O 2 THR D 110 ? VAL D 115 ? THR D 112 VAL D 117 O 3 MET D 88 ? GLY D 96 ? MET D 86 GLY D 94 O 4 VAL D 104 ? PHE D 106 ? VAL D 106 PHE D 108 P 1 GLU D 125 ? PHE D 129 ? GLU D 127 PHE D 131 P 2 LYS D 141 ? PHE D 151 ? LYS D 143 PHE D 153 P 3 TYR D 189 ? SER D 198 ? TYR D 191 SER D 200 P 4 VAL D 171 ? THR D 173 ? VAL D 173 THR D 175 Q 1 GLU D 125 ? PHE D 129 ? GLU D 127 PHE D 131 Q 2 LYS D 141 ? PHE D 151 ? LYS D 143 PHE D 153 Q 3 TYR D 189 ? SER D 198 ? TYR D 191 SER D 200 Q 4 LEU D 178 ? LYS D 179 ? LEU D 180 LYS D 181 R 1 LYS D 165 ? VAL D 167 ? LYS D 167 VAL D 169 R 2 VAL D 156 ? VAL D 162 ? VAL D 158 VAL D 164 R 3 PHE D 209 ? PHE D 215 ? PHE D 211 PHE D 217 R 4 GLN D 234 ? ALA D 240 ? GLN D 236 ALA D 242 # 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 THR A 37 ? O THR A 37 N VAL A 30 ? N VAL A 30 A 3 4 O VAL A 29 ? O VAL A 29 N LEU A 13 ? N LEU A 13 A 4 5 N SER A 16 ? N SER A 16 O ILE A 98 ? O ILE A 98 A 5 6 N SER A 101 ? N SER A 101 O HIS A 117 ? O HIS A 117 A 6 7 N VAL A 118 ? N VAL A 118 O VAL A 126 ? O VAL A 126 A 7 8 N ARG A 127 ? N ARG A 127 O GLN A 134 ? O GLN A 134 B 1 2 N VAL A 196 ? N VAL A 196 O GLN A 205 ? O GLN A 205 B 2 3 N ARG A 204 ? N ARG A 204 O VAL A 253 ? O VAL A 253 B 3 4 O THR A 250 ? O THR A 250 N HIS A 233 ? N HIS A 233 C 1 2 N VAL A 196 ? N VAL A 196 O GLN A 205 ? O GLN A 205 C 2 3 N ARG A 204 ? N ARG A 204 O VAL A 253 ? O VAL A 253 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 CYS B 25 ? N CYS B 25 O ALA B 66 ? O ALA B 66 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 CYS B 25 ? N CYS B 25 O ALA B 66 ? O ALA B 66 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 GLU B 36 ? N GLU B 36 O LYS B 83 ? O LYS B 83 G 3 4 N CYS B 80 ? N CYS B 80 O VAL B 93 ? O VAL B 93 H 1 2 N GLU C 4 ? N GLU C 4 O ASN C 23 ? O ASN C 23 H 2 3 N LEU C 20 ? N LEU C 20 O LEU C 74 ? O LEU C 75 H 3 4 O HIS C 75 ? O HIS C 76 N SER C 62 ? N SER C 63 H 4 5 O ALA C 63 ? O ALA C 64 N THR C 56 ? N THR C 56 I 1 2 N LEU C 10 ? N LEU C 10 O GLN C 108 ? O GLN C 111 J 1 2 O VAL C 44 ? O VAL C 44 N LYS C 36 ? N LYS C 36 J 2 3 N PHE C 35 ? N PHE C 35 O ILE C 88 ? O ILE C 89 J 3 4 N VAL C 91 ? N VAL C 92 O HIS C 102 ? O HIS C 105 K 1 2 N ALA C 121 ? N ALA C 124 O THR C 139 ? O THR C 142 K 2 3 N PHE C 138 ? N PHE C 141 O ALA C 175 ? O ALA C 178 K 3 4 O TRP C 178 ? O TRP C 181 N TYR C 156 ? N TYR C 159 L 1 2 N ALA C 121 ? N ALA C 124 O THR C 139 ? O THR C 142 L 2 3 N PHE C 138 ? N PHE C 141 O ALA C 175 ? O ALA C 178 L 3 4 O SER C 174 ? O SER C 177 N CYS C 161 ? N CYS C 164 M 1 2 N THR D 7 ? N THR D 5 O GLN D 26 ? O GLN D 24 M 2 3 N LEU D 21 ? N LEU D 19 O VAL D 80 ? O VAL D 78 M 3 4 O THR D 79 ? O THR D 77 N ASP D 67 ? N ASP D 65 N 1 2 N LEU D 13 ? N LEU D 11 O THR D 113 ? O THR D 115 N 2 3 O LEU D 112 ? O LEU D 114 N ALA D 89 ? N ALA D 87 N 3 4 O ALA D 94 ? O ALA D 92 N TYR D 35 ? N TYR D 33 N 4 5 N TRP D 36 ? N TRP D 34 O ILE D 48 ? O ILE D 46 N 5 6 N TYR D 50 ? N TYR D 48 O GLU D 58 ? O GLU D 56 O 1 2 N LEU D 13 ? N LEU D 11 O THR D 113 ? O THR D 115 O 2 3 O LEU D 112 ? O LEU D 114 N ALA D 89 ? N ALA D 87 O 3 4 N SER D 95 ? N SER D 93 O PHE D 105 ? O PHE D 107 P 1 2 N PHE D 129 ? N PHE D 131 O VAL D 145 ? O VAL D 147 P 2 3 N LEU D 144 ? N LEU D 146 O LEU D 195 ? O LEU D 197 P 3 4 O ARG D 194 ? O ARG D 196 N CYS D 172 ? N CYS D 174 Q 1 2 N PHE D 129 ? N PHE D 131 O VAL D 145 ? O VAL D 147 Q 2 3 N LEU D 144 ? N LEU D 146 O LEU D 195 ? O LEU D 197 Q 3 4 O ALA D 190 ? O ALA D 192 N LEU D 178 ? N LEU D 180 R 1 2 O LYS D 165 ? O LYS D 167 N VAL D 162 ? N VAL D 164 R 2 3 N GLU D 157 ? N GLU D 159 O GLN D 214 ? O GLN D 216 R 3 4 N PHE D 209 ? N PHE D 211 O ALA D 240 ? O ALA D 242 # 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 ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG A 305' AC2 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 306' AC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 304' AC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 303' AC5 Software ? ? ? ? 25 'BINDING SITE FOR RESIDUE 3GB A 307' # 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 6 GLY A 130 ? GLY A 130 . ? 1_555 ? 2 AC1 6 THR A 131 ? THR A 131 . ? 1_555 ? 3 AC1 6 GLN A 161 ? GLN A 161 . ? 1_555 ? 4 AC1 6 ASN A 165 ? ASN A 165 . ? 1_555 ? 5 AC1 6 NAG F . ? NAG A 306 . ? 1_555 ? 6 AC1 6 HOH J . ? HOH A 324 . ? 1_555 ? 7 AC2 1 NAG E . ? NAG A 305 . ? 1_555 ? 8 AC3 2 SER A 24 ? SER A 24 . ? 1_555 ? 9 AC3 2 ASN A 42 ? ASN A 42 . ? 1_555 ? 10 AC4 3 ALA A 19 ? ALA A 19 . ? 1_555 ? 11 AC4 3 ASN A 20 ? ASN A 20 . ? 1_555 ? 12 AC4 3 HOH K . ? HOH B 308 . ? 1_555 ? 13 AC5 25 CYS A 12 ? CYS A 12 . ? 1_555 ? 14 AC5 25 GLN A 14 ? GLN A 14 . ? 1_555 ? 15 AC5 25 SER A 28 ? SER A 28 . ? 1_555 ? 16 AC5 25 PHE A 70 ? PHE A 70 . ? 1_555 ? 17 AC5 25 TYR A 73 ? TYR A 73 . ? 1_555 ? 18 AC5 25 ASP A 80 ? ASP A 80 . ? 1_555 ? 19 AC5 25 LEU A 100 ? LEU A 100 . ? 1_555 ? 20 AC5 25 LEU A 116 ? LEU A 116 . ? 1_555 ? 21 AC5 25 TRP A 133 ? TRP A 133 . ? 1_555 ? 22 AC5 25 TRP A 142 ? TRP A 142 . ? 1_555 ? 23 AC5 25 LEU A 150 ? LEU A 150 . ? 1_555 ? 24 AC5 25 ASP A 153 ? ASP A 153 . ? 1_555 ? 25 AC5 25 GLN A 154 ? GLN A 154 . ? 1_555 ? 26 AC5 25 GLY A 155 ? GLY A 155 . ? 1_555 ? 27 AC5 25 THR A 156 ? THR A 156 . ? 1_555 ? 28 AC5 25 ALA A 158 ? ALA A 158 . ? 1_555 ? 29 AC5 25 THR A 159 ? THR A 159 . ? 1_555 ? 30 AC5 25 CYS A 168 ? CYS A 168 . ? 1_555 ? 31 AC5 25 PHE A 171 ? PHE A 171 . ? 1_555 ? 32 AC5 25 PRO C 28 ? PRO C 28 . ? 1_555 ? 33 AC5 25 ASP C 29 ? ASP C 29 . ? 1_555 ? 34 AC5 25 ASN C 30 ? ASN C 30 . ? 1_555 ? 35 AC5 25 LYS C 67 ? LYS C 68 . ? 1_555 ? 36 AC5 25 ARG C 94 ? ARG C 95 . ? 1_555 ? 37 AC5 25 GLY C 95 ? GLY C 96 . ? 1_555 ? # _atom_sites.entry_id 3SDC _atom_sites.fract_transf_matrix[1][1] 0.010599 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] -0.000000 _atom_sites.fract_transf_matrix[2][2] 0.010599 _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] 0.003474 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # 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 . ASN A 1 7 ? 9.056 -122.177 -54.809 1.00 57.86 ? 7 ASN A N 1 ATOM 2 C CA . ASN A 1 7 ? 9.948 -122.024 -53.612 1.00 58.06 ? 7 ASN A CA 1 ATOM 3 C C . ASN A 1 7 ? 9.504 -120.981 -52.569 1.00 57.84 ? 7 ASN A C 1 ATOM 4 O O . ASN A 1 7 ? 8.784 -121.326 -51.633 1.00 58.08 ? 7 ASN A O 1 ATOM 5 C CB . ASN A 1 7 ? 11.412 -121.794 -54.029 1.00 58.33 ? 7 ASN A CB 1 ATOM 6 C CG . ASN A 1 7 ? 12.309 -123.000 -53.745 1.00 58.94 ? 7 ASN A CG 1 ATOM 7 O OD1 . ASN A 1 7 ? 12.248 -124.019 -54.442 1.00 59.56 ? 7 ASN A OD1 1 ATOM 8 N ND2 . ASN A 1 7 ? 13.165 -122.875 -52.728 1.00 59.37 ? 7 ASN A ND2 1 ATOM 9 N N . TYR A 1 8 ? 9.936 -119.723 -52.730 1.00 57.50 ? 8 TYR A N 1 ATOM 10 C CA . TYR A 1 8 ? 9.758 -118.668 -51.700 1.00 57.16 ? 8 TYR A CA 1 ATOM 11 C C . TYR A 1 8 ? 8.569 -117.734 -51.949 1.00 56.44 ? 8 TYR A C 1 ATOM 12 O O . TYR A 1 8 ? 8.188 -117.497 -53.095 1.00 56.55 ? 8 TYR A O 1 ATOM 13 C CB . TYR A 1 8 ? 11.040 -117.825 -51.530 1.00 57.45 ? 8 TYR A CB 1 ATOM 14 C CG . TYR A 1 8 ? 12.140 -118.500 -50.727 1.00 58.84 ? 8 TYR A CG 1 ATOM 15 C CD1 . TYR A 1 8 ? 13.095 -119.305 -51.357 1.00 60.17 ? 8 TYR A CD1 1 ATOM 16 C CD2 . TYR A 1 8 ? 12.228 -118.335 -49.340 1.00 59.77 ? 8 TYR A CD2 1 ATOM 17 C CE1 . TYR A 1 8 ? 14.104 -119.936 -50.631 1.00 60.95 ? 8 TYR A CE1 1 ATOM 18 C CE2 . TYR A 1 8 ? 13.235 -118.960 -48.602 1.00 60.66 ? 8 TYR A CE2 1 ATOM 19 C CZ . TYR A 1 8 ? 14.172 -119.762 -49.256 1.00 61.33 ? 8 TYR A CZ 1 ATOM 20 O OH . TYR A 1 8 ? 15.179 -120.396 -48.547 1.00 61.71 ? 8 TYR A OH 1 ATOM 21 N N . THR A 1 9 ? 8.005 -117.196 -50.865 1.00 55.39 ? 9 THR A N 1 ATOM 22 C CA . THR A 1 9 ? 6.860 -116.285 -50.936 1.00 54.21 ? 9 THR A CA 1 ATOM 23 C C . THR A 1 9 ? 7.074 -115.025 -50.107 1.00 53.46 ? 9 THR A C 1 ATOM 24 O O . THR A 1 9 ? 7.317 -115.085 -48.902 1.00 53.47 ? 9 THR A O 1 ATOM 25 C CB . THR A 1 9 ? 5.554 -116.976 -50.499 1.00 54.27 ? 9 THR A CB 1 ATOM 26 O OG1 . THR A 1 9 ? 5.249 -118.031 -51.420 1.00 54.45 ? 9 THR A OG1 1 ATOM 27 C CG2 . THR A 1 9 ? 4.395 -115.986 -50.464 1.00 53.82 ? 9 THR A CG2 1 ATOM 28 N N . PHE A 1 10 ? 6.971 -113.884 -50.778 1.00 52.48 ? 10 PHE A N 1 ATOM 29 C CA . PHE A 1 10 ? 7.140 -112.581 -50.165 1.00 51.30 ? 10 PHE A CA 1 ATOM 30 C C . PHE A 1 10 ? 5.777 -112.066 -49.788 1.00 50.92 ? 10 PHE A C 1 ATOM 31 O O . PHE A 1 10 ? 4.854 -112.127 -50.592 1.00 50.94 ? 10 PHE A O 1 ATOM 32 C CB . PHE A 1 10 ? 7.771 -111.645 -51.179 1.00 51.06 ? 10 PHE A CB 1 ATOM 33 C CG . PHE A 1 10 ? 8.149 -110.310 -50.631 1.00 50.05 ? 10 PHE A CG 1 ATOM 34 C CD1 . PHE A 1 10 ? 9.129 -110.194 -49.657 1.00 48.95 ? 10 PHE A CD1 1 ATOM 35 C CD2 . PHE A 1 10 ? 7.555 -109.153 -51.133 1.00 49.49 ? 10 PHE A CD2 1 ATOM 36 C CE1 . PHE A 1 10 ? 9.496 -108.946 -49.171 1.00 48.86 ? 10 PHE A CE1 1 ATOM 37 C CE2 . PHE A 1 10 ? 7.909 -107.898 -50.654 1.00 48.72 ? 10 PHE A CE2 1 ATOM 38 C CZ . PHE A 1 10 ? 8.882 -107.791 -49.672 1.00 48.99 ? 10 PHE A CZ 1 ATOM 39 N N . ARG A 1 11 ? 5.648 -111.573 -48.561 1.00 50.42 ? 11 ARG A N 1 ATOM 40 C CA . ARG A 1 11 ? 4.388 -111.008 -48.084 1.00 49.99 ? 11 ARG A CA 1 ATOM 41 C C . ARG A 1 11 ? 4.592 -109.657 -47.441 1.00 49.57 ? 11 ARG A C 1 ATOM 42 O O . ARG A 1 11 ? 5.364 -109.519 -46.490 1.00 49.63 ? 11 ARG A O 1 ATOM 43 C CB . ARG A 1 11 ? 3.736 -111.909 -47.048 1.00 50.01 ? 11 ARG A CB 1 ATOM 44 C CG . ARG A 1 11 ? 3.310 -113.248 -47.549 1.00 51.03 ? 11 ARG A CG 1 ATOM 45 C CD . ARG A 1 11 ? 3.042 -114.157 -46.371 1.00 53.00 ? 11 ARG A CD 1 ATOM 46 N NE . ARG A 1 11 ? 3.444 -115.526 -46.672 1.00 54.34 ? 11 ARG A NE 1 ATOM 47 C CZ . ARG A 1 11 ? 2.664 -116.424 -47.266 1.00 55.05 ? 11 ARG A CZ 1 ATOM 48 N NH1 . ARG A 1 11 ? 3.138 -117.641 -47.497 1.00 55.38 ? 11 ARG A NH1 1 ATOM 49 N NH2 . ARG A 1 11 ? 1.416 -116.112 -47.627 1.00 54.83 ? 11 ARG A NH2 1 ATOM 50 N N . CYS A 1 12 ? 3.899 -108.657 -47.962 1.00 48.97 ? 12 CYS A N 1 ATOM 51 C CA . CYS A 1 12 ? 3.746 -107.416 -47.236 1.00 48.40 ? 12 CYS A CA 1 ATOM 52 C C . CYS A 1 12 ? 2.382 -107.508 -46.588 1.00 48.01 ? 12 CYS A C 1 ATOM 53 O O . CYS A 1 12 ? 1.373 -107.749 -47.265 1.00 47.79 ? 12 CYS A O 1 ATOM 54 C CB . CYS A 1 12 ? 3.861 -106.219 -48.166 1.00 48.31 ? 12 CYS A CB 1 ATOM 55 S SG . CYS A 1 12 ? 5.480 -106.106 -48.945 1.00 49.12 ? 12 CYS A SG 1 ATOM 56 N N . LEU A 1 13 ? 2.369 -107.374 -45.266 1.00 47.57 ? 13 LEU A N 1 ATOM 57 C CA . LEU A 1 13 ? 1.147 -107.542 -44.495 1.00 47.26 ? 13 LEU A CA 1 ATOM 58 C C . LEU A 1 13 ? 0.743 -106.253 -43.813 1.00 47.17 ? 13 LEU A C 1 ATOM 59 O O . LEU A 1 13 ? 1.533 -105.658 -43.073 1.00 47.18 ? 13 LEU A O 1 ATOM 60 C CB . LEU A 1 13 ? 1.294 -108.672 -43.477 1.00 47.14 ? 13 LEU A CB 1 ATOM 61 C CG . LEU A 1 13 ? 1.475 -110.074 -44.062 1.00 47.32 ? 13 LEU A CG 1 ATOM 62 C CD1 . LEU A 1 13 ? 1.354 -111.123 -42.974 1.00 47.69 ? 13 LEU A CD1 1 ATOM 63 C CD2 . LEU A 1 13 ? 0.473 -110.356 -45.177 1.00 47.61 ? 13 LEU A CD2 1 ATOM 64 N N . GLN A 1 14 ? -0.489 -105.825 -44.080 1.00 46.96 ? 14 GLN A N 1 ATOM 65 C CA . GLN A 1 14 ? -1.003 -104.569 -43.548 1.00 46.80 ? 14 GLN A CA 1 ATOM 66 C C . GLN A 1 14 ? -2.223 -104.821 -42.677 1.00 46.74 ? 14 GLN A C 1 ATOM 67 O O . GLN A 1 14 ? -3.169 -105.483 -43.099 1.00 46.57 ? 14 GLN A O 1 ATOM 68 C CB . GLN A 1 14 ? -1.338 -103.590 -44.681 1.00 46.78 ? 14 GLN A CB 1 ATOM 69 C CG . GLN A 1 14 ? -1.681 -102.176 -44.211 1.00 46.28 ? 14 GLN A CG 1 ATOM 70 C CD . GLN A 1 14 ? -2.221 -101.284 -45.316 1.00 45.27 ? 14 GLN A CD 1 ATOM 71 O OE1 . GLN A 1 14 ? -1.742 -101.313 -46.449 1.00 45.28 ? 14 GLN A OE1 1 ATOM 72 N NE2 . GLN A 1 14 ? -3.218 -100.477 -44.984 1.00 44.53 ? 14 GLN A NE2 1 ATOM 73 N N . MET A 1 15 ? -2.175 -104.290 -41.460 1.00 46.69 ? 15 MET A N 1 ATOM 74 C CA . MET A 1 15 ? -3.270 -104.382 -40.522 1.00 46.94 ? 15 MET A CA 1 ATOM 75 C C . MET A 1 15 ? -3.748 -102.986 -40.250 1.00 47.03 ? 15 MET A C 1 ATOM 76 O O . MET A 1 15 ? -3.033 -102.190 -39.648 1.00 47.13 ? 15 MET A O 1 ATOM 77 C CB . MET A 1 15 ? -2.792 -104.978 -39.211 1.00 47.04 ? 15 MET A CB 1 ATOM 78 C CG . MET A 1 15 ? -2.469 -106.429 -39.279 1.00 47.95 ? 15 MET A CG 1 ATOM 79 S SD . MET A 1 15 ? -1.004 -106.785 -38.309 1.00 50.51 ? 15 MET A SD 1 ATOM 80 C CE . MET A 1 15 ? 0.187 -106.996 -39.632 1.00 49.79 ? 15 MET A CE 1 ATOM 81 N N . SER A 1 16 ? -4.955 -102.682 -40.695 1.00 47.22 ? 16 SER A N 1 ATOM 82 C CA . SER A 1 16 ? -5.525 -101.376 -40.436 1.00 47.54 ? 16 SER A CA 1 ATOM 83 C C . SER A 1 16 ? -6.752 -101.507 -39.552 1.00 47.86 ? 16 SER A C 1 ATOM 84 O O . SER A 1 16 ? -7.611 -102.364 -39.777 1.00 48.04 ? 16 SER A O 1 ATOM 85 C CB . SER A 1 16 ? -5.838 -100.650 -41.742 1.00 47.48 ? 16 SER A CB 1 ATOM 86 O OG . SER A 1 16 ? -4.638 -100.248 -42.383 1.00 47.35 ? 16 SER A OG 1 ATOM 87 N N . SER A 1 17 ? -6.811 -100.660 -38.532 1.00 48.22 ? 17 SER A N 1 ATOM 88 C CA . SER A 1 17 ? -7.876 -100.703 -37.544 1.00 48.59 ? 17 SER A CA 1 ATOM 89 C C . SER A 1 17 ? -8.466 -99.318 -37.368 1.00 49.02 ? 17 SER A C 1 ATOM 90 O O . SER A 1 17 ? -7.733 -98.358 -37.121 1.00 49.07 ? 17 SER A O 1 ATOM 91 C CB . SER A 1 17 ? -7.334 -101.207 -36.209 1.00 48.55 ? 17 SER A CB 1 ATOM 92 O OG . SER A 1 17 ? -6.741 -102.482 -36.361 1.00 48.25 ? 17 SER A OG 1 ATOM 93 N N . PHE A 1 18 ? -9.788 -99.229 -37.500 1.00 49.47 ? 18 PHE A N 1 ATOM 94 C CA . PHE A 1 18 ? -10.527 -97.976 -37.366 1.00 49.91 ? 18 PHE A CA 1 ATOM 95 C C . PHE A 1 18 ? -11.607 -98.172 -36.313 1.00 50.43 ? 18 PHE A C 1 ATOM 96 O O . PHE A 1 18 ? -12.455 -99.055 -36.458 1.00 50.53 ? 18 PHE A O 1 ATOM 97 C CB . PHE A 1 18 ? -11.171 -97.598 -38.703 1.00 49.85 ? 18 PHE A CB 1 ATOM 98 C CG . PHE A 1 18 ? -10.194 -97.475 -39.835 1.00 49.49 ? 18 PHE A CG 1 ATOM 99 C CD1 . PHE A 1 18 ? -9.822 -98.590 -40.576 1.00 49.06 ? 18 PHE A CD1 1 ATOM 100 C CD2 . PHE A 1 18 ? -9.647 -96.242 -40.163 1.00 49.39 ? 18 PHE A CD2 1 ATOM 101 C CE1 . PHE A 1 18 ? -8.907 -98.477 -41.621 1.00 49.01 ? 18 PHE A CE1 1 ATOM 102 C CE2 . PHE A 1 18 ? -8.734 -96.121 -41.209 1.00 49.41 ? 18 PHE A CE2 1 ATOM 103 C CZ . PHE A 1 18 ? -8.366 -97.242 -41.940 1.00 48.93 ? 18 PHE A CZ 1 ATOM 104 N N . ALA A 1 19 ? -11.576 -97.361 -35.256 1.00 50.96 ? 19 ALA A N 1 ATOM 105 C CA . ALA A 1 19 ? -12.482 -97.547 -34.118 1.00 51.59 ? 19 ALA A CA 1 ATOM 106 C C . ALA A 1 19 ? -13.716 -96.672 -34.227 1.00 52.23 ? 19 ALA A C 1 ATOM 107 O O . ALA A 1 19 ? -14.830 -97.130 -34.011 1.00 52.46 ? 19 ALA A O 1 ATOM 108 C CB . ALA A 1 19 ? -11.762 -97.279 -32.814 1.00 51.46 ? 19 ALA A CB 1 ATOM 109 N N . ASN A 1 20 ? -13.496 -95.407 -34.550 1.00 53.07 ? 20 ASN A N 1 ATOM 110 C CA . ASN A 1 20 ? -14.553 -94.439 -34.773 1.00 54.02 ? 20 ASN A CA 1 ATOM 111 C C . ASN A 1 20 ? -14.024 -93.398 -35.761 1.00 54.18 ? 20 ASN A C 1 ATOM 112 O O . ASN A 1 20 ? -13.008 -93.630 -36.411 1.00 54.24 ? 20 ASN A O 1 ATOM 113 C CB . ASN A 1 20 ? -14.970 -93.800 -33.447 1.00 54.44 ? 20 ASN A CB 1 ATOM 114 C CG . ASN A 1 20 ? -13.779 -93.478 -32.555 1.00 56.42 ? 20 ASN A CG 1 ATOM 115 O OD1 . ASN A 1 20 ? -12.967 -92.605 -32.876 1.00 57.10 ? 20 ASN A OD1 1 ATOM 116 N ND2 . ASN A 1 20 ? -13.678 -94.187 -31.420 1.00 59.59 ? 20 ASN A ND2 1 ATOM 117 N N . ARG A 1 21 ? -14.655 -92.236 -35.824 1.00 54.45 ? 21 ARG A N 1 ATOM 118 C CA . ARG A 1 21 ? -14.236 -91.218 -36.777 1.00 54.82 ? 21 ARG A CA 1 ATOM 119 C C . ARG A 1 21 ? -12.797 -90.767 -36.526 1.00 54.95 ? 21 ARG A C 1 ATOM 120 O O . ARG A 1 21 ? -12.049 -90.496 -37.466 1.00 55.10 ? 21 ARG A O 1 ATOM 121 C CB . ARG A 1 21 ? -15.180 -90.015 -36.724 1.00 54.97 ? 21 ARG A CB 1 ATOM 122 C CG . ARG A 1 21 ? -16.563 -90.286 -37.293 1.00 55.88 ? 21 ARG A CG 1 ATOM 123 C CD . ARG A 1 21 ? -17.437 -89.043 -37.236 1.00 55.44 ? 21 ARG A CD 1 ATOM 124 N NE . ARG A 1 21 ? -17.940 -88.668 -38.555 0.00 62.80 ? 21 ARG A NE 1 ATOM 125 C CZ . ARG A 1 21 ? -17.378 -87.751 -39.335 1.00 58.02 ? 21 ARG A CZ 1 ATOM 126 N NH1 . ARG A 1 21 ? -17.904 -87.473 -40.520 0.73 58.17 ? 21 ARG A NH1 1 ATOM 127 N NH2 . ARG A 1 21 ? -16.289 -87.111 -38.932 1.00 58.02 ? 21 ARG A NH2 1 ATOM 128 N N . SER A 1 22 ? -12.424 -90.671 -35.255 1.00 54.93 ? 22 SER A N 1 ATOM 129 C CA . SER A 1 22 ? -11.172 -90.008 -34.843 1.00 54.90 ? 22 SER A CA 1 ATOM 130 C C . SER A 1 22 ? -9.927 -90.895 -34.756 1.00 54.70 ? 22 SER A C 1 ATOM 131 O O . SER A 1 22 ? -8.809 -90.427 -35.006 1.00 54.90 ? 22 SER A O 1 ATOM 132 C CB . SER A 1 22 ? -11.358 -89.311 -33.496 1.00 54.96 ? 22 SER A CB 1 ATOM 133 O OG . SER A 1 22 ? -11.918 -88.030 -33.677 1.00 55.87 ? 22 SER A OG 1 ATOM 134 N N . TRP A 1 23 ? -10.124 -92.161 -34.391 1.00 54.14 ? 23 TRP A N 1 ATOM 135 C CA . TRP A 1 23 ? -9.030 -93.050 -34.014 1.00 53.40 ? 23 TRP A CA 1 ATOM 136 C C . TRP A 1 23 ? -8.771 -94.092 -35.088 1.00 52.94 ? 23 TRP A C 1 ATOM 137 O O . TRP A 1 23 ? -9.707 -94.725 -35.580 1.00 52.91 ? 23 TRP A O 1 ATOM 138 C CB . TRP A 1 23 ? -9.390 -93.746 -32.704 1.00 53.42 ? 23 TRP A CB 1 ATOM 139 C CG . TRP A 1 23 ? -8.263 -94.432 -32.007 1.00 53.41 ? 23 TRP A CG 1 ATOM 140 C CD1 . TRP A 1 23 ? -7.491 -93.918 -31.010 1.00 53.50 ? 23 TRP A CD1 1 ATOM 141 C CD2 . TRP A 1 23 ? -7.801 -95.771 -32.223 1.00 53.60 ? 23 TRP A CD2 1 ATOM 142 N NE1 . TRP A 1 23 ? -6.569 -94.846 -30.595 1.00 53.41 ? 23 TRP A NE1 1 ATOM 143 C CE2 . TRP A 1 23 ? -6.735 -95.993 -31.323 1.00 53.62 ? 23 TRP A CE2 1 ATOM 144 C CE3 . TRP A 1 23 ? -8.179 -96.803 -33.092 1.00 54.11 ? 23 TRP A CE3 1 ATOM 145 C CZ2 . TRP A 1 23 ? -6.033 -97.204 -31.270 1.00 53.86 ? 23 TRP A CZ2 1 ATOM 146 C CZ3 . TRP A 1 23 ? -7.485 -98.014 -33.036 1.00 54.45 ? 23 TRP A CZ3 1 ATOM 147 C CH2 . TRP A 1 23 ? -6.422 -98.200 -32.131 1.00 54.38 ? 23 TRP A CH2 1 ATOM 148 N N . SER A 1 24 ? -7.501 -94.265 -35.448 1.00 52.33 ? 24 SER A N 1 ATOM 149 C CA . SER A 1 24 ? -7.080 -95.380 -36.310 1.00 51.69 ? 24 SER A CA 1 ATOM 150 C C . SER A 1 24 ? -5.564 -95.571 -36.332 1.00 50.98 ? 24 SER A C 1 ATOM 151 O O . SER A 1 24 ? -4.817 -94.680 -35.914 1.00 51.05 ? 24 SER A O 1 ATOM 152 C CB . SER A 1 24 ? -7.624 -95.226 -37.735 1.00 51.74 ? 24 SER A CB 1 ATOM 153 O OG . SER A 1 24 ? -6.857 -94.310 -38.486 1.00 52.39 ? 24 SER A OG 1 ATOM 154 N N . ARG A 1 25 ? -5.127 -96.737 -36.813 1.00 50.06 ? 25 ARG A N 1 ATOM 155 C CA . ARG A 1 25 ? -3.698 -97.066 -36.925 1.00 49.21 ? 25 ARG A CA 1 ATOM 156 C C . ARG A 1 25 ? -3.425 -98.144 -37.975 1.00 48.50 ? 25 ARG A C 1 ATOM 157 O O . ARG A 1 25 ? -4.266 -99.015 -38.232 1.00 48.46 ? 25 ARG A O 1 ATOM 158 C CB . ARG A 1 25 ? -3.123 -97.514 -35.575 1.00 49.36 ? 25 ARG A CB 1 ATOM 159 C CG . ARG A 1 25 ? -3.675 -98.850 -35.078 1.00 49.45 ? 25 ARG A CG 1 ATOM 160 C CD . ARG A 1 25 ? -3.032 -99.307 -33.792 1.00 49.42 ? 25 ARG A CD 1 ATOM 161 N NE . ARG A 1 25 ? -1.593 -99.509 -33.927 1.00 49.61 ? 25 ARG A NE 1 ATOM 162 C CZ . ARG A 1 25 ? -0.680 -98.898 -33.179 1.00 49.78 ? 25 ARG A CZ 1 ATOM 163 N NH1 . ARG A 1 25 ? -1.050 -98.043 -32.230 1.00 49.85 ? 25 ARG A NH1 1 ATOM 164 N NH2 . ARG A 1 25 ? 0.607 -99.154 -33.372 1.00 49.94 ? 25 ARG A NH2 1 ATOM 165 N N . THR A 1 26 ? -2.235 -98.080 -38.566 1.00 47.51 ? 26 THR A N 1 ATOM 166 C CA . THR A 1 26 ? -1.803 -99.050 -39.565 1.00 46.40 ? 26 THR A CA 1 ATOM 167 C C . THR A 1 26 ? -0.409 -99.560 -39.214 1.00 45.91 ? 26 THR A C 1 ATOM 168 O O . THR A 1 26 ? 0.562 -98.799 -39.165 1.00 45.72 ? 26 THR A O 1 ATOM 169 C CB . THR A 1 26 ? -1.868 -98.463 -41.003 1.00 46.30 ? 26 THR A CB 1 ATOM 170 O OG1 . THR A 1 26 ? -3.234 -98.359 -41.405 1.00 45.35 ? 26 THR A OG1 1 ATOM 171 C CG2 . THR A 1 26 ? -1.142 -99.342 -42.003 1.00 46.22 ? 26 THR A CG2 1 ATOM 172 N N . ASP A 1 27 ? -0.337 -100.856 -38.938 1.00 45.30 ? 27 ASP A N 1 ATOM 173 C CA . ASP A 1 27 ? 0.925 -101.523 -38.694 1.00 44.88 ? 27 ASP A CA 1 ATOM 174 C C . ASP A 1 27 ? 1.136 -102.514 -39.805 1.00 44.57 ? 27 ASP A C 1 ATOM 175 O O . ASP A 1 27 ? 0.197 -103.195 -40.235 1.00 44.42 ? 27 ASP A O 1 ATOM 176 C CB . ASP A 1 27 ? 0.921 -102.248 -37.351 1.00 44.94 ? 27 ASP A CB 1 ATOM 177 C CG . ASP A 1 27 ? 0.565 -101.337 -36.205 1.00 45.03 ? 27 ASP A CG 1 ATOM 178 O OD1 . ASP A 1 27 ? -0.494 -101.574 -35.588 1.00 45.24 ? 27 ASP A OD1 1 ATOM 179 O OD2 . ASP A 1 27 ? 1.324 -100.380 -35.936 1.00 45.00 ? 27 ASP A OD2 1 ATOM 180 N N . SER A 1 28 ? 2.372 -102.584 -40.273 1.00 44.16 ? 28 SER A N 1 ATOM 181 C CA . SER A 1 28 ? 2.706 -103.478 -41.355 1.00 43.85 ? 28 SER A CA 1 ATOM 182 C C . SER A 1 28 ? 3.888 -104.333 -40.941 1.00 43.75 ? 28 SER A C 1 ATOM 183 O O . SER A 1 28 ? 4.715 -103.906 -40.130 1.00 43.86 ? 28 SER A O 1 ATOM 184 C CB . SER A 1 28 ? 3.014 -102.686 -42.626 1.00 43.74 ? 28 SER A CB 1 ATOM 185 O OG . SER A 1 28 ? 2.022 -101.701 -42.872 1.00 43.55 ? 28 SER A OG 1 ATOM 186 N N . VAL A 1 29 ? 3.936 -105.549 -41.476 1.00 43.44 ? 29 VAL A N 1 ATOM 187 C CA . VAL A 1 29 ? 5.071 -106.452 -41.308 1.00 43.25 ? 29 VAL A CA 1 ATOM 188 C C . VAL A 1 29 ? 5.430 -107.079 -42.665 1.00 43.22 ? 29 VAL A C 1 ATOM 189 O O . VAL A 1 29 ? 4.584 -107.161 -43.560 1.00 43.42 ? 29 VAL A O 1 ATOM 190 C CB . VAL A 1 29 ? 4.790 -107.551 -40.237 1.00 43.35 ? 29 VAL A CB 1 ATOM 191 C CG1 . VAL A 1 29 ? 4.711 -106.944 -38.851 1.00 43.22 ? 29 VAL A CG1 1 ATOM 192 C CG2 . VAL A 1 29 ? 3.515 -108.339 -40.545 1.00 43.18 ? 29 VAL A CG2 1 ATOM 193 N N . VAL A 1 30 ? 6.676 -107.504 -42.835 1.00 43.03 ? 30 VAL A N 1 ATOM 194 C CA . VAL A 1 30 ? 7.079 -108.090 -44.110 1.00 42.97 ? 30 VAL A CA 1 ATOM 195 C C . VAL A 1 30 ? 7.843 -109.401 -43.911 1.00 43.31 ? 30 VAL A C 1 ATOM 196 O O . VAL A 1 30 ? 8.810 -109.464 -43.139 1.00 43.35 ? 30 VAL A O 1 ATOM 197 C CB . VAL A 1 30 ? 7.882 -107.096 -44.989 1.00 42.81 ? 30 VAL A CB 1 ATOM 198 C CG1 . VAL A 1 30 ? 8.159 -107.694 -46.327 1.00 42.53 ? 30 VAL A CG1 1 ATOM 199 C CG2 . VAL A 1 30 ? 7.115 -105.807 -45.191 1.00 42.57 ? 30 VAL A CG2 1 ATOM 200 N N . TRP A 1 31 ? 7.391 -110.434 -44.626 1.00 43.37 ? 31 TRP A N 1 ATOM 201 C CA . TRP A 1 31 ? 7.917 -111.787 -44.513 1.00 43.24 ? 31 TRP A CA 1 ATOM 202 C C . TRP A 1 31 ? 8.387 -112.290 -45.853 1.00 43.51 ? 31 TRP A C 1 ATOM 203 O O . TRP A 1 31 ? 7.611 -112.346 -46.805 1.00 43.63 ? 31 TRP A O 1 ATOM 204 C CB . TRP A 1 31 ? 6.823 -112.743 -44.043 1.00 43.13 ? 31 TRP A CB 1 ATOM 205 C CG . TRP A 1 31 ? 6.232 -112.403 -42.740 1.00 42.46 ? 31 TRP A CG 1 ATOM 206 C CD1 . TRP A 1 31 ? 5.183 -111.576 -42.515 1.00 42.09 ? 31 TRP A CD1 1 ATOM 207 C CD2 . TRP A 1 31 ? 6.646 -112.889 -41.464 1.00 42.65 ? 31 TRP A CD2 1 ATOM 208 N NE1 . TRP A 1 31 ? 4.912 -111.506 -41.174 1.00 42.31 ? 31 TRP A NE1 1 ATOM 209 C CE2 . TRP A 1 31 ? 5.797 -112.304 -40.503 1.00 42.71 ? 31 TRP A CE2 1 ATOM 210 C CE3 . TRP A 1 31 ? 7.658 -113.760 -41.035 1.00 42.99 ? 31 TRP A CE3 1 ATOM 211 C CZ2 . TRP A 1 31 ? 5.925 -112.557 -39.134 1.00 42.79 ? 31 TRP A CZ2 1 ATOM 212 C CZ3 . TRP A 1 31 ? 7.783 -114.018 -39.675 1.00 42.99 ? 31 TRP A CZ3 1 ATOM 213 C CH2 . TRP A 1 31 ? 6.919 -113.416 -38.741 1.00 43.22 ? 31 TRP A CH2 1 ATOM 214 N N . LEU A 1 32 ? 9.657 -112.663 -45.926 1.00 43.91 ? 32 LEU A N 1 ATOM 215 C CA . LEU A 1 32 ? 10.141 -113.478 -47.028 1.00 44.29 ? 32 LEU A CA 1 ATOM 216 C C . LEU A 1 32 ? 10.230 -114.885 -46.471 1.00 44.67 ? 32 LEU A C 1 ATOM 217 O O . LEU A 1 32 ? 10.822 -115.085 -45.407 1.00 44.96 ? 32 LEU A O 1 ATOM 218 C CB . LEU A 1 32 ? 11.501 -112.983 -47.517 1.00 44.04 ? 32 LEU A CB 1 ATOM 219 C CG . LEU A 1 32 ? 12.428 -113.953 -48.251 1.00 44.16 ? 32 LEU A CG 1 ATOM 220 C CD1 . LEU A 1 32 ? 11.840 -114.515 -49.558 1.00 43.42 ? 32 LEU A CD1 1 ATOM 221 C CD2 . LEU A 1 32 ? 13.764 -113.265 -48.493 1.00 44.69 ? 32 LEU A CD2 1 ATOM 222 N N . GLY A 1 33 ? 9.635 -115.852 -47.170 1.00 44.98 ? 33 GLY A N 1 ATOM 223 C CA . GLY A 1 33 ? 9.470 -117.196 -46.616 1.00 45.42 ? 33 GLY A CA 1 ATOM 224 C C . GLY A 1 33 ? 8.857 -117.023 -45.243 1.00 45.83 ? 33 GLY A C 1 ATOM 225 O O . GLY A 1 33 ? 7.848 -116.322 -45.103 1.00 45.78 ? 33 GLY A O 1 ATOM 226 N N . ASP A 1 34 ? 9.480 -117.606 -44.221 1.00 46.21 ? 34 ASP A N 1 ATOM 227 C CA . ASP A 1 34 ? 9.005 -117.389 -42.852 1.00 46.80 ? 34 ASP A CA 1 ATOM 228 C C . ASP A 1 34 ? 9.950 -116.558 -41.981 1.00 46.78 ? 34 ASP A C 1 ATOM 229 O O . ASP A 1 34 ? 9.861 -116.596 -40.756 1.00 47.09 ? 34 ASP A O 1 ATOM 230 C CB . ASP A 1 34 ? 8.629 -118.711 -42.170 1.00 46.93 ? 34 ASP A CB 1 ATOM 231 C CG . ASP A 1 34 ? 9.766 -119.710 -42.163 1.00 48.69 ? 34 ASP A CG 1 ATOM 232 O OD1 . ASP A 1 34 ? 10.916 -119.303 -41.885 1.00 50.42 ? 34 ASP A OD1 1 ATOM 233 O OD2 . ASP A 1 34 ? 9.510 -120.910 -42.430 1.00 50.88 ? 34 ASP A OD2 1 ATOM 234 N N . LEU A 1 35 ? 10.842 -115.801 -42.613 1.00 46.78 ? 35 LEU A N 1 ATOM 235 C CA . LEU A 1 35 ? 11.709 -114.873 -41.892 1.00 46.77 ? 35 LEU A CA 1 ATOM 236 C C . LEU A 1 35 ? 11.250 -113.445 -42.105 1.00 46.77 ? 35 LEU A C 1 ATOM 237 O O . LEU A 1 35 ? 11.153 -112.987 -43.250 1.00 46.92 ? 35 LEU A O 1 ATOM 238 C CB . LEU A 1 35 ? 13.155 -114.991 -42.370 1.00 46.94 ? 35 LEU A CB 1 ATOM 239 C CG . LEU A 1 35 ? 14.027 -116.183 -41.979 1.00 47.20 ? 35 LEU A CG 1 ATOM 240 C CD1 . LEU A 1 35 ? 15.487 -115.855 -42.234 1.00 47.06 ? 35 LEU A CD1 1 ATOM 241 C CD2 . LEU A 1 35 ? 13.825 -116.564 -40.526 1.00 48.04 ? 35 LEU A CD2 1 ATOM 242 N N . GLN A 1 36 ? 10.984 -112.735 -41.009 1.00 46.61 ? 36 GLN A N 1 ATOM 243 C CA . GLN A 1 36 ? 10.509 -111.354 -41.096 1.00 46.45 ? 36 GLN A CA 1 ATOM 244 C C . GLN A 1 36 ? 11.625 -110.423 -41.544 1.00 46.57 ? 36 GLN A C 1 ATOM 245 O O . GLN A 1 36 ? 12.705 -110.409 -40.951 1.00 46.52 ? 36 GLN A O 1 ATOM 246 C CB . GLN A 1 36 ? 9.923 -110.876 -39.767 1.00 46.37 ? 36 GLN A CB 1 ATOM 247 C CG . GLN A 1 36 ? 9.344 -109.466 -39.840 1.00 45.81 ? 36 GLN A CG 1 ATOM 248 C CD . GLN A 1 36 ? 9.082 -108.853 -38.487 1.00 44.49 ? 36 GLN A CD 1 ATOM 249 O OE1 . GLN A 1 36 ? 9.625 -109.296 -37.474 1.00 45.03 ? 36 GLN A OE1 1 ATOM 250 N NE2 . GLN A 1 36 ? 8.246 -107.821 -38.461 1.00 42.74 ? 36 GLN A NE2 1 ATOM 251 N N . THR A 1 37 ? 11.348 -109.642 -42.586 1.00 46.74 ? 37 THR A N 1 ATOM 252 C CA . THR A 1 37 ? 12.352 -108.765 -43.188 1.00 46.81 ? 37 THR A CA 1 ATOM 253 C C . THR A 1 37 ? 12.167 -107.310 -42.791 1.00 46.89 ? 37 THR A C 1 ATOM 254 O O . THR A 1 37 ? 13.145 -106.628 -42.503 1.00 46.86 ? 37 THR A O 1 ATOM 255 C CB . THR A 1 37 ? 12.344 -108.848 -44.714 1.00 46.66 ? 37 THR A CB 1 ATOM 256 O OG1 . THR A 1 37 ? 11.133 -108.273 -45.207 1.00 46.82 ? 37 THR A OG1 1 ATOM 257 C CG2 . THR A 1 37 ? 12.427 -110.281 -45.170 1.00 46.79 ? 37 THR A CG2 1 ATOM 258 N N . HIS A 1 38 ? 10.922 -106.839 -42.773 1.00 47.18 ? 38 HIS A N 1 ATOM 259 C CA . HIS A 1 38 ? 10.646 -105.434 -42.448 1.00 47.68 ? 38 HIS A CA 1 ATOM 260 C C . HIS A 1 38 ? 9.575 -105.241 -41.356 1.00 47.95 ? 38 HIS A C 1 ATOM 261 O O . HIS A 1 38 ? 8.831 -106.171 -41.025 1.00 47.84 ? 38 HIS A O 1 ATOM 262 C CB . HIS A 1 38 ? 10.297 -104.637 -43.718 1.00 47.57 ? 38 HIS A CB 1 ATOM 263 C CG . HIS A 1 38 ? 11.360 -104.681 -44.776 1.00 47.74 ? 38 HIS A CG 1 ATOM 264 N ND1 . HIS A 1 38 ? 11.532 -105.761 -45.616 1.00 47.60 ? 38 HIS A ND1 1 ATOM 265 C CD2 . HIS A 1 38 ? 12.302 -103.775 -45.133 1.00 48.02 ? 38 HIS A CD2 1 ATOM 266 C CE1 . HIS A 1 38 ? 12.538 -105.522 -46.440 1.00 47.59 ? 38 HIS A CE1 1 ATOM 267 N NE2 . HIS A 1 38 ? 13.022 -104.323 -46.169 1.00 47.86 ? 38 HIS A NE2 1 ATOM 268 N N . ARG A 1 39 ? 9.522 -104.032 -40.798 1.00 48.36 ? 39 ARG A N 1 ATOM 269 C CA . ARG A 1 39 ? 8.566 -103.681 -39.749 1.00 49.15 ? 39 ARG A CA 1 ATOM 270 C C . ARG A 1 39 ? 8.142 -102.226 -39.888 1.00 49.57 ? 39 ARG A C 1 ATOM 271 O O . ARG A 1 39 ? 8.993 -101.345 -39.943 1.00 49.89 ? 39 ARG A O 1 ATOM 272 C CB . ARG A 1 39 ? 9.194 -103.898 -38.370 1.00 49.12 ? 39 ARG A CB 1 ATOM 273 C CG . ARG A 1 39 ? 8.499 -103.178 -37.201 1.00 49.93 ? 39 ARG A CG 1 ATOM 274 C CD . ARG A 1 39 ? 9.323 -103.274 -35.924 1.00 51.30 ? 39 ARG A CD 1 ATOM 275 N NE . ARG A 1 39 ? 9.723 -104.659 -35.685 1.00 53.07 ? 39 ARG A NE 1 ATOM 276 C CZ . ARG A 1 39 ? 10.918 -105.044 -35.245 1.00 54.31 ? 39 ARG A CZ 1 ATOM 277 N NH1 . ARG A 1 39 ? 11.864 -104.145 -34.977 1.00 54.54 ? 39 ARG A NH1 1 ATOM 278 N NH2 . ARG A 1 39 ? 11.169 -106.339 -35.081 1.00 54.42 ? 39 ARG A NH2 1 ATOM 279 N N . TRP A 1 40 ? 6.840 -101.967 -39.926 1.00 50.07 ? 40 TRP A N 1 ATOM 280 C CA . TRP A 1 40 ? 6.374 -100.589 -40.020 1.00 50.78 ? 40 TRP A CA 1 ATOM 281 C C . TRP A 1 40 ? 5.258 -100.216 -39.033 1.00 51.45 ? 40 TRP A C 1 ATOM 282 O O . TRP A 1 40 ? 4.060 -100.255 -39.353 1.00 51.59 ? 40 TRP A O 1 ATOM 283 C CB . TRP A 1 40 ? 6.012 -100.228 -41.463 1.00 50.72 ? 40 TRP A CB 1 ATOM 284 C CG . TRP A 1 40 ? 5.962 -98.749 -41.715 1.00 50.44 ? 40 TRP A CG 1 ATOM 285 C CD1 . TRP A 1 40 ? 6.562 -97.763 -40.977 1.00 50.30 ? 40 TRP A CD1 1 ATOM 286 C CD2 . TRP A 1 40 ? 5.309 -98.095 -42.797 1.00 50.34 ? 40 TRP A CD2 1 ATOM 287 N NE1 . TRP A 1 40 ? 6.303 -96.538 -41.524 1.00 50.03 ? 40 TRP A NE1 1 ATOM 288 C CE2 . TRP A 1 40 ? 5.540 -96.710 -42.648 1.00 50.35 ? 40 TRP A CE2 1 ATOM 289 C CE3 . TRP A 1 40 ? 4.543 -98.541 -43.880 1.00 50.73 ? 40 TRP A CE3 1 ATOM 290 C CZ2 . TRP A 1 40 ? 5.029 -95.764 -43.543 1.00 50.90 ? 40 TRP A CZ2 1 ATOM 291 C CZ3 . TRP A 1 40 ? 4.032 -97.599 -44.770 1.00 50.83 ? 40 TRP A CZ3 1 ATOM 292 C CH2 . TRP A 1 40 ? 4.276 -96.228 -44.593 1.00 50.80 ? 40 TRP A CH2 1 ATOM 293 N N . SER A 1 41 ? 5.696 -99.831 -37.838 1.00 52.06 ? 41 SER A N 1 ATOM 294 C CA . SER A 1 41 ? 4.825 -99.432 -36.738 1.00 52.66 ? 41 SER A CA 1 ATOM 295 C C . SER A 1 41 ? 4.181 -98.063 -37.015 1.00 52.88 ? 41 SER A C 1 ATOM 296 O O . SER A 1 41 ? 4.848 -97.165 -37.537 1.00 52.85 ? 41 SER A O 1 ATOM 297 C CB . SER A 1 41 ? 5.660 -99.412 -35.447 1.00 52.73 ? 41 SER A CB 1 ATOM 298 O OG . SER A 1 41 ? 4.899 -99.045 -34.309 1.00 53.22 ? 41 SER A OG 1 ATOM 299 N N . ASN A 1 42 ? 2.893 -97.914 -36.675 1.00 53.40 ? 42 ASN A N 1 ATOM 300 C CA . ASN A 1 42 ? 2.130 -96.667 -36.926 1.00 53.99 ? 42 ASN A CA 1 ATOM 301 C C . ASN A 1 42 ? 2.935 -95.426 -36.566 1.00 53.87 ? 42 ASN A C 1 ATOM 302 O O . ASN A 1 42 ? 3.006 -94.471 -37.343 1.00 53.83 ? 42 ASN A O 1 ATOM 303 C CB . ASN A 1 42 ? 0.778 -96.645 -36.170 1.00 54.32 ? 42 ASN A CB 1 ATOM 304 C CG . ASN A 1 42 ? -0.122 -95.453 -36.573 1.00 55.72 ? 42 ASN A CG 1 ATOM 305 O OD1 . ASN A 1 42 ? -0.806 -95.507 -37.597 1.00 56.79 ? 42 ASN A OD1 1 ATOM 306 N ND2 . ASN A 1 42 ? -0.129 -94.389 -35.760 1.00 57.40 ? 42 ASN A ND2 1 ATOM 307 N N . ASP A 1 43 ? 3.556 -95.471 -35.392 1.00 53.79 ? 43 ASP A N 1 ATOM 308 C CA . ASP A 1 43 ? 4.232 -94.316 -34.823 1.00 53.85 ? 43 ASP A CA 1 ATOM 309 C C . ASP A 1 43 ? 5.582 -94.023 -35.466 1.00 53.59 ? 43 ASP A C 1 ATOM 310 O O . ASP A 1 43 ? 6.151 -92.954 -35.254 1.00 53.57 ? 43 ASP A O 1 ATOM 311 C CB . ASP A 1 43 ? 4.363 -94.463 -33.302 1.00 54.04 ? 43 ASP A CB 1 ATOM 312 C CG . ASP A 1 43 ? 4.956 -95.799 -32.881 1.00 54.82 ? 43 ASP A CG 1 ATOM 313 O OD1 . ASP A 1 43 ? 4.846 -96.122 -31.682 1.00 55.63 ? 43 ASP A OD1 1 ATOM 314 O OD2 . ASP A 1 43 ? 5.536 -96.522 -33.724 1.00 55.65 ? 43 ASP A OD2 1 ATOM 315 N N . SER A 1 44 ? 6.099 -94.965 -36.246 1.00 53.43 ? 44 SER A N 1 ATOM 316 C CA . SER A 1 44 ? 7.304 -94.694 -37.016 1.00 53.27 ? 44 SER A CA 1 ATOM 317 C C . SER A 1 44 ? 6.931 -94.098 -38.349 1.00 52.95 ? 44 SER A C 1 ATOM 318 O O . SER A 1 44 ? 6.002 -94.570 -39.007 1.00 52.87 ? 44 SER A O 1 ATOM 319 C CB . SER A 1 44 ? 8.138 -95.948 -37.250 1.00 53.42 ? 44 SER A CB 1 ATOM 320 O OG . SER A 1 44 ? 9.316 -95.607 -37.963 1.00 53.80 ? 44 SER A OG 1 ATOM 321 N N . ALA A 1 45 ? 7.668 -93.064 -38.738 1.00 52.60 ? 45 ALA A N 1 ATOM 322 C CA . ALA A 1 45 ? 7.512 -92.463 -40.052 1.00 52.29 ? 45 ALA A CA 1 ATOM 323 C C . ALA A 1 45 ? 8.197 -93.332 -41.100 1.00 52.11 ? 45 ALA A C 1 ATOM 324 O O . ALA A 1 45 ? 7.797 -93.326 -42.265 1.00 52.00 ? 45 ALA A O 1 ATOM 325 C CB . ALA A 1 45 ? 8.078 -91.055 -40.069 1.00 52.28 ? 45 ALA A CB 1 ATOM 326 N N . THR A 1 46 ? 9.206 -94.093 -40.668 1.00 51.92 ? 46 THR A N 1 ATOM 327 C CA . THR A 1 46 ? 10.016 -94.923 -41.568 1.00 51.76 ? 46 THR A CA 1 ATOM 328 C C . THR A 1 46 ? 9.916 -96.428 -41.319 1.00 51.65 ? 46 THR A C 1 ATOM 329 O O . THR A 1 46 ? 9.776 -96.888 -40.186 1.00 51.53 ? 46 THR A O 1 ATOM 330 C CB . THR A 1 46 ? 11.511 -94.539 -41.504 1.00 51.84 ? 46 THR A CB 1 ATOM 331 O OG1 . THR A 1 46 ? 11.977 -94.647 -40.153 1.00 51.63 ? 46 THR A OG1 1 ATOM 332 C CG2 . THR A 1 46 ? 11.737 -93.116 -42.019 1.00 51.88 ? 46 THR A CG2 1 ATOM 333 N N . ILE A 1 47 ? 10.009 -97.180 -42.410 1.00 51.71 ? 47 ILE A N 1 ATOM 334 C CA . ILE A 1 47 ? 10.061 -98.638 -42.390 1.00 51.72 ? 47 ILE A CA 1 ATOM 335 C C . ILE A 1 47 ? 11.413 -99.098 -41.854 1.00 51.88 ? 47 ILE A C 1 ATOM 336 O O . ILE A 1 47 ? 12.459 -98.610 -42.280 1.00 52.00 ? 47 ILE A O 1 ATOM 337 C CB . ILE A 1 47 ? 9.840 -99.213 -43.807 1.00 51.59 ? 47 ILE A CB 1 ATOM 338 C CG1 . ILE A 1 47 ? 8.447 -98.850 -44.318 1.00 51.31 ? 47 ILE A CG1 1 ATOM 339 C CG2 . ILE A 1 47 ? 10.039 -100.724 -43.831 1.00 51.85 ? 47 ILE A CG2 1 ATOM 340 C CD1 . ILE A 1 47 ? 8.368 -98.751 -45.815 1.00 51.72 ? 47 ILE A CD1 1 ATOM 341 N N . SER A 1 48 ? 11.378 -100.046 -40.927 1.00 52.02 ? 48 SER A N 1 ATOM 342 C CA . SER A 1 48 ? 12.575 -100.520 -40.257 1.00 52.23 ? 48 SER A CA 1 ATOM 343 C C . SER A 1 48 ? 12.964 -101.903 -40.746 1.00 52.51 ? 48 SER A C 1 ATOM 344 O O . SER A 1 48 ? 12.123 -102.799 -40.846 1.00 52.60 ? 48 SER A O 1 ATOM 345 C CB . SER A 1 48 ? 12.336 -100.553 -38.755 1.00 52.00 ? 48 SER A CB 1 ATOM 346 O OG . SER A 1 48 ? 11.482 -99.485 -38.387 1.00 52.28 ? 48 SER A OG 1 ATOM 347 N N . PHE A 1 49 ? 14.245 -102.062 -41.056 1.00 52.87 ? 49 PHE A N 1 ATOM 348 C CA . PHE A 1 49 ? 14.814 -103.362 -41.379 1.00 53.31 ? 49 PHE A CA 1 ATOM 349 C C . PHE A 1 49 ? 14.883 -104.249 -40.128 1.00 53.62 ? 49 PHE A C 1 ATOM 350 O O . PHE A 1 49 ? 15.202 -103.774 -39.031 1.00 53.85 ? 49 PHE A O 1 ATOM 351 C CB . PHE A 1 49 ? 16.227 -103.195 -41.948 1.00 53.47 ? 49 PHE A CB 1 ATOM 352 C CG . PHE A 1 49 ? 16.326 -102.240 -43.115 1.00 53.76 ? 49 PHE A CG 1 ATOM 353 C CD1 . PHE A 1 49 ? 17.354 -101.302 -43.167 1.00 53.64 ? 49 PHE A CD1 1 ATOM 354 C CD2 . PHE A 1 49 ? 15.411 -102.288 -44.167 1.00 53.89 ? 49 PHE A CD2 1 ATOM 355 C CE1 . PHE A 1 49 ? 17.468 -100.429 -44.238 1.00 53.39 ? 49 PHE A CE1 1 ATOM 356 C CE2 . PHE A 1 49 ? 15.516 -101.416 -45.236 1.00 53.62 ? 49 PHE A CE2 1 ATOM 357 C CZ . PHE A 1 49 ? 16.546 -100.484 -45.271 1.00 53.47 ? 49 PHE A CZ 1 ATOM 358 N N . THR A 1 50 ? 14.588 -105.535 -40.292 1.00 53.82 ? 50 THR A N 1 ATOM 359 C CA . THR A 1 50 ? 14.733 -106.489 -39.197 1.00 54.02 ? 50 THR A CA 1 ATOM 360 C C . THR A 1 50 ? 15.843 -107.488 -39.500 1.00 54.32 ? 50 THR A C 1 ATOM 361 O O . THR A 1 50 ? 16.082 -108.425 -38.729 1.00 54.42 ? 50 THR A O 1 ATOM 362 C CB . THR A 1 50 ? 13.428 -107.239 -38.915 1.00 54.04 ? 50 THR A CB 1 ATOM 363 O OG1 . THR A 1 50 ? 12.976 -107.875 -40.113 1.00 54.01 ? 50 THR A OG1 1 ATOM 364 C CG2 . THR A 1 50 ? 12.358 -106.285 -38.405 1.00 53.91 ? 50 THR A CG2 1 ATOM 365 N N . LYS A 1 51 ? 16.506 -107.278 -40.635 1.00 54.56 ? 51 LYS A N 1 ATOM 366 C CA . LYS A 1 51 ? 17.686 -108.041 -41.027 1.00 54.82 ? 51 LYS A CA 1 ATOM 367 C C . LYS A 1 51 ? 18.776 -107.080 -41.496 1.00 54.99 ? 51 LYS A C 1 ATOM 368 O O . LYS A 1 51 ? 18.477 -105.953 -41.891 1.00 54.98 ? 51 LYS A O 1 ATOM 369 C CB . LYS A 1 51 ? 17.339 -109.010 -42.153 1.00 54.83 ? 51 LYS A CB 1 ATOM 370 C CG . LYS A 1 51 ? 16.342 -110.091 -41.772 1.00 55.12 ? 51 LYS A CG 1 ATOM 371 C CD . LYS A 1 51 ? 17.034 -111.330 -41.224 1.00 55.27 ? 51 LYS A CD 1 ATOM 372 C CE . LYS A 1 51 ? 16.021 -112.291 -40.644 1.00 55.16 ? 51 LYS A CE 1 ATOM 373 N NZ . LYS A 1 51 ? 15.295 -111.643 -39.515 1.00 55.34 ? 51 LYS A NZ 1 ATOM 374 N N . PRO A 1 52 ? 20.049 -107.512 -41.453 1.00 55.19 ? 52 PRO A N 1 ATOM 375 C CA . PRO A 1 52 ? 21.034 -106.619 -42.035 1.00 55.30 ? 52 PRO A CA 1 ATOM 376 C C . PRO A 1 52 ? 20.718 -106.410 -43.511 1.00 55.47 ? 52 PRO A C 1 ATOM 377 O O . PRO A 1 52 ? 20.814 -105.295 -44.004 1.00 55.74 ? 52 PRO A O 1 ATOM 378 C CB . PRO A 1 52 ? 22.351 -107.390 -41.880 1.00 55.32 ? 52 PRO A CB 1 ATOM 379 C CG . PRO A 1 52 ? 22.094 -108.408 -40.832 1.00 55.19 ? 52 PRO A CG 1 ATOM 380 C CD . PRO A 1 52 ? 20.655 -108.763 -40.960 1.00 55.22 ? 52 PRO A CD 1 ATOM 381 N N . TRP A 1 53 ? 20.292 -107.471 -44.188 1.00 55.52 ? 53 TRP A N 1 ATOM 382 C CA . TRP A 1 53 ? 20.155 -107.459 -45.641 1.00 55.76 ? 53 TRP A CA 1 ATOM 383 C C . TRP A 1 53 ? 18.797 -107.001 -46.166 1.00 55.72 ? 53 TRP A C 1 ATOM 384 O O . TRP A 1 53 ? 18.447 -107.285 -47.313 1.00 55.63 ? 53 TRP A O 1 ATOM 385 C CB . TRP A 1 53 ? 20.474 -108.842 -46.193 1.00 55.89 ? 53 TRP A CB 1 ATOM 386 C CG . TRP A 1 53 ? 19.843 -109.950 -45.423 1.00 56.46 ? 53 TRP A CG 1 ATOM 387 C CD1 . TRP A 1 53 ? 20.374 -110.608 -44.349 1.00 57.15 ? 53 TRP A CD1 1 ATOM 388 C CD2 . TRP A 1 53 ? 18.563 -110.536 -45.659 1.00 56.95 ? 53 TRP A CD2 1 ATOM 389 N NE1 . TRP A 1 53 ? 19.504 -111.571 -43.903 1.00 57.33 ? 53 TRP A NE1 1 ATOM 390 C CE2 . TRP A 1 53 ? 18.383 -111.550 -44.689 1.00 57.23 ? 53 TRP A CE2 1 ATOM 391 C CE3 . TRP A 1 53 ? 17.548 -110.307 -46.597 1.00 57.09 ? 53 TRP A CE3 1 ATOM 392 C CZ2 . TRP A 1 53 ? 17.226 -112.333 -44.630 1.00 57.03 ? 53 TRP A CZ2 1 ATOM 393 C CZ3 . TRP A 1 53 ? 16.395 -111.087 -46.536 1.00 56.98 ? 53 TRP A CZ3 1 ATOM 394 C CH2 . TRP A 1 53 ? 16.246 -112.087 -45.558 1.00 56.98 ? 53 TRP A CH2 1 ATOM 395 N N . SER A 1 54 ? 18.048 -106.277 -45.340 1.00 55.81 ? 54 SER A N 1 ATOM 396 C CA . SER A 1 54 ? 16.658 -105.944 -45.655 1.00 55.83 ? 54 SER A CA 1 ATOM 397 C C . SER A 1 54 ? 16.503 -105.016 -46.855 1.00 56.03 ? 54 SER A C 1 ATOM 398 O O . SER A 1 54 ? 15.513 -105.110 -47.584 1.00 56.15 ? 54 SER A O 1 ATOM 399 C CB . SER A 1 54 ? 15.945 -105.340 -44.448 1.00 55.61 ? 54 SER A CB 1 ATOM 400 O OG . SER A 1 54 ? 16.043 -106.163 -43.306 1.00 55.26 ? 54 SER A OG 1 ATOM 401 N N . GLN A 1 55 ? 17.471 -104.128 -47.064 1.00 56.18 ? 55 GLN A N 1 ATOM 402 C CA . GLN A 1 55 ? 17.394 -103.195 -48.181 1.00 56.42 ? 55 GLN A CA 1 ATOM 403 C C . GLN A 1 55 ? 17.541 -103.923 -49.511 1.00 56.75 ? 55 GLN A C 1 ATOM 404 O O . GLN A 1 55 ? 17.360 -103.328 -50.570 1.00 56.78 ? 55 GLN A O 1 ATOM 405 C CB . GLN A 1 55 ? 18.437 -102.085 -48.050 1.00 56.48 ? 55 GLN A CB 1 ATOM 406 C CG . GLN A 1 55 ? 18.066 -100.806 -48.810 1.00 56.56 ? 55 GLN A CG 1 ATOM 407 C CD . GLN A 1 55 ? 19.095 -99.701 -48.658 1.00 56.71 ? 55 GLN A CD 1 ATOM 408 O OE1 . GLN A 1 55 ? 19.419 -99.282 -47.545 1.00 56.80 ? 55 GLN A OE1 1 ATOM 409 N NE2 . GLN A 1 55 ? 19.606 -99.213 -49.784 1.00 56.39 ? 55 GLN A NE2 1 ATOM 410 N N . GLY A 1 56 ? 17.851 -105.217 -49.447 1.00 57.25 ? 56 GLY A N 1 ATOM 411 C CA . GLY A 1 56 ? 18.020 -106.035 -50.643 1.00 57.72 ? 56 GLY A CA 1 ATOM 412 C C . GLY A 1 56 ? 19.140 -105.419 -51.452 1.00 58.10 ? 56 GLY A C 1 ATOM 413 O O . GLY A 1 56 ? 20.149 -104.973 -50.884 1.00 58.00 ? 56 GLY A O 1 ATOM 414 N N . LYS A 1 57 ? 18.980 -105.379 -52.771 1.00 58.41 ? 57 LYS A N 1 ATOM 415 C CA . LYS A 1 57 ? 20.008 -104.831 -53.656 1.00 58.69 ? 57 LYS A CA 1 ATOM 416 C C . LYS A 1 57 ? 19.767 -103.380 -54.126 1.00 58.77 ? 57 LYS A C 1 ATOM 417 O O . LYS A 1 57 ? 20.482 -102.860 -54.982 1.00 58.99 ? 57 LYS A O 1 ATOM 418 C CB . LYS A 1 57 ? 20.153 -105.693 -54.914 1.00 58.70 ? 57 LYS A CB 1 ATOM 419 C CG . LYS A 1 57 ? 20.583 -107.125 -54.639 1.00 59.10 ? 57 LYS A CG 1 ATOM 420 C CD . LYS A 1 57 ? 21.974 -107.176 -54.028 1.00 59.06 ? 57 LYS A CD 1 ATOM 421 C CE . LYS A 1 57 ? 22.433 -108.610 -53.821 0.00 64.70 ? 57 LYS A CE 1 ATOM 422 N NZ . LYS A 1 57 ? 23.785 -108.677 -53.200 1.00 48.91 ? 57 LYS A NZ 1 ATOM 423 N N . LEU A 1 58 ? 18.748 -102.740 -53.560 1.00 58.77 ? 58 LEU A N 1 ATOM 424 C CA . LEU A 1 58 ? 18.322 -101.419 -54.023 1.00 58.80 ? 58 LEU A CA 1 ATOM 425 C C . LEU A 1 58 ? 19.246 -100.396 -53.403 1.00 59.02 ? 58 LEU A C 1 ATOM 426 O O . LEU A 1 58 ? 19.693 -100.567 -52.269 1.00 59.23 ? 58 LEU A O 1 ATOM 427 C CB . LEU A 1 58 ? 16.885 -101.072 -53.653 1.00 58.65 ? 58 LEU A CB 1 ATOM 428 C CG . LEU A 1 58 ? 15.739 -101.948 -54.156 1.00 58.49 ? 58 LEU A CG 1 ATOM 429 C CD1 . LEU A 1 58 ? 14.447 -101.227 -53.853 1.00 58.06 ? 58 LEU A CD1 1 ATOM 430 C CD2 . LEU A 1 58 ? 15.836 -102.306 -55.648 1.00 57.93 ? 58 LEU A CD2 1 ATOM 431 N N . SER A 1 59 ? 19.515 -99.328 -54.150 1.00 59.27 ? 59 SER A N 1 ATOM 432 C CA . SER A 1 59 ? 20.366 -98.234 -53.683 1.00 59.66 ? 59 SER A CA 1 ATOM 433 C C . SER A 1 59 ? 19.655 -97.393 -52.621 1.00 59.84 ? 59 SER A C 1 ATOM 434 O O . SER A 1 59 ? 18.437 -97.491 -52.465 1.00 59.91 ? 59 SER A O 1 ATOM 435 C CB . SER A 1 59 ? 20.791 -97.353 -54.861 1.00 59.72 ? 59 SER A CB 1 ATOM 436 O OG . SER A 1 59 ? 19.677 -96.696 -55.442 1.00 59.87 ? 59 SER A OG 1 ATOM 437 N N . ASN A 1 60 ? 20.411 -96.568 -51.899 1.00 59.95 ? 60 ASN A N 1 ATOM 438 C CA . ASN A 1 60 ? 19.830 -95.721 -50.861 1.00 60.17 ? 60 ASN A CA 1 ATOM 439 C C . ASN A 1 60 ? 18.683 -94.849 -51.351 1.00 60.36 ? 60 ASN A C 1 ATOM 440 O O . ASN A 1 60 ? 17.653 -94.747 -50.680 1.00 60.45 ? 60 ASN A O 1 ATOM 441 C CB . ASN A 1 60 ? 20.896 -94.873 -50.178 1.00 60.15 ? 60 ASN A CB 1 ATOM 442 C CG . ASN A 1 60 ? 21.494 -95.560 -48.965 1.00 60.55 ? 60 ASN A CG 1 ATOM 443 O OD1 . ASN A 1 60 ? 21.550 -96.789 -48.889 1.00 60.80 ? 60 ASN A OD1 1 ATOM 444 N ND2 . ASN A 1 60 ? 21.946 -94.765 -48.004 1.00 60.93 ? 60 ASN A ND2 1 ATOM 445 N N . GLN A 1 61 ? 18.849 -94.234 -52.520 1.00 60.58 ? 61 GLN A N 1 ATOM 446 C CA . GLN A 1 61 ? 17.768 -93.418 -53.086 1.00 60.75 ? 61 GLN A CA 1 ATOM 447 C C . GLN A 1 61 ? 16.666 -94.250 -53.773 1.00 60.51 ? 61 GLN A C 1 ATOM 448 O O . GLN A 1 61 ? 15.494 -93.864 -53.723 1.00 60.73 ? 61 GLN A O 1 ATOM 449 C CB . GLN A 1 61 ? 18.290 -92.258 -53.966 1.00 60.95 ? 61 GLN A CB 1 ATOM 450 C CG . GLN A 1 61 ? 18.954 -92.644 -55.293 1.00 61.41 ? 61 GLN A CG 1 ATOM 451 C CD . GLN A 1 61 ? 19.685 -91.475 -55.940 1.00 61.80 ? 61 GLN A CD 1 ATOM 452 O OE1 . GLN A 1 61 ? 20.375 -90.708 -55.265 1.00 62.41 ? 61 GLN A OE1 1 ATOM 453 N NE2 . GLN A 1 61 ? 19.541 -91.338 -57.251 1.00 61.82 ? 61 GLN A NE2 1 ATOM 454 N N . GLN A 1 62 ? 17.030 -95.381 -54.389 1.00 59.94 ? 62 GLN A N 1 ATOM 455 C CA . GLN A 1 62 ? 16.036 -96.333 -54.899 1.00 59.44 ? 62 GLN A CA 1 ATOM 456 C C . GLN A 1 62 ? 15.067 -96.698 -53.787 1.00 59.11 ? 62 GLN A C 1 ATOM 457 O O . GLN A 1 62 ? 13.852 -96.712 -53.987 1.00 58.88 ? 62 GLN A O 1 ATOM 458 C CB . GLN A 1 62 ? 16.704 -97.611 -55.393 1.00 59.46 ? 62 GLN A CB 1 ATOM 459 C CG . GLN A 1 62 ? 16.803 -97.764 -56.894 1.00 60.01 ? 62 GLN A CG 1 ATOM 460 C CD . GLN A 1 62 ? 17.578 -99.017 -57.284 1.00 61.12 ? 62 GLN A CD 1 ATOM 461 O OE1 . GLN A 1 62 ? 18.591 -99.351 -56.666 1.00 61.41 ? 62 GLN A OE1 1 ATOM 462 N NE2 . GLN A 1 62 ? 17.102 -99.717 -58.314 1.00 61.56 ? 62 GLN A NE2 1 ATOM 463 N N . TRP A 1 63 ? 15.635 -96.987 -52.613 1.00 58.89 ? 63 TRP A N 1 ATOM 464 C CA . TRP A 1 63 ? 14.883 -97.359 -51.416 1.00 58.44 ? 63 TRP A CA 1 ATOM 465 C C . TRP A 1 63 ? 14.040 -96.196 -50.940 1.00 58.17 ? 63 TRP A C 1 ATOM 466 O O . TRP A 1 63 ? 12.870 -96.366 -50.610 1.00 58.19 ? 63 TRP A O 1 ATOM 467 C CB . TRP A 1 63 ? 15.819 -97.820 -50.284 1.00 58.46 ? 63 TRP A CB 1 ATOM 468 C CG . TRP A 1 63 ? 15.109 -97.947 -48.959 1.00 58.03 ? 63 TRP A CG 1 ATOM 469 C CD1 . TRP A 1 63 ? 15.189 -97.090 -47.898 1.00 57.99 ? 63 TRP A CD1 1 ATOM 470 C CD2 . TRP A 1 63 ? 14.181 -98.971 -48.577 1.00 57.37 ? 63 TRP A CD2 1 ATOM 471 N NE1 . TRP A 1 63 ? 14.377 -97.523 -46.873 1.00 57.50 ? 63 TRP A NE1 1 ATOM 472 C CE2 . TRP A 1 63 ? 13.747 -98.674 -47.263 1.00 57.00 ? 63 TRP A CE2 1 ATOM 473 C CE3 . TRP A 1 63 ? 13.678 -100.114 -49.214 1.00 56.64 ? 63 TRP A CE3 1 ATOM 474 C CZ2 . TRP A 1 63 ? 12.839 -99.475 -46.576 1.00 56.57 ? 63 TRP A CZ2 1 ATOM 475 C CZ3 . TRP A 1 63 ? 12.777 -100.911 -48.532 1.00 56.20 ? 63 TRP A CZ3 1 ATOM 476 C CH2 . TRP A 1 63 ? 12.366 -100.587 -47.224 1.00 56.55 ? 63 TRP A CH2 1 ATOM 477 N N . GLU A 1 64 ? 14.646 -95.018 -50.900 1.00 57.83 ? 64 GLU A N 1 ATOM 478 C CA . GLU A 1 64 ? 13.938 -93.828 -50.485 1.00 57.70 ? 64 GLU A CA 1 ATOM 479 C C . GLU A 1 64 ? 12.716 -93.580 -51.372 1.00 57.12 ? 64 GLU A C 1 ATOM 480 O O . GLU A 1 64 ? 11.635 -93.262 -50.873 1.00 56.97 ? 64 GLU A O 1 ATOM 481 C CB . GLU A 1 64 ? 14.880 -92.624 -50.495 1.00 58.11 ? 64 GLU A CB 1 ATOM 482 C CG . GLU A 1 64 ? 14.373 -91.454 -49.667 1.00 59.67 ? 64 GLU A CG 1 ATOM 483 C CD . GLU A 1 64 ? 13.979 -91.881 -48.265 1.00 61.52 ? 64 GLU A CD 1 ATOM 484 O OE1 . GLU A 1 64 ? 14.891 -92.292 -47.516 1.00 62.47 ? 64 GLU A OE1 1 ATOM 485 O OE2 . GLU A 1 64 ? 12.769 -91.815 -47.924 1.00 61.45 ? 64 GLU A OE2 1 ATOM 486 N N . LYS A 1 65 ? 12.896 -93.744 -52.682 1.00 56.47 ? 65 LYS A N 1 ATOM 487 C CA . LYS A 1 65 ? 11.814 -93.580 -53.639 1.00 55.94 ? 65 LYS A CA 1 ATOM 488 C C . LYS A 1 65 ? 10.663 -94.457 -53.186 1.00 55.09 ? 65 LYS A C 1 ATOM 489 O O . LYS A 1 65 ? 9.542 -93.977 -53.007 1.00 55.01 ? 65 LYS A O 1 ATOM 490 C CB . LYS A 1 65 ? 12.282 -93.969 -55.044 1.00 56.25 ? 65 LYS A CB 1 ATOM 491 C CG . LYS A 1 65 ? 11.523 -93.300 -56.182 1.00 57.62 ? 65 LYS A CG 1 ATOM 492 C CD . LYS A 1 65 ? 12.474 -92.946 -57.334 1.00 60.28 ? 65 LYS A CD 1 ATOM 493 C CE . LYS A 1 65 ? 11.749 -92.279 -58.517 1.00 61.71 ? 65 LYS A CE 1 ATOM 494 N NZ . LYS A 1 65 ? 11.072 -93.278 -59.412 1.00 62.72 ? 65 LYS A NZ 1 ATOM 495 N N . LEU A 1 66 ? 10.973 -95.733 -52.959 1.00 54.14 ? 66 LEU A N 1 ATOM 496 C CA . LEU A 1 66 ? 10.006 -96.713 -52.474 1.00 53.17 ? 66 LEU A CA 1 ATOM 497 C C . LEU A 1 66 ? 9.397 -96.341 -51.143 1.00 52.54 ? 66 LEU A C 1 ATOM 498 O O . LEU A 1 66 ? 8.188 -96.459 -50.973 1.00 52.65 ? 66 LEU A O 1 ATOM 499 C CB . LEU A 1 66 ? 10.640 -98.093 -52.342 1.00 53.12 ? 66 LEU A CB 1 ATOM 500 C CG . LEU A 1 66 ? 10.300 -99.124 -53.410 1.00 53.36 ? 66 LEU A CG 1 ATOM 501 C CD1 . LEU A 1 66 ? 10.925 -100.439 -53.025 1.00 53.86 ? 66 LEU A CD1 1 ATOM 502 C CD2 . LEU A 1 66 ? 8.796 -99.293 -53.557 1.00 53.71 ? 66 LEU A CD2 1 ATOM 503 N N . GLN A 1 67 ? 10.224 -95.902 -50.197 1.00 51.63 ? 67 GLN A N 1 ATOM 504 C CA . GLN A 1 67 ? 9.717 -95.592 -48.872 1.00 50.76 ? 67 GLN A CA 1 ATOM 505 C C . GLN A 1 67 ? 8.795 -94.400 -48.947 1.00 50.44 ? 67 GLN A C 1 ATOM 506 O O . GLN A 1 67 ? 7.684 -94.445 -48.427 1.00 50.21 ? 67 GLN A O 1 ATOM 507 C CB . GLN A 1 67 ? 10.835 -95.356 -47.860 1.00 50.69 ? 67 GLN A CB 1 ATOM 508 C CG . GLN A 1 67 ? 10.368 -95.587 -46.433 1.00 50.46 ? 67 GLN A CG 1 ATOM 509 C CD . GLN A 1 67 ? 11.402 -95.240 -45.386 1.00 50.58 ? 67 GLN A CD 1 ATOM 510 O OE1 . GLN A 1 67 ? 11.856 -94.101 -45.295 1.00 51.50 ? 67 GLN A OE1 1 ATOM 511 N NE2 . GLN A 1 67 ? 11.763 -96.218 -44.570 1.00 50.28 ? 67 GLN A NE2 1 ATOM 512 N N . HIS A 1 68 ? 9.247 -93.348 -49.628 1.00 50.33 ? 68 HIS A N 1 ATOM 513 C CA . HIS A 1 68 ? 8.465 -92.116 -49.746 1.00 50.09 ? 68 HIS A CA 1 ATOM 514 C C . HIS A 1 68 ? 7.116 -92.362 -50.413 1.00 49.51 ? 68 HIS A C 1 ATOM 515 O O . HIS A 1 68 ? 6.120 -91.721 -50.071 1.00 49.46 ? 68 HIS A O 1 ATOM 516 C CB . HIS A 1 68 ? 9.231 -91.012 -50.483 1.00 50.41 ? 68 HIS A CB 1 ATOM 517 C CG . HIS A 1 68 ? 8.439 -89.749 -50.649 1.00 51.38 ? 68 HIS A CG 1 ATOM 518 N ND1 . HIS A 1 68 ? 7.652 -89.501 -51.757 1.00 51.62 ? 68 HIS A ND1 1 ATOM 519 C CD2 . HIS A 1 68 ? 8.284 -88.682 -49.829 1.00 51.80 ? 68 HIS A CD2 1 ATOM 520 C CE1 . HIS A 1 68 ? 7.056 -88.330 -51.615 1.00 51.94 ? 68 HIS A CE1 1 ATOM 521 N NE2 . HIS A 1 68 ? 7.420 -87.814 -50.453 1.00 52.01 ? 68 HIS A NE2 1 ATOM 522 N N . MET A 1 69 ? 7.093 -93.285 -51.367 1.00 48.71 ? 69 MET A N 1 ATOM 523 C CA . MET A 1 69 ? 5.850 -93.709 -51.987 1.00 47.99 ? 69 MET A CA 1 ATOM 524 C C . MET A 1 69 ? 4.921 -94.340 -50.944 1.00 47.27 ? 69 MET A C 1 ATOM 525 O O . MET A 1 69 ? 3.733 -94.007 -50.876 1.00 47.19 ? 69 MET A O 1 ATOM 526 C CB . MET A 1 69 ? 6.152 -94.686 -53.119 1.00 48.19 ? 69 MET A CB 1 ATOM 527 C CG . MET A 1 69 ? 4.952 -95.092 -53.947 1.00 49.40 ? 69 MET A CG 1 ATOM 528 S SD . MET A 1 69 ? 3.883 -96.246 -53.073 1.00 51.67 ? 69 MET A SD 1 ATOM 529 C CE . MET A 1 69 ? 4.943 -97.685 -52.987 1.00 52.26 ? 69 MET A CE 1 ATOM 530 N N . PHE A 1 70 ? 5.473 -95.238 -50.127 1.00 46.36 ? 70 PHE A N 1 ATOM 531 C CA . PHE A 1 70 ? 4.697 -95.932 -49.107 1.00 45.28 ? 70 PHE A CA 1 ATOM 532 C C . PHE A 1 70 ? 4.226 -95.026 -48.001 1.00 45.06 ? 70 PHE A C 1 ATOM 533 O O . PHE A 1 70 ? 3.094 -95.149 -47.553 1.00 45.36 ? 70 PHE A O 1 ATOM 534 C CB . PHE A 1 70 ? 5.482 -97.082 -48.510 1.00 44.86 ? 70 PHE A CB 1 ATOM 535 C CG . PHE A 1 70 ? 5.387 -98.326 -49.300 1.00 43.89 ? 70 PHE A CG 1 ATOM 536 C CD1 . PHE A 1 70 ? 4.153 -98.904 -49.548 1.00 43.02 ? 70 PHE A CD1 1 ATOM 537 C CD2 . PHE A 1 70 ? 6.523 -98.927 -49.804 1.00 43.09 ? 70 PHE A CD2 1 ATOM 538 C CE1 . PHE A 1 70 ? 4.055 -100.068 -50.286 1.00 42.93 ? 70 PHE A CE1 1 ATOM 539 C CE2 . PHE A 1 70 ? 6.437 -100.088 -50.546 1.00 43.09 ? 70 PHE A CE2 1 ATOM 540 C CZ . PHE A 1 70 ? 5.198 -100.663 -50.788 1.00 43.09 ? 70 PHE A CZ 1 ATOM 541 N N . GLN A 1 71 ? 5.091 -94.120 -47.558 1.00 44.50 ? 71 GLN A N 1 ATOM 542 C CA . GLN A 1 71 ? 4.709 -93.151 -46.543 1.00 44.21 ? 71 GLN A CA 1 ATOM 543 C C . GLN A 1 71 ? 3.452 -92.384 -46.962 1.00 44.12 ? 71 GLN A C 1 ATOM 544 O O . GLN A 1 71 ? 2.468 -92.353 -46.217 1.00 44.24 ? 71 GLN A O 1 ATOM 545 C CB . GLN A 1 71 ? 5.863 -92.200 -46.247 1.00 44.16 ? 71 GLN A CB 1 ATOM 546 C CG . GLN A 1 71 ? 7.045 -92.878 -45.599 1.00 44.16 ? 71 GLN A CG 1 ATOM 547 C CD . GLN A 1 71 ? 8.307 -92.063 -45.702 1.00 44.72 ? 71 GLN A CD 1 ATOM 548 O OE1 . GLN A 1 71 ? 8.578 -91.438 -46.729 1.00 45.48 ? 71 GLN A OE1 1 ATOM 549 N NE2 . GLN A 1 71 ? 9.096 -92.064 -44.636 1.00 45.30 ? 71 GLN A NE2 1 ATOM 550 N N . VAL A 1 72 ? 3.485 -91.802 -48.164 1.00 43.94 ? 72 VAL A N 1 ATOM 551 C CA . VAL A 1 72 ? 2.344 -91.080 -48.742 1.00 43.60 ? 72 VAL A CA 1 ATOM 552 C C . VAL A 1 72 ? 1.117 -91.984 -48.761 1.00 43.52 ? 72 VAL A C 1 ATOM 553 O O . VAL A 1 72 ? 0.043 -91.582 -48.307 1.00 43.59 ? 72 VAL A O 1 ATOM 554 C CB . VAL A 1 72 ? 2.640 -90.544 -50.185 1.00 43.62 ? 72 VAL A CB 1 ATOM 555 C CG1 . VAL A 1 72 ? 1.367 -90.040 -50.863 1.00 43.29 ? 72 VAL A CG1 1 ATOM 556 C CG2 . VAL A 1 72 ? 3.696 -89.438 -50.161 1.00 43.51 ? 72 VAL A CG2 1 ATOM 557 N N . TYR A 1 73 ? 1.289 -93.208 -49.266 1.00 43.26 ? 73 TYR A N 1 ATOM 558 C CA . TYR A 1 73 ? 0.192 -94.175 -49.334 1.00 42.92 ? 73 TYR A CA 1 ATOM 559 C C . TYR A 1 73 ? -0.520 -94.371 -48.000 1.00 42.91 ? 73 TYR A C 1 ATOM 560 O O . TYR A 1 73 ? -1.749 -94.354 -47.952 1.00 43.00 ? 73 TYR A O 1 ATOM 561 C CB . TYR A 1 73 ? 0.679 -95.522 -49.851 1.00 42.71 ? 73 TYR A CB 1 ATOM 562 C CG . TYR A 1 73 ? -0.202 -96.688 -49.451 1.00 41.97 ? 73 TYR A CG 1 ATOM 563 C CD1 . TYR A 1 73 ? -1.437 -96.895 -50.054 1.00 40.77 ? 73 TYR A CD1 1 ATOM 564 C CD2 . TYR A 1 73 ? 0.208 -97.589 -48.472 1.00 42.27 ? 73 TYR A CD2 1 ATOM 565 C CE1 . TYR A 1 73 ? -2.237 -97.963 -49.702 1.00 40.51 ? 73 TYR A CE1 1 ATOM 566 C CE2 . TYR A 1 73 ? -0.586 -98.667 -48.113 1.00 42.06 ? 73 TYR A CE2 1 ATOM 567 C CZ . TYR A 1 73 ? -1.807 -98.844 -48.734 1.00 41.30 ? 73 TYR A CZ 1 ATOM 568 O OH . TYR A 1 73 ? -2.597 -99.908 -48.376 1.00 41.93 ? 73 TYR A OH 1 ATOM 569 N N . ARG A 1 74 ? 0.254 -94.558 -46.931 1.00 42.81 ? 74 ARG A N 1 ATOM 570 C CA . ARG A 1 74 ? -0.307 -94.827 -45.605 1.00 42.73 ? 74 ARG A CA 1 ATOM 571 C C . ARG A 1 74 ? -1.369 -93.807 -45.217 1.00 42.38 ? 74 ARG A C 1 ATOM 572 O O . ARG A 1 74 ? -2.547 -94.154 -45.087 1.00 42.45 ? 74 ARG A O 1 ATOM 573 C CB . ARG A 1 74 ? 0.786 -94.893 -44.529 1.00 43.07 ? 74 ARG A CB 1 ATOM 574 C CG . ARG A 1 74 ? 0.249 -95.185 -43.126 1.00 43.06 ? 74 ARG A CG 1 ATOM 575 C CD . ARG A 1 74 ? 1.311 -95.783 -42.250 1.00 43.36 ? 74 ARG A CD 1 ATOM 576 N NE . ARG A 1 74 ? 2.279 -94.788 -41.805 1.00 44.48 ? 74 ARG A NE 1 ATOM 577 C CZ . ARG A 1 74 ? 3.176 -95.004 -40.846 1.00 45.56 ? 74 ARG A CZ 1 ATOM 578 N NH1 . ARG A 1 74 ? 3.238 -96.179 -40.231 1.00 46.07 ? 74 ARG A NH1 1 ATOM 579 N NH2 . ARG A 1 74 ? 4.024 -94.050 -40.505 1.00 46.41 ? 74 ARG A NH2 1 ATOM 580 N N . VAL A 1 75 ? -0.953 -92.555 -45.052 1.00 41.64 ? 75 VAL A N 1 ATOM 581 C CA . VAL A 1 75 ? -1.877 -91.503 -44.654 1.00 41.19 ? 75 VAL A CA 1 ATOM 582 C C . VAL A 1 75 ? -3.033 -91.350 -45.649 1.00 40.60 ? 75 VAL A C 1 ATOM 583 O O . VAL A 1 75 ? -4.168 -91.087 -45.253 1.00 40.43 ? 75 VAL A O 1 ATOM 584 C CB . VAL A 1 75 ? -1.142 -90.162 -44.392 1.00 41.35 ? 75 VAL A CB 1 ATOM 585 C CG1 . VAL A 1 75 ? -0.110 -89.880 -45.473 1.00 41.53 ? 75 VAL A CG1 1 ATOM 586 C CG2 . VAL A 1 75 ? -2.139 -89.000 -44.258 1.00 41.73 ? 75 VAL A CG2 1 ATOM 587 N N . SER A 1 76 ? -2.738 -91.553 -46.928 1.00 40.12 ? 76 SER A N 1 ATOM 588 C CA . SER A 1 76 ? -3.727 -91.412 -47.981 1.00 39.77 ? 76 SER A CA 1 ATOM 589 C C . SER A 1 76 ? -4.799 -92.473 -47.885 1.00 39.67 ? 76 SER A C 1 ATOM 590 O O . SER A 1 76 ? -5.968 -92.204 -48.132 1.00 39.39 ? 76 SER A O 1 ATOM 591 C CB . SER A 1 76 ? -3.057 -91.490 -49.345 1.00 39.75 ? 76 SER A CB 1 ATOM 592 O OG . SER A 1 76 ? -2.432 -90.265 -49.661 1.00 40.05 ? 76 SER A OG 1 ATOM 593 N N . PHE A 1 77 ? -4.377 -93.681 -47.533 1.00 39.83 ? 77 PHE A N 1 ATOM 594 C CA . PHE A 1 77 ? -5.261 -94.832 -47.418 1.00 40.11 ? 77 PHE A CA 1 ATOM 595 C C . PHE A 1 77 ? -6.201 -94.656 -46.235 1.00 40.16 ? 77 PHE A C 1 ATOM 596 O O . PHE A 1 77 ? -7.403 -94.917 -46.355 1.00 39.90 ? 77 PHE A O 1 ATOM 597 C CB . PHE A 1 77 ? -4.419 -96.106 -47.263 1.00 40.40 ? 77 PHE A CB 1 ATOM 598 C CG . PHE A 1 77 ? -5.207 -97.335 -46.880 1.00 40.75 ? 77 PHE A CG 1 ATOM 599 C CD1 . PHE A 1 77 ? -5.213 -97.788 -45.560 1.00 41.10 ? 77 PHE A CD1 1 ATOM 600 C CD2 . PHE A 1 77 ? -5.922 -98.048 -47.838 1.00 40.25 ? 77 PHE A CD2 1 ATOM 601 C CE1 . PHE A 1 77 ? -5.935 -98.922 -45.204 1.00 41.39 ? 77 PHE A CE1 1 ATOM 602 C CE2 . PHE A 1 77 ? -6.642 -99.182 -47.493 1.00 40.11 ? 77 PHE A CE2 1 ATOM 603 C CZ . PHE A 1 77 ? -6.649 -99.622 -46.177 1.00 41.05 ? 77 PHE A CZ 1 ATOM 604 N N . THR A 1 78 ? -5.629 -94.226 -45.101 1.00 40.28 ? 78 THR A N 1 ATOM 605 C CA . THR A 1 78 ? -6.372 -93.906 -43.880 1.00 40.19 ? 78 THR A CA 1 ATOM 606 C C . THR A 1 78 ? -7.549 -92.988 -44.212 1.00 40.50 ? 78 THR A C 1 ATOM 607 O O . THR A 1 78 ? -8.710 -93.390 -44.079 1.00 40.83 ? 78 THR A O 1 ATOM 608 C CB . THR A 1 78 ? -5.465 -93.259 -42.793 1.00 39.97 ? 78 THR A CB 1 ATOM 609 O OG1 . THR A 1 78 ? -4.546 -94.230 -42.301 1.00 39.39 ? 78 THR A OG1 1 ATOM 610 C CG2 . THR A 1 78 ? -6.284 -92.765 -41.620 1.00 39.84 ? 78 THR A CG2 1 ATOM 611 N N . ARG A 1 79 ? -7.255 -91.775 -44.673 1.00 40.52 ? 79 ARG A N 1 ATOM 612 C CA . ARG A 1 79 ? -8.307 -90.819 -44.983 1.00 40.66 ? 79 ARG A CA 1 ATOM 613 C C . ARG A 1 79 ? -9.310 -91.371 -45.992 1.00 40.50 ? 79 ARG A C 1 ATOM 614 O O . ARG A 1 79 ? -10.505 -91.159 -45.848 1.00 40.48 ? 79 ARG A O 1 ATOM 615 C CB . ARG A 1 79 ? -7.716 -89.517 -45.482 1.00 40.74 ? 79 ARG A CB 1 ATOM 616 C CG . ARG A 1 79 ? -8.644 -88.346 -45.316 1.00 42.20 ? 79 ARG A CG 1 ATOM 617 C CD . ARG A 1 79 ? -8.224 -87.208 -46.211 1.00 45.31 ? 79 ARG A CD 1 ATOM 618 N NE . ARG A 1 79 ? -8.357 -87.567 -47.626 1.00 47.18 ? 79 ARG A NE 1 ATOM 619 C CZ . ARG A 1 79 ? -7.880 -86.839 -48.630 1.00 47.46 ? 79 ARG A CZ 1 ATOM 620 N NH1 . ARG A 1 79 ? -7.233 -85.703 -48.393 1.00 46.36 ? 79 ARG A NH1 1 ATOM 621 N NH2 . ARG A 1 79 ? -8.053 -87.255 -49.875 1.00 48.38 ? 79 ARG A NH2 1 ATOM 622 N N . ASP A 1 80 ? -8.818 -92.097 -46.990 1.00 40.55 ? 80 ASP A N 1 ATOM 623 C CA . ASP A 1 80 ? -9.674 -92.683 -48.011 1.00 40.65 ? 80 ASP A CA 1 ATOM 624 C C . ASP A 1 80 ? -10.654 -93.677 -47.419 1.00 40.76 ? 80 ASP A C 1 ATOM 625 O O . ASP A 1 80 ? -11.821 -93.695 -47.788 1.00 41.10 ? 80 ASP A O 1 ATOM 626 C CB . ASP A 1 80 ? -8.846 -93.327 -49.123 1.00 40.69 ? 80 ASP A CB 1 ATOM 627 C CG . ASP A 1 80 ? -8.364 -92.316 -50.163 1.00 41.45 ? 80 ASP A CG 1 ATOM 628 O OD1 . ASP A 1 80 ? -8.642 -91.095 -50.034 1.00 42.95 ? 80 ASP A OD1 1 ATOM 629 O OD2 . ASP A 1 80 ? -7.704 -92.747 -51.128 1.00 41.72 ? 80 ASP A OD2 1 ATOM 630 N N . ILE A 1 81 ? -10.197 -94.502 -46.490 1.00 40.83 ? 81 ILE A N 1 ATOM 631 C CA . ILE A 1 81 ? -11.121 -95.402 -45.820 1.00 40.82 ? 81 ILE A CA 1 ATOM 632 C C . ILE A 1 81 ? -12.171 -94.581 -45.070 1.00 41.00 ? 81 ILE A C 1 ATOM 633 O O . ILE A 1 81 ? -13.370 -94.771 -45.268 1.00 40.63 ? 81 ILE A O 1 ATOM 634 C CB . ILE A 1 81 ? -10.389 -96.412 -44.897 1.00 40.78 ? 81 ILE A CB 1 ATOM 635 C CG1 . ILE A 1 81 ? -9.652 -97.461 -45.740 1.00 40.36 ? 81 ILE A CG1 1 ATOM 636 C CG2 . ILE A 1 81 ? -11.364 -97.096 -43.930 1.00 40.56 ? 81 ILE A CG2 1 ATOM 637 C CD1 . ILE A 1 81 ? -10.559 -98.328 -46.632 1.00 39.02 ? 81 ILE A CD1 1 ATOM 638 N N . GLN A 1 82 ? -11.706 -93.646 -44.246 1.00 41.34 ? 82 GLN A N 1 ATOM 639 C CA . GLN A 1 82 ? -12.589 -92.774 -43.480 1.00 41.89 ? 82 GLN A CA 1 ATOM 640 C C . GLN A 1 82 ? -13.718 -92.201 -44.334 1.00 42.13 ? 82 GLN A C 1 ATOM 641 O O . GLN A 1 82 ? -14.871 -92.127 -43.889 1.00 42.35 ? 82 GLN A O 1 ATOM 642 C CB . GLN A 1 82 ? -11.786 -91.650 -42.829 1.00 41.86 ? 82 GLN A CB 1 ATOM 643 C CG . GLN A 1 82 ? -10.984 -92.121 -41.633 1.00 42.99 ? 82 GLN A CG 1 ATOM 644 C CD . GLN A 1 82 ? -9.890 -91.154 -41.203 1.00 44.34 ? 82 GLN A CD 1 ATOM 645 O OE1 . GLN A 1 82 ? -9.337 -90.401 -42.016 1.00 44.32 ? 82 GLN A OE1 1 ATOM 646 N NE2 . GLN A 1 82 ? -9.557 -91.187 -39.911 1.00 44.68 ? 82 GLN A NE2 1 ATOM 647 N N . GLU A 1 83 ? -13.379 -91.810 -45.562 1.00 42.28 ? 83 GLU A N 1 ATOM 648 C CA . GLU A 1 83 ? -14.357 -91.275 -46.500 1.00 42.26 ? 83 GLU A CA 1 ATOM 649 C C . GLU A 1 83 ? -15.270 -92.382 -46.986 1.00 42.43 ? 83 GLU A C 1 ATOM 650 O O . GLU A 1 83 ? -16.480 -92.221 -46.993 1.00 42.65 ? 83 GLU A O 1 ATOM 651 C CB . GLU A 1 83 ? -13.678 -90.591 -47.687 1.00 42.09 ? 83 GLU A CB 1 ATOM 652 C CG . GLU A 1 83 ? -12.945 -89.323 -47.342 1.00 42.06 ? 83 GLU A CG 1 ATOM 653 C CD . GLU A 1 83 ? -13.857 -88.253 -46.789 1.00 42.67 ? 83 GLU A CD 1 ATOM 654 O OE1 . GLU A 1 83 ? -14.991 -88.107 -47.298 1.00 42.61 ? 83 GLU A OE1 1 ATOM 655 O OE2 . GLU A 1 83 ? -13.430 -87.549 -45.847 1.00 42.90 ? 83 GLU A OE2 1 ATOM 656 N N . LEU A 1 84 ? -14.698 -93.513 -47.379 1.00 42.58 ? 84 LEU A N 1 ATOM 657 C CA . LEU A 1 84 ? -15.517 -94.626 -47.824 1.00 42.97 ? 84 LEU A CA 1 ATOM 658 C C . LEU A 1 84 ? -16.607 -94.960 -46.800 1.00 43.46 ? 84 LEU A C 1 ATOM 659 O O . LEU A 1 84 ? -17.731 -95.311 -47.181 1.00 43.76 ? 84 LEU A O 1 ATOM 660 C CB . LEU A 1 84 ? -14.653 -95.838 -48.160 1.00 42.82 ? 84 LEU A CB 1 ATOM 661 C CG . LEU A 1 84 ? -13.985 -95.644 -49.516 1.00 42.64 ? 84 LEU A CG 1 ATOM 662 C CD1 . LEU A 1 84 ? -12.768 -96.515 -49.670 1.00 42.55 ? 84 LEU A CD1 1 ATOM 663 C CD2 . LEU A 1 84 ? -14.984 -95.878 -50.639 1.00 42.98 ? 84 LEU A CD2 1 ATOM 664 N N . VAL A 1 85 ? -16.284 -94.822 -45.510 1.00 43.79 ? 85 VAL A N 1 ATOM 665 C CA . VAL A 1 85 ? -17.284 -94.970 -44.448 1.00 43.84 ? 85 VAL A CA 1 ATOM 666 C C . VAL A 1 85 ? -18.351 -93.895 -44.632 1.00 44.02 ? 85 VAL A C 1 ATOM 667 O O . VAL A 1 85 ? -19.522 -94.221 -44.859 1.00 44.26 ? 85 VAL A O 1 ATOM 668 C CB . VAL A 1 85 ? -16.685 -94.918 -43.006 1.00 43.76 ? 85 VAL A CB 1 ATOM 669 C CG1 . VAL A 1 85 ? -17.795 -94.927 -41.971 1.00 43.37 ? 85 VAL A CG1 1 ATOM 670 C CG2 . VAL A 1 85 ? -15.748 -96.090 -42.761 1.00 43.54 ? 85 VAL A CG2 1 ATOM 671 N N . LYS A 1 86 ? -17.942 -92.625 -44.575 1.00 43.95 ? 86 LYS A N 1 ATOM 672 C CA . LYS A 1 86 ? -18.877 -91.507 -44.740 1.00 44.16 ? 86 LYS A CA 1 ATOM 673 C C . LYS A 1 86 ? -19.847 -91.766 -45.879 1.00 44.38 ? 86 LYS A C 1 ATOM 674 O O . LYS A 1 86 ? -21.011 -91.376 -45.817 1.00 44.44 ? 86 LYS A O 1 ATOM 675 C CB . LYS A 1 86 ? -18.134 -90.198 -45.012 1.00 44.11 ? 86 LYS A CB 1 ATOM 676 C CG . LYS A 1 86 ? -17.208 -89.760 -43.902 1.00 44.03 ? 86 LYS A CG 1 ATOM 677 C CD . LYS A 1 86 ? -16.672 -88.366 -44.127 1.00 42.22 ? 86 LYS A CD 1 ATOM 678 C CE . LYS A 1 86 ? -15.587 -88.084 -43.125 1.00 41.96 ? 86 LYS A CE 1 ATOM 679 N NZ . LYS A 1 86 ? -14.864 -86.854 -43.465 1.00 42.62 ? 86 LYS A NZ 1 ATOM 680 N N . MET A 1 87 ? -19.346 -92.441 -46.908 1.00 44.86 ? 87 MET A N 1 ATOM 681 C CA . MET A 1 87 ? -20.101 -92.724 -48.113 1.00 45.27 ? 87 MET A CA 1 ATOM 682 C C . MET A 1 87 ? -21.078 -93.873 -47.902 1.00 45.82 ? 87 MET A C 1 ATOM 683 O O . MET A 1 87 ? -22.214 -93.791 -48.352 1.00 45.90 ? 87 MET A O 1 ATOM 684 C CB . MET A 1 87 ? -19.155 -93.030 -49.276 1.00 45.14 ? 87 MET A CB 1 ATOM 685 C CG . MET A 1 87 ? -19.752 -92.777 -50.649 1.00 44.39 ? 87 MET A CG 1 ATOM 686 S SD . MET A 1 87 ? -19.058 -93.814 -51.951 1.00 43.50 ? 87 MET A SD 1 ATOM 687 C CE . MET A 1 87 ? -17.372 -93.218 -52.027 1.00 42.37 ? 87 MET A CE 1 ATOM 688 N N . MET A 1 88 ? -20.645 -94.931 -47.223 1.00 46.48 ? 88 MET A N 1 ATOM 689 C CA . MET A 1 88 ? -21.520 -96.073 -46.952 1.00 47.48 ? 88 MET A CA 1 ATOM 690 C C . MET A 1 88 ? -22.355 -95.853 -45.675 1.00 48.31 ? 88 MET A C 1 ATOM 691 O O . MET A 1 88 ? -22.263 -96.606 -44.709 1.00 48.53 ? 88 MET A O 1 ATOM 692 C CB . MET A 1 88 ? -20.699 -97.361 -46.879 1.00 47.42 ? 88 MET A CB 1 ATOM 693 C CG . MET A 1 88 ? -19.765 -97.576 -48.052 1.00 47.04 ? 88 MET A CG 1 ATOM 694 S SD . MET A 1 88 ? -20.597 -97.384 -49.631 1.00 48.39 ? 88 MET A SD 1 ATOM 695 C CE . MET A 1 88 ? -21.591 -98.880 -49.762 1.00 46.79 ? 88 MET A CE 1 ATOM 696 N N . SER A 1 89 ? -23.204 -94.832 -45.710 1.00 49.40 ? 89 SER A N 1 ATOM 697 C CA . SER A 1 89 ? -23.740 -94.184 -44.501 1.00 50.39 ? 89 SER A CA 1 ATOM 698 C C . SER A 1 89 ? -24.347 -95.073 -43.424 1.00 50.67 ? 89 SER A C 1 ATOM 699 O O . SER A 1 89 ? -24.046 -94.888 -42.239 1.00 50.95 ? 89 SER A O 1 ATOM 700 C CB . SER A 1 89 ? -24.680 -93.008 -44.851 1.00 50.72 ? 89 SER A CB 1 ATOM 701 O OG . SER A 1 89 ? -25.583 -93.326 -45.905 1.00 51.65 ? 89 SER A OG 1 ATOM 702 N N . PRO A 1 90 ? -25.223 -96.013 -43.812 1.00 50.88 ? 90 PRO A N 1 ATOM 703 C CA . PRO A 1 90 ? -25.542 -97.019 -42.817 1.00 51.04 ? 90 PRO A CA 1 ATOM 704 C C . PRO A 1 90 ? -25.083 -98.407 -43.233 1.00 51.19 ? 90 PRO A C 1 ATOM 705 O O . PRO A 1 90 ? -25.116 -99.318 -42.428 1.00 51.41 ? 90 PRO A O 1 ATOM 706 C CB . PRO A 1 90 ? -27.075 -96.967 -42.754 1.00 50.97 ? 90 PRO A CB 1 ATOM 707 C CG . PRO A 1 90 ? -27.519 -96.209 -44.008 1.00 50.83 ? 90 PRO A CG 1 ATOM 708 C CD . PRO A 1 90 ? -26.293 -95.921 -44.818 1.00 50.91 ? 90 PRO A CD 1 ATOM 709 N N . LYS A 1 91 ? -24.650 -98.562 -44.476 1.00 51.62 ? 91 LYS A N 1 ATOM 710 C CA . LYS A 1 91 ? -24.306 -99.873 -45.014 1.00 52.01 ? 91 LYS A CA 1 ATOM 711 C C . LYS A 1 91 ? -23.196 -100.534 -44.197 1.00 52.18 ? 91 LYS A C 1 ATOM 712 O O . LYS A 1 91 ? -23.290 -101.713 -43.851 1.00 52.21 ? 91 LYS A O 1 ATOM 713 C CB . LYS A 1 91 ? -23.881 -99.741 -46.478 1.00 52.18 ? 91 LYS A CB 1 ATOM 714 C CG . LYS A 1 91 ? -24.436 -100.808 -47.382 1.00 51.96 ? 91 LYS A CG 1 ATOM 715 C CD . LYS A 1 91 ? -25.823 -100.430 -47.818 1.00 51.83 ? 91 LYS A CD 1 ATOM 716 C CE . LYS A 1 91 ? -26.221 -101.157 -49.075 1.00 51.82 ? 91 LYS A CE 1 ATOM 717 N NZ . LYS A 1 91 ? -27.523 -100.630 -49.511 1.00 51.54 ? 91 LYS A NZ 1 ATOM 718 N N . GLU A 1 92 ? -22.148 -99.768 -43.906 1.00 52.34 ? 92 GLU A N 1 ATOM 719 C CA . GLU A 1 92 ? -21.098 -100.192 -42.985 1.00 52.77 ? 92 GLU A CA 1 ATOM 720 C C . GLU A 1 92 ? -20.780 -99.109 -41.972 1.00 52.68 ? 92 GLU A C 1 ATOM 721 O O . GLU A 1 92 ? -21.026 -97.925 -42.214 1.00 52.78 ? 92 GLU A O 1 ATOM 722 C CB . GLU A 1 92 ? -19.828 -100.593 -43.729 1.00 52.94 ? 92 GLU A CB 1 ATOM 723 C CG . GLU A 1 92 ? -19.922 -101.942 -44.412 1.00 54.23 ? 92 GLU A CG 1 ATOM 724 C CD . GLU A 1 92 ? -20.126 -103.104 -43.452 1.00 55.69 ? 92 GLU A CD 1 ATOM 725 O OE1 . GLU A 1 92 ? -20.951 -103.988 -43.779 1.00 56.05 ? 92 GLU A OE1 1 ATOM 726 O OE2 . GLU A 1 92 ? -19.470 -103.132 -42.381 1.00 56.28 ? 92 GLU A OE2 1 ATOM 727 N N . ASP A 1 93 ? -20.272 -99.518 -40.814 1.00 52.54 ? 93 ASP A N 1 ATOM 728 C CA . ASP A 1 93 ? -19.911 -98.571 -39.766 1.00 52.49 ? 93 ASP A CA 1 ATOM 729 C C . ASP A 1 93 ? -18.725 -99.036 -38.927 1.00 52.38 ? 93 ASP A C 1 ATOM 730 O O . ASP A 1 93 ? -18.457 -100.232 -38.816 1.00 52.33 ? 93 ASP A O 1 ATOM 731 C CB . ASP A 1 93 ? -21.115 -98.308 -38.858 1.00 52.41 ? 93 ASP A CB 1 ATOM 732 C CG . ASP A 1 93 ? -20.809 -97.309 -37.759 0.00 55.29 ? 93 ASP A CG 1 ATOM 733 O OD1 . ASP A 1 93 ? -20.541 -96.132 -38.082 1.00 54.25 ? 93 ASP A OD1 1 ATOM 734 O OD2 . ASP A 1 93 ? -20.835 -97.700 -36.573 0.74 188.08 ? 93 ASP A OD2 1 ATOM 735 N N . TYR A 1 94 ? -18.027 -98.077 -38.329 1.00 52.20 ? 94 TYR A N 1 ATOM 736 C CA . TYR A 1 94 ? -16.975 -98.364 -37.357 1.00 52.02 ? 94 TYR A CA 1 ATOM 737 C C . TYR A 1 94 ? -17.564 -99.250 -36.254 1.00 51.82 ? 94 TYR A C 1 ATOM 738 O O . TYR A 1 94 ? -18.749 -99.118 -35.926 1.00 51.81 ? 94 TYR A O 1 ATOM 739 C CB . TYR A 1 94 ? -16.393 -97.071 -36.755 1.00 52.12 ? 94 TYR A CB 1 ATOM 740 C CG . TYR A 1 94 ? -15.869 -96.070 -37.768 1.00 52.64 ? 94 TYR A CG 1 ATOM 741 C CD1 . TYR A 1 94 ? -16.487 -94.830 -37.931 1.00 53.36 ? 94 TYR A CD1 1 ATOM 742 C CD2 . TYR A 1 94 ? -14.762 -96.364 -38.567 1.00 53.46 ? 94 TYR A CD2 1 ATOM 743 C CE1 . TYR A 1 94 ? -16.019 -93.904 -38.863 1.00 54.26 ? 94 TYR A CE1 1 ATOM 744 C CE2 . TYR A 1 94 ? -14.284 -95.449 -39.509 1.00 54.19 ? 94 TYR A CE2 1 ATOM 745 C CZ . TYR A 1 94 ? -14.917 -94.219 -39.653 1.00 54.78 ? 94 TYR A CZ 1 ATOM 746 O OH . TYR A 1 94 ? -14.451 -93.301 -40.578 1.00 55.41 ? 94 TYR A OH 1 ATOM 747 N N . PRO A 1 95 ? -16.748 -100.162 -35.685 1.00 51.55 ? 95 PRO A N 1 ATOM 748 C CA . PRO A 1 95 ? -15.321 -100.344 -35.952 1.00 51.19 ? 95 PRO A CA 1 ATOM 749 C C . PRO A 1 95 ? -15.045 -101.103 -37.244 1.00 50.78 ? 95 PRO A C 1 ATOM 750 O O . PRO A 1 95 ? -15.833 -101.970 -37.643 1.00 50.91 ? 95 PRO A O 1 ATOM 751 C CB . PRO A 1 95 ? -14.826 -101.153 -34.744 1.00 51.31 ? 95 PRO A CB 1 ATOM 752 C CG . PRO A 1 95 ? -16.055 -101.517 -33.942 1.00 51.49 ? 95 PRO A CG 1 ATOM 753 C CD . PRO A 1 95 ? -17.254 -101.190 -34.762 1.00 51.52 ? 95 PRO A CD 1 ATOM 754 N N . ILE A 1 96 ? -13.928 -100.769 -37.885 1.00 50.10 ? 96 ILE A N 1 ATOM 755 C CA . ILE A 1 96 ? -13.542 -101.387 -39.144 1.00 49.44 ? 96 ILE A CA 1 ATOM 756 C C . ILE A 1 96 ? -12.137 -101.960 -39.036 1.00 48.94 ? 96 ILE A C 1 ATOM 757 O O . ILE A 1 96 ? -11.206 -101.288 -38.585 1.00 48.81 ? 96 ILE A O 1 ATOM 758 C CB . ILE A 1 96 ? -13.629 -100.374 -40.331 1.00 49.59 ? 96 ILE A CB 1 ATOM 759 C CG1 . ILE A 1 96 ? -15.087 -99.970 -40.625 1.00 49.69 ? 96 ILE A CG1 1 ATOM 760 C CG2 . ILE A 1 96 ? -12.955 -100.911 -41.589 1.00 49.38 ? 96 ILE A CG2 1 ATOM 761 C CD1 . ILE A 1 96 ? -16.011 -101.104 -41.033 1.00 49.62 ? 96 ILE A CD1 1 ATOM 762 N N . GLU A 1 97 ? -12.005 -103.212 -39.455 1.00 48.39 ? 97 GLU A N 1 ATOM 763 C CA . GLU A 1 97 ? -10.714 -103.861 -39.548 1.00 47.88 ? 97 GLU A CA 1 ATOM 764 C C . GLU A 1 97 ? -10.418 -104.273 -40.988 1.00 47.80 ? 97 GLU A C 1 ATOM 765 O O . GLU A 1 97 ? -11.228 -104.950 -41.640 1.00 47.51 ? 97 GLU A O 1 ATOM 766 C CB . GLU A 1 97 ? -10.669 -105.060 -38.608 1.00 47.89 ? 97 GLU A CB 1 ATOM 767 C CG . GLU A 1 97 ? -10.828 -104.690 -37.140 1.00 47.11 ? 97 GLU A CG 1 ATOM 768 C CD . GLU A 1 97 ? -9.609 -103.979 -36.581 1.00 46.19 ? 97 GLU A CD 1 ATOM 769 O OE1 . GLU A 1 97 ? -8.513 -104.100 -37.182 1.00 45.18 ? 97 GLU A OE1 1 ATOM 770 O OE2 . GLU A 1 97 ? -9.752 -103.305 -35.537 1.00 45.23 ? 97 GLU A OE2 1 ATOM 771 N N . ILE A 1 98 ? -9.258 -103.839 -41.474 1.00 47.74 ? 98 ILE A N 1 ATOM 772 C CA . ILE A 1 98 ? -8.820 -104.123 -42.831 1.00 48.01 ? 98 ILE A CA 1 ATOM 773 C C . ILE A 1 98 ? -7.453 -104.794 -42.843 1.00 48.25 ? 98 ILE A C 1 ATOM 774 O O . ILE A 1 98 ? -6.554 -104.405 -42.090 1.00 48.56 ? 98 ILE A O 1 ATOM 775 C CB . ILE A 1 98 ? -8.770 -102.845 -43.674 1.00 47.91 ? 98 ILE A CB 1 ATOM 776 C CG1 . ILE A 1 98 ? -10.174 -102.285 -43.831 1.00 47.83 ? 98 ILE A CG1 1 ATOM 777 C CG2 . ILE A 1 98 ? -8.194 -103.129 -45.061 1.00 48.40 ? 98 ILE A CG2 1 ATOM 778 C CD1 . ILE A 1 98 ? -10.197 -100.821 -44.004 1.00 48.50 ? 98 ILE A CD1 1 ATOM 779 N N . GLN A 1 99 ? -7.310 -105.800 -43.705 1.00 48.29 ? 99 GLN A N 1 ATOM 780 C CA . GLN A 1 99 ? -6.060 -106.515 -43.876 1.00 48.23 ? 99 GLN A CA 1 ATOM 781 C C . GLN A 1 99 ? -5.620 -106.508 -45.321 1.00 48.66 ? 99 GLN A C 1 ATOM 782 O O . GLN A 1 99 ? -6.417 -106.805 -46.210 1.00 48.89 ? 99 GLN A O 1 ATOM 783 C CB . GLN A 1 99 ? -6.222 -107.949 -43.402 1.00 48.01 ? 99 GLN A CB 1 ATOM 784 C CG . GLN A 1 99 ? -5.856 -108.128 -41.960 1.00 47.35 ? 99 GLN A CG 1 ATOM 785 C CD . GLN A 1 99 ? -6.610 -109.239 -41.305 1.00 45.73 ? 99 GLN A CD 1 ATOM 786 O OE1 . GLN A 1 99 ? -7.822 -109.159 -41.140 1.00 45.68 ? 99 GLN A OE1 1 ATOM 787 N NE2 . GLN A 1 99 ? -5.900 -110.281 -40.908 1.00 44.77 ? 99 GLN A NE2 1 ATOM 788 N N . LEU A 1 100 ? -4.357 -106.162 -45.557 1.00 49.02 ? 100 LEU A N 1 ATOM 789 C CA . LEU A 1 100 ? -3.779 -106.282 -46.891 1.00 49.42 ? 100 LEU A CA 1 ATOM 790 C C . LEU A 1 100 ? -2.694 -107.327 -46.918 1.00 49.46 ? 100 LEU A C 1 ATOM 791 O O . LEU A 1 100 ? -1.890 -107.414 -46.004 1.00 49.63 ? 100 LEU A O 1 ATOM 792 C CB . LEU A 1 100 ? -3.227 -104.947 -47.395 1.00 49.50 ? 100 LEU A CB 1 ATOM 793 C CG . LEU A 1 100 ? -4.238 -103.972 -48.015 1.00 50.46 ? 100 LEU A CG 1 ATOM 794 C CD1 . LEU A 1 100 ? -4.834 -103.042 -46.955 1.00 51.58 ? 100 LEU A CD1 1 ATOM 795 C CD2 . LEU A 1 100 ? -3.625 -103.157 -49.145 1.00 50.16 ? 100 LEU A CD2 1 ATOM 796 N N . SER A 1 101 ? -2.684 -108.121 -47.975 1.00 49.79 ? 101 SER A N 1 ATOM 797 C CA . SER A 1 101 ? -1.598 -109.048 -48.225 1.00 50.21 ? 101 SER A CA 1 ATOM 798 C C . SER A 1 101 ? -1.138 -108.845 -49.664 1.00 50.57 ? 101 SER A C 1 ATOM 799 O O . SER A 1 101 ? -1.889 -109.101 -50.601 1.00 50.58 ? 101 SER A O 1 ATOM 800 C CB . SER A 1 101 ? -2.075 -110.478 -48.002 1.00 50.15 ? 101 SER A CB 1 ATOM 801 O OG . SER A 1 101 ? -0.984 -111.367 -47.908 1.00 50.00 ? 101 SER A OG 1 ATOM 802 N N . ALA A 1 102 ? 0.083 -108.358 -49.839 1.00 50.97 ? 102 ALA A N 1 ATOM 803 C CA . ALA A 1 102 ? 0.578 -108.040 -51.170 1.00 51.55 ? 102 ALA A CA 1 ATOM 804 C C . ALA A 1 102 ? 1.999 -108.543 -51.339 1.00 52.14 ? 102 ALA A C 1 ATOM 805 O O . ALA A 1 102 ? 2.835 -108.357 -50.452 1.00 52.27 ? 102 ALA A O 1 ATOM 806 C CB . ALA A 1 102 ? 0.515 -106.543 -51.404 1.00 51.41 ? 102 ALA A CB 1 ATOM 807 N N . GLY A 1 103 ? 2.281 -109.188 -52.467 1.00 52.71 ? 103 GLY A N 1 ATOM 808 C CA . GLY A 1 103 ? 3.642 -109.628 -52.721 1.00 53.54 ? 103 GLY A CA 1 ATOM 809 C C . GLY A 1 103 ? 3.887 -110.513 -53.917 1.00 54.24 ? 103 GLY A C 1 ATOM 810 O O . GLY A 1 103 ? 3.253 -110.382 -54.959 1.00 54.00 ? 103 GLY A O 1 ATOM 811 N N . CYS A 1 104 ? 4.826 -111.430 -53.734 1.00 55.24 ? 104 CYS A N 1 ATOM 812 C CA . CYS A 1 104 ? 5.395 -112.199 -54.817 1.00 56.23 ? 104 CYS A CA 1 ATOM 813 C C . CYS A 1 104 ? 5.569 -113.643 -54.455 1.00 57.40 ? 104 CYS A C 1 ATOM 814 O O . CYS A 1 104 ? 5.807 -113.985 -53.300 1.00 57.73 ? 104 CYS A O 1 ATOM 815 C CB . CYS A 1 104 ? 6.776 -111.660 -55.117 1.00 55.82 ? 104 CYS A CB 1 ATOM 816 S SG . CYS A 1 104 ? 6.720 -110.241 -56.122 1.00 55.11 ? 104 CYS A SG 1 ATOM 817 N N . GLU A 1 105 ? 5.461 -114.493 -55.468 1.00 58.85 ? 105 GLU A N 1 ATOM 818 C CA . GLU A 1 105 ? 5.891 -115.871 -55.367 1.00 60.32 ? 105 GLU A CA 1 ATOM 819 C C . GLU A 1 105 ? 7.054 -116.018 -56.335 1.00 61.21 ? 105 GLU A C 1 ATOM 820 O O . GLU A 1 105 ? 6.920 -115.743 -57.528 1.00 61.21 ? 105 GLU A O 1 ATOM 821 C CB . GLU A 1 105 ? 4.757 -116.822 -55.747 1.00 60.33 ? 105 GLU A CB 1 ATOM 822 C CG . GLU A 1 105 ? 4.925 -118.234 -55.211 1.00 61.05 ? 105 GLU A CG 1 ATOM 823 C CD . GLU A 1 105 ? 3.738 -118.689 -54.386 1.00 62.25 ? 105 GLU A CD 1 ATOM 824 O OE1 . GLU A 1 105 ? 3.874 -119.685 -53.645 1.00 63.41 ? 105 GLU A OE1 1 ATOM 825 O OE2 . GLU A 1 105 ? 2.668 -118.051 -54.478 0.00 74.88 ? 105 GLU A OE2 1 ATOM 826 N N . MET A 1 106 ? 8.196 -116.452 -55.819 1.00 62.55 ? 106 MET A N 1 ATOM 827 C CA . MET A 1 106 ? 9.386 -116.624 -56.636 1.00 63.93 ? 106 MET A CA 1 ATOM 828 C C . MET A 1 106 ? 9.562 -118.051 -57.118 1.00 64.63 ? 106 MET A C 1 ATOM 829 O O . MET A 1 106 ? 9.277 -119.010 -56.395 1.00 64.91 ? 106 MET A O 1 ATOM 830 C CB . MET A 1 106 ? 10.626 -116.183 -55.856 1.00 64.08 ? 106 MET A CB 1 ATOM 831 C CG . MET A 1 106 ? 10.627 -114.708 -55.506 1.00 65.06 ? 106 MET A CG 1 ATOM 832 S SD . MET A 1 106 ? 10.155 -113.682 -56.916 1.00 67.66 ? 106 MET A SD 1 ATOM 833 C CE . MET A 1 106 ? 11.576 -113.917 -58.004 1.00 67.89 ? 106 MET A CE 1 ATOM 834 N N . TYR A 1 107 ? 10.124 -118.155 -58.299 1.00 65.42 ? 107 TYR A N 1 ATOM 835 C CA . TYR A 1 107 ? 10.253 -119.399 -58.971 1.00 66.28 ? 107 TYR A CA 1 ATOM 836 C C . TYR A 1 107 ? 11.531 -119.454 -59.754 1.00 66.60 ? 107 TYR A C 1 ATOM 837 O O . TYR A 1 107 ? 12.191 -118.459 -59.951 1.00 66.78 ? 107 TYR A O 1 ATOM 838 C CB . TYR A 1 107 ? 9.126 -119.515 -59.947 1.00 66.47 ? 107 TYR A CB 1 ATOM 839 C CG . TYR A 1 107 ? 7.789 -119.582 -59.319 1.00 67.23 ? 107 TYR A CG 1 ATOM 840 C CD1 . TYR A 1 107 ? 7.614 -120.154 -58.099 1.00 68.40 ? 107 TYR A CD1 1 ATOM 841 C CD2 . TYR A 1 107 ? 6.697 -119.091 -59.964 1.00 67.71 ? 107 TYR A CD2 1 ATOM 842 C CE1 . TYR A 1 107 ? 6.380 -120.239 -57.546 1.00 68.88 ? 107 TYR A CE1 1 ATOM 843 C CE2 . TYR A 1 107 ? 5.475 -119.159 -59.410 1.00 68.36 ? 107 TYR A CE2 1 ATOM 844 C CZ . TYR A 1 107 ? 5.315 -119.738 -58.208 1.00 68.76 ? 107 TYR A CZ 1 ATOM 845 O OH . TYR A 1 107 ? 4.067 -119.805 -57.671 1.00 68.94 ? 107 TYR A OH 1 ATOM 846 N N . PRO A 1 108 ? 11.870 -120.645 -60.198 1.00 66.87 ? 108 PRO A N 1 ATOM 847 C CA . PRO A 1 108 ? 12.917 -120.844 -61.183 1.00 66.92 ? 108 PRO A CA 1 ATOM 848 C C . PRO A 1 108 ? 12.503 -120.166 -62.457 1.00 66.84 ? 108 PRO A C 1 ATOM 849 O O . PRO A 1 108 ? 11.390 -120.353 -62.883 1.00 66.82 ? 108 PRO A O 1 ATOM 850 C CB . PRO A 1 108 ? 12.872 -122.341 -61.392 1.00 67.13 ? 108 PRO A CB 1 ATOM 851 C CG . PRO A 1 108 ? 11.518 -122.721 -61.044 1.00 66.94 ? 108 PRO A CG 1 ATOM 852 C CD . PRO A 1 108 ? 11.176 -121.894 -59.894 1.00 66.92 ? 108 PRO A CD 1 ATOM 853 N N . GLY A 1 109 ? 13.428 -119.488 -63.108 1.00 66.52 ? 109 GLY A N 1 ATOM 854 C CA . GLY A 1 109 ? 13.238 -118.196 -63.709 1.00 66.30 ? 109 GLY A CA 1 ATOM 855 C C . GLY A 1 109 ? 13.512 -117.386 -62.463 1.00 66.05 ? 109 GLY A C 1 ATOM 856 O O . GLY A 1 109 ? 13.875 -117.979 -61.442 1.00 66.36 ? 109 GLY A O 1 ATOM 857 N N . ASN A 1 110 ? 13.340 -116.068 -62.480 1.00 65.46 ? 110 ASN A N 1 ATOM 858 C CA . ASN A 1 110 ? 12.910 -115.326 -63.620 1.00 64.69 ? 110 ASN A CA 1 ATOM 859 C C . ASN A 1 110 ? 11.672 -115.999 -64.057 1.00 63.81 ? 110 ASN A C 1 ATOM 860 O O . ASN A 1 110 ? 11.478 -116.302 -65.222 1.00 64.02 ? 110 ASN A O 1 ATOM 861 C CB . ASN A 1 110 ? 13.975 -115.262 -64.677 1.00 65.01 ? 110 ASN A CB 1 ATOM 862 C CG . ASN A 1 110 ? 14.884 -114.078 -64.488 1.00 65.95 ? 110 ASN A CG 1 ATOM 863 O OD1 . ASN A 1 110 ? 15.750 -114.079 -63.625 1.00 66.80 ? 110 ASN A OD1 1 ATOM 864 N ND2 . ASN A 1 110 ? 14.689 -113.058 -65.293 1.00 66.81 ? 110 ASN A ND2 1 ATOM 865 N N . ALA A 1 111 ? 10.879 -116.308 -63.052 1.00 62.48 ? 111 ALA A N 1 ATOM 866 C CA . ALA A 1 111 ? 9.484 -116.588 -63.177 1.00 61.11 ? 111 ALA A CA 1 ATOM 867 C C . ALA A 1 111 ? 9.044 -116.046 -61.878 1.00 60.05 ? 111 ALA A C 1 ATOM 868 O O . ALA A 1 111 ? 9.811 -116.004 -60.959 1.00 60.15 ? 111 ALA A O 1 ATOM 869 C CB . ALA A 1 111 ? 9.235 -118.037 -63.229 1.00 61.26 ? 111 ALA A CB 1 ATOM 870 N N . SER A 1 112 ? 7.812 -115.619 -61.790 1.00 58.38 ? 112 SER A N 1 ATOM 871 C CA . SER A 1 112 ? 7.322 -115.017 -60.552 1.00 56.81 ? 112 SER A CA 1 ATOM 872 C C . SER A 1 112 ? 5.847 -114.685 -60.701 1.00 55.74 ? 112 SER A C 1 ATOM 873 O O . SER A 1 112 ? 5.433 -114.201 -61.749 1.00 56.00 ? 112 SER A O 1 ATOM 874 C CB . SER A 1 112 ? 8.110 -113.740 -60.235 1.00 56.90 ? 112 SER A CB 1 ATOM 875 O OG . SER A 1 112 ? 7.249 -112.660 -59.899 1.00 56.65 ? 112 SER A OG 1 ATOM 876 N N . GLU A 1 113 ? 5.068 -114.903 -59.642 1.00 54.14 ? 113 GLU A N 1 ATOM 877 C CA . GLU A 1 113 ? 3.635 -114.589 -59.634 1.00 52.49 ? 113 GLU A CA 1 ATOM 878 C C . GLU A 1 113 ? 3.287 -113.590 -58.523 1.00 51.18 ? 113 GLU A C 1 ATOM 879 O O . GLU A 1 113 ? 3.783 -113.713 -57.403 1.00 51.31 ? 113 GLU A O 1 ATOM 880 C CB . GLU A 1 113 ? 2.806 -115.864 -59.474 1.00 52.62 ? 113 GLU A CB 1 ATOM 881 C CG . GLU A 1 113 ? 1.307 -115.624 -59.385 1.00 52.27 ? 113 GLU A CG 1 ATOM 882 C CD . GLU A 1 113 ? 0.503 -116.674 -60.125 0.00 68.75 ? 113 GLU A CD 1 ATOM 883 O OE1 . GLU A 1 113 ? 1.020 -117.231 -61.116 1.00 66.93 ? 113 GLU A OE1 1 ATOM 884 O OE2 . GLU A 1 113 ? -0.646 -116.942 -59.717 0.64 37.33 ? 113 GLU A OE2 1 ATOM 885 N N . SER A 1 114 ? 2.450 -112.599 -58.831 1.00 49.46 ? 114 SER A N 1 ATOM 886 C CA . SER A 1 114 ? 2.174 -111.526 -57.876 1.00 47.89 ? 114 SER A CA 1 ATOM 887 C C . SER A 1 114 ? 0.710 -111.437 -57.456 1.00 46.71 ? 114 SER A C 1 ATOM 888 O O . SER A 1 114 ? -0.177 -111.907 -58.161 1.00 46.81 ? 114 SER A O 1 ATOM 889 C CB . SER A 1 114 ? 2.650 -110.196 -58.440 1.00 47.97 ? 114 SER A CB 1 ATOM 890 O OG . SER A 1 114 ? 3.991 -110.311 -58.875 1.00 48.15 ? 114 SER A OG 1 ATOM 891 N N . PHE A 1 115 ? 0.463 -110.830 -56.300 1.00 45.25 ? 115 PHE A N 1 ATOM 892 C CA . PHE A 1 115 ? -0.873 -110.810 -55.709 1.00 43.90 ? 115 PHE A CA 1 ATOM 893 C C . PHE A 1 115 ? -1.090 -109.614 -54.788 1.00 42.98 ? 115 PHE A C 1 ATOM 894 O O . PHE A 1 115 ? -0.155 -109.129 -54.149 1.00 42.95 ? 115 PHE A O 1 ATOM 895 C CB . PHE A 1 115 ? -1.111 -112.104 -54.924 1.00 44.04 ? 115 PHE A CB 1 ATOM 896 C CG . PHE A 1 115 ? -0.203 -112.268 -53.726 1.00 44.32 ? 115 PHE A CG 1 ATOM 897 C CD1 . PHE A 1 115 ? 1.088 -112.769 -53.874 1.00 44.59 ? 115 PHE A CD1 1 ATOM 898 C CD2 . PHE A 1 115 ? -0.640 -111.918 -52.449 1.00 44.21 ? 115 PHE A CD2 1 ATOM 899 C CE1 . PHE A 1 115 ? 1.922 -112.912 -52.776 1.00 44.53 ? 115 PHE A CE1 1 ATOM 900 C CE2 . PHE A 1 115 ? 0.186 -112.053 -51.352 1.00 43.89 ? 115 PHE A CE2 1 ATOM 901 C CZ . PHE A 1 115 ? 1.471 -112.552 -51.513 1.00 44.33 ? 115 PHE A CZ 1 ATOM 902 N N . LEU A 1 116 ? -2.329 -109.144 -54.716 1.00 41.83 ? 116 LEU A N 1 ATOM 903 C CA . LEU A 1 116 ? -2.712 -108.187 -53.682 1.00 40.91 ? 116 LEU A CA 1 ATOM 904 C C . LEU A 1 116 ? -4.132 -108.500 -53.221 1.00 40.42 ? 116 LEU A C 1 ATOM 905 O O . LEU A 1 116 ? -5.096 -108.296 -53.956 1.00 40.34 ? 116 LEU A O 1 ATOM 906 C CB . LEU A 1 116 ? -2.573 -106.740 -54.167 1.00 40.76 ? 116 LEU A CB 1 ATOM 907 C CG . LEU A 1 116 ? -2.632 -105.619 -53.125 1.00 40.66 ? 116 LEU A CG 1 ATOM 908 C CD1 . LEU A 1 116 ? -1.959 -104.370 -53.642 1.00 40.67 ? 116 LEU A CD1 1 ATOM 909 C CD2 . LEU A 1 116 ? -4.055 -105.295 -52.711 1.00 40.60 ? 116 LEU A CD2 1 ATOM 910 N N . HIS A 1 117 ? -4.243 -109.019 -52.003 1.00 39.80 ? 117 HIS A N 1 ATOM 911 C CA . HIS A 1 117 ? -5.520 -109.429 -51.446 1.00 39.42 ? 117 HIS A CA 1 ATOM 912 C C . HIS A 1 117 ? -5.917 -108.513 -50.290 1.00 39.00 ? 117 HIS A C 1 ATOM 913 O O . HIS A 1 117 ? -5.087 -108.151 -49.456 1.00 38.84 ? 117 HIS A O 1 ATOM 914 C CB . HIS A 1 117 ? -5.439 -110.877 -50.974 1.00 39.60 ? 117 HIS A CB 1 ATOM 915 C CG . HIS A 1 117 ? -5.250 -111.870 -52.077 1.00 40.50 ? 117 HIS A CG 1 ATOM 916 N ND1 . HIS A 1 117 ? -5.662 -113.181 -51.971 1.00 42.02 ? 117 HIS A ND1 1 ATOM 917 C CD2 . HIS A 1 117 ? -4.697 -111.750 -53.307 1.00 41.33 ? 117 HIS A CD2 1 ATOM 918 C CE1 . HIS A 1 117 ? -5.365 -113.827 -53.084 1.00 42.24 ? 117 HIS A CE1 1 ATOM 919 N NE2 . HIS A 1 117 ? -4.780 -112.981 -53.912 1.00 42.23 ? 117 HIS A NE2 1 ATOM 920 N N . VAL A 1 118 ? -7.187 -108.126 -50.261 1.00 38.60 ? 118 VAL A N 1 ATOM 921 C CA . VAL A 1 118 ? -7.712 -107.262 -49.215 1.00 38.43 ? 118 VAL A CA 1 ATOM 922 C C . VAL A 1 118 ? -8.807 -107.995 -48.463 1.00 38.43 ? 118 VAL A C 1 ATOM 923 O O . VAL A 1 118 ? -9.706 -108.587 -49.065 1.00 38.30 ? 118 VAL A O 1 ATOM 924 C CB . VAL A 1 118 ? -8.318 -105.958 -49.776 1.00 38.45 ? 118 VAL A CB 1 ATOM 925 C CG1 . VAL A 1 118 ? -8.493 -104.923 -48.666 1.00 38.30 ? 118 VAL A CG1 1 ATOM 926 C CG2 . VAL A 1 118 ? -7.458 -105.394 -50.888 1.00 38.67 ? 118 VAL A CG2 1 ATOM 927 N N . ALA A 1 119 ? -8.722 -107.950 -47.139 1.00 38.51 ? 119 ALA A N 1 ATOM 928 C CA . ALA A 1 119 ? -9.747 -108.520 -46.284 1.00 38.47 ? 119 ALA A CA 1 ATOM 929 C C . ALA A 1 119 ? -10.434 -107.421 -45.524 1.00 38.63 ? 119 ALA A C 1 ATOM 930 O O . ALA A 1 119 ? -9.825 -106.404 -45.175 1.00 38.50 ? 119 ALA A O 1 ATOM 931 C CB . ALA A 1 119 ? -9.158 -109.503 -45.326 1.00 38.65 ? 119 ALA A CB 1 ATOM 932 N N . PHE A 1 120 ? -11.714 -107.643 -45.268 1.00 38.86 ? 120 PHE A N 1 ATOM 933 C CA . PHE A 1 120 ? -12.539 -106.670 -44.594 1.00 39.08 ? 120 PHE A CA 1 ATOM 934 C C . PHE A 1 120 ? -13.268 -107.390 -43.493 1.00 39.44 ? 120 PHE A C 1 ATOM 935 O O . PHE A 1 120 ? -14.031 -108.321 -43.751 1.00 39.38 ? 120 PHE A O 1 ATOM 936 C CB . PHE A 1 120 ? -13.531 -106.057 -45.573 1.00 38.90 ? 120 PHE A CB 1 ATOM 937 C CG . PHE A 1 120 ? -14.395 -104.997 -44.971 1.00 38.92 ? 120 PHE A CG 1 ATOM 938 C CD1 . PHE A 1 120 ? -13.856 -103.763 -44.602 1.00 38.47 ? 120 PHE A CD1 1 ATOM 939 C CD2 . PHE A 1 120 ? -15.754 -105.222 -44.781 1.00 38.78 ? 120 PHE A CD2 1 ATOM 940 C CE1 . PHE A 1 120 ? -14.654 -102.777 -44.048 1.00 37.49 ? 120 PHE A CE1 1 ATOM 941 C CE2 . PHE A 1 120 ? -16.563 -104.234 -44.225 1.00 38.46 ? 120 PHE A CE2 1 ATOM 942 C CZ . PHE A 1 120 ? -16.009 -103.011 -43.858 1.00 37.82 ? 120 PHE A CZ 1 ATOM 943 N N . GLN A 1 121 ? -13.018 -106.961 -42.260 1.00 39.98 ? 121 GLN A N 1 ATOM 944 C CA . GLN A 1 121 ? -13.569 -107.624 -41.078 1.00 40.46 ? 121 GLN A CA 1 ATOM 945 C C . GLN A 1 121 ? -13.152 -109.095 -41.012 1.00 40.77 ? 121 GLN A C 1 ATOM 946 O O . GLN A 1 121 ? -13.871 -109.928 -40.446 1.00 40.88 ? 121 GLN A O 1 ATOM 947 C CB . GLN A 1 121 ? -15.101 -107.487 -41.021 1.00 40.34 ? 121 GLN A CB 1 ATOM 948 C CG . GLN A 1 121 ? -15.629 -106.070 -41.186 1.00 40.47 ? 121 GLN A CG 1 ATOM 949 C CD . GLN A 1 121 ? -15.214 -105.127 -40.067 1.00 40.91 ? 121 GLN A CD 1 ATOM 950 O OE1 . GLN A 1 121 ? -14.172 -105.301 -39.436 1.00 41.52 ? 121 GLN A OE1 1 ATOM 951 N NE2 . GLN A 1 121 ? -16.033 -104.113 -39.824 1.00 40.90 ? 121 GLN A NE2 1 ATOM 952 N N . GLY A 1 122 ? -11.993 -109.407 -41.595 1.00 41.07 ? 122 GLY A N 1 ATOM 953 C CA . GLY A 1 122 ? -11.445 -110.763 -41.555 1.00 41.37 ? 122 GLY A CA 1 ATOM 954 C C . GLY A 1 122 ? -11.960 -111.686 -42.643 1.00 41.73 ? 122 GLY A C 1 ATOM 955 O O . GLY A 1 122 ? -11.645 -112.870 -42.647 1.00 41.68 ? 122 GLY A O 1 ATOM 956 N N . LYS A 1 123 ? -12.762 -111.162 -43.562 1.00 42.17 ? 123 LYS A N 1 ATOM 957 C CA . LYS A 1 123 ? -13.117 -111.938 -44.736 1.00 42.88 ? 123 LYS A CA 1 ATOM 958 C C . LYS A 1 123 ? -12.434 -111.362 -45.975 1.00 42.92 ? 123 LYS A C 1 ATOM 959 O O . LYS A 1 123 ? -12.373 -110.142 -46.150 1.00 42.91 ? 123 LYS A O 1 ATOM 960 C CB . LYS A 1 123 ? -14.636 -112.034 -44.913 1.00 43.14 ? 123 LYS A CB 1 ATOM 961 C CG . LYS A 1 123 ? -15.087 -113.358 -45.578 1.00 45.16 ? 123 LYS A CG 1 ATOM 962 C CD . LYS A 1 123 ? -16.621 -113.598 -45.538 1.00 47.32 ? 123 LYS A CD 1 ATOM 963 C CE . LYS A 1 123 ? -17.342 -113.166 -46.836 1.00 47.81 ? 123 LYS A CE 1 ATOM 964 N NZ . LYS A 1 123 ? -17.597 -111.684 -46.908 1.00 47.83 ? 123 LYS A NZ 1 ATOM 965 N N . TYR A 1 124 ? -11.891 -112.251 -46.806 1.00 43.05 ? 124 TYR A N 1 ATOM 966 C CA . TYR A 1 124 ? -11.293 -111.884 -48.084 1.00 43.15 ? 124 TYR A CA 1 ATOM 967 C C . TYR A 1 124 ? -12.393 -111.416 -49.022 1.00 43.45 ? 124 TYR A C 1 ATOM 968 O O . TYR A 1 124 ? -13.381 -112.119 -49.257 1.00 43.44 ? 124 TYR A O 1 ATOM 969 C CB . TYR A 1 124 ? -10.560 -113.090 -48.660 1.00 43.25 ? 124 TYR A CB 1 ATOM 970 C CG . TYR A 1 124 ? -9.970 -112.949 -50.049 1.00 43.12 ? 124 TYR A CG 1 ATOM 971 C CD1 . TYR A 1 124 ? -9.184 -111.851 -50.405 1.00 43.46 ? 124 TYR A CD1 1 ATOM 972 C CD2 . TYR A 1 124 ? -10.145 -113.956 -50.985 1.00 42.77 ? 124 TYR A CD2 1 ATOM 973 C CE1 . TYR A 1 124 ? -8.627 -111.749 -51.674 1.00 43.18 ? 124 TYR A CE1 1 ATOM 974 C CE2 . TYR A 1 124 ? -9.591 -113.867 -52.244 1.00 43.69 ? 124 TYR A CE2 1 ATOM 975 C CZ . TYR A 1 124 ? -8.832 -112.766 -52.584 1.00 43.64 ? 124 TYR A CZ 1 ATOM 976 O OH . TYR A 1 124 ? -8.293 -112.699 -53.846 1.00 43.89 ? 124 TYR A OH 1 ATOM 977 N N . VAL A 1 125 ? -12.228 -110.206 -49.536 1.00 43.78 ? 125 VAL A N 1 ATOM 978 C CA . VAL A 1 125 ? -13.288 -109.548 -50.292 1.00 44.02 ? 125 VAL A CA 1 ATOM 979 C C . VAL A 1 125 ? -12.812 -109.017 -51.651 1.00 44.26 ? 125 VAL A C 1 ATOM 980 O O . VAL A 1 125 ? -13.450 -109.275 -52.681 1.00 44.61 ? 125 VAL A O 1 ATOM 981 C CB . VAL A 1 125 ? -13.955 -108.418 -49.462 1.00 43.90 ? 125 VAL A CB 1 ATOM 982 C CG1 . VAL A 1 125 ? -14.833 -108.996 -48.385 1.00 44.07 ? 125 VAL A CG1 1 ATOM 983 C CG2 . VAL A 1 125 ? -12.917 -107.515 -48.832 1.00 44.13 ? 125 VAL A CG2 1 ATOM 984 N N . VAL A 1 126 ? -11.684 -108.305 -51.646 1.00 44.10 ? 126 VAL A N 1 ATOM 985 C CA . VAL A 1 126 ? -11.207 -107.574 -52.812 1.00 43.89 ? 126 VAL A CA 1 ATOM 986 C C . VAL A 1 126 ? -9.782 -107.956 -53.170 1.00 43.91 ? 126 VAL A C 1 ATOM 987 O O . VAL A 1 126 ? -8.924 -108.027 -52.296 1.00 43.89 ? 126 VAL A O 1 ATOM 988 C CB . VAL A 1 126 ? -11.239 -106.057 -52.541 1.00 43.87 ? 126 VAL A CB 1 ATOM 989 C CG1 . VAL A 1 126 ? -10.569 -105.291 -53.670 1.00 43.87 ? 126 VAL A CG1 1 ATOM 990 C CG2 . VAL A 1 126 ? -12.669 -105.578 -52.327 1.00 43.45 ? 126 VAL A CG2 1 ATOM 991 N N . ARG A 1 127 ? -9.529 -108.204 -54.451 1.00 43.97 ? 127 ARG A N 1 ATOM 992 C CA . ARG A 1 127 ? -8.155 -108.296 -54.918 1.00 44.12 ? 127 ARG A CA 1 ATOM 993 C C . ARG A 1 127 ? -7.858 -107.209 -55.926 1.00 44.58 ? 127 ARG A C 1 ATOM 994 O O . ARG A 1 127 ? -8.740 -106.436 -56.286 1.00 44.74 ? 127 ARG A O 1 ATOM 995 C CB . ARG A 1 127 ? -7.820 -109.688 -55.463 1.00 43.96 ? 127 ARG A CB 1 ATOM 996 C CG . ARG A 1 127 ? -8.312 -110.052 -56.855 1.00 43.36 ? 127 ARG A CG 1 ATOM 997 C CD . ARG A 1 127 ? -8.308 -111.570 -56.938 1.00 42.98 ? 127 ARG A CD 1 ATOM 998 N NE . ARG A 1 127 ? -8.044 -112.148 -58.253 1.00 42.42 ? 127 ARG A NE 1 ATOM 999 C CZ . ARG A 1 127 ? -8.977 -112.422 -59.157 1.00 42.55 ? 127 ARG A CZ 1 ATOM 1000 N NH1 . ARG A 1 127 ? -10.250 -112.132 -58.925 1.00 43.04 ? 127 ARG A NH1 1 ATOM 1001 N NH2 . ARG A 1 127 ? -8.633 -112.975 -60.308 1.00 42.55 ? 127 ARG A NH2 1 ATOM 1002 N N . PHE A 1 128 ? -6.597 -107.120 -56.328 1.00 45.17 ? 128 PHE A N 1 ATOM 1003 C CA . PHE A 1 128 ? -6.225 -106.388 -57.523 1.00 45.68 ? 128 PHE A CA 1 ATOM 1004 C C . PHE A 1 128 ? -5.901 -107.432 -58.571 1.00 46.16 ? 128 PHE A C 1 ATOM 1005 O O . PHE A 1 128 ? -5.308 -108.461 -58.261 1.00 46.50 ? 128 PHE A O 1 ATOM 1006 C CB . PHE A 1 128 ? -5.016 -105.511 -57.270 1.00 45.52 ? 128 PHE A CB 1 ATOM 1007 C CG . PHE A 1 128 ? -4.760 -104.519 -58.359 1.00 45.65 ? 128 PHE A CG 1 ATOM 1008 C CD1 . PHE A 1 128 ? -5.324 -103.250 -58.303 1.00 44.83 ? 128 PHE A CD1 1 ATOM 1009 C CD2 . PHE A 1 128 ? -3.953 -104.851 -59.441 1.00 45.65 ? 128 PHE A CD2 1 ATOM 1010 C CE1 . PHE A 1 128 ? -5.087 -102.334 -59.299 1.00 45.08 ? 128 PHE A CE1 1 ATOM 1011 C CE2 . PHE A 1 128 ? -3.707 -103.934 -60.447 1.00 45.63 ? 128 PHE A CE2 1 ATOM 1012 C CZ . PHE A 1 128 ? -4.273 -102.675 -60.378 1.00 45.51 ? 128 PHE A CZ 1 ATOM 1013 N N . TRP A 1 129 ? -6.298 -107.183 -59.808 1.00 46.73 ? 129 TRP A N 1 ATOM 1014 C CA . TRP A 1 129 ? -6.165 -108.200 -60.835 1.00 47.52 ? 129 TRP A CA 1 ATOM 1015 C C . TRP A 1 129 ? -5.964 -107.591 -62.210 1.00 47.42 ? 129 TRP A C 1 ATOM 1016 O O . TRP A 1 129 ? -6.875 -106.982 -62.767 1.00 47.85 ? 129 TRP A O 1 ATOM 1017 C CB . TRP A 1 129 ? -7.389 -109.113 -60.835 1.00 47.87 ? 129 TRP A CB 1 ATOM 1018 C CG . TRP A 1 129 ? -7.210 -110.333 -61.671 1.00 49.85 ? 129 TRP A CG 1 ATOM 1019 C CD1 . TRP A 1 129 ? -7.976 -110.722 -62.738 1.00 50.92 ? 129 TRP A CD1 1 ATOM 1020 C CD2 . TRP A 1 129 ? -6.191 -111.330 -61.519 1.00 51.37 ? 129 TRP A CD2 1 ATOM 1021 N NE1 . TRP A 1 129 ? -7.502 -111.908 -63.251 1.00 51.88 ? 129 TRP A NE1 1 ATOM 1022 C CE2 . TRP A 1 129 ? -6.408 -112.302 -62.523 1.00 52.23 ? 129 TRP A CE2 1 ATOM 1023 C CE3 . TRP A 1 129 ? -5.119 -111.499 -60.629 1.00 51.51 ? 129 TRP A CE3 1 ATOM 1024 C CZ2 . TRP A 1 129 ? -5.588 -113.428 -62.661 1.00 53.30 ? 129 TRP A CZ2 1 ATOM 1025 C CZ3 . TRP A 1 129 ? -4.306 -112.615 -60.767 1.00 52.10 ? 129 TRP A CZ3 1 ATOM 1026 C CH2 . TRP A 1 129 ? -4.543 -113.563 -61.776 1.00 53.17 ? 129 TRP A CH2 1 ATOM 1027 N N . GLY A 1 130 ? -4.769 -107.762 -62.755 1.00 47.13 ? 130 GLY A N 1 ATOM 1028 C CA . GLY A 1 130 ? -4.445 -107.172 -64.033 1.00 46.67 ? 130 GLY A CA 1 ATOM 1029 C C . GLY A 1 130 ? -4.306 -105.680 -63.884 1.00 46.29 ? 130 GLY A C 1 ATOM 1030 O O . GLY A 1 130 ? -3.222 -105.180 -63.626 1.00 46.18 ? 130 GLY A O 1 ATOM 1031 N N . THR A 1 131 ? -5.417 -104.972 -64.014 1.00 46.31 ? 131 THR A N 1 ATOM 1032 C CA . THR A 1 131 ? -5.386 -103.513 -64.110 1.00 46.66 ? 131 THR A CA 1 ATOM 1033 C C . THR A 1 131 ? -6.280 -102.759 -63.118 1.00 46.61 ? 131 THR A C 1 ATOM 1034 O O . THR A 1 131 ? -6.092 -101.565 -62.896 1.00 46.34 ? 131 THR A O 1 ATOM 1035 C CB . THR A 1 131 ? -5.786 -103.077 -65.516 1.00 46.74 ? 131 THR A CB 1 ATOM 1036 O OG1 . THR A 1 131 ? -6.911 -103.856 -65.947 1.00 47.32 ? 131 THR A OG1 1 ATOM 1037 C CG2 . THR A 1 131 ? -4.639 -103.293 -66.476 1.00 47.29 ? 131 THR A CG2 1 ATOM 1038 N N . SER A 1 132 ? -7.249 -103.456 -62.531 1.00 46.83 ? 132 SER A N 1 ATOM 1039 C CA . SER A 1 132 ? -8.265 -102.820 -61.697 1.00 46.88 ? 132 SER A CA 1 ATOM 1040 C C . SER A 1 132 ? -8.474 -103.562 -60.380 1.00 46.95 ? 132 SER A C 1 ATOM 1041 O O . SER A 1 132 ? -7.856 -104.596 -60.143 1.00 46.98 ? 132 SER A O 1 ATOM 1042 C CB . SER A 1 132 ? -9.588 -102.734 -62.467 1.00 46.87 ? 132 SER A CB 1 ATOM 1043 O OG . SER A 1 132 ? -10.117 -104.024 -62.727 1.00 46.72 ? 132 SER A OG 1 ATOM 1044 N N . TRP A 1 133 ? -9.335 -103.012 -59.526 1.00 47.11 ? 133 TRP A N 1 ATOM 1045 C CA . TRP A 1 133 ? -9.770 -103.683 -58.311 1.00 47.23 ? 133 TRP A CA 1 ATOM 1046 C C . TRP A 1 133 ? -10.940 -104.571 -58.649 1.00 47.90 ? 133 TRP A C 1 ATOM 1047 O O . TRP A 1 133 ? -11.772 -104.213 -59.474 1.00 48.00 ? 133 TRP A O 1 ATOM 1048 C CB . TRP A 1 133 ? -10.213 -102.675 -57.263 1.00 46.81 ? 133 TRP A CB 1 ATOM 1049 C CG . TRP A 1 133 ? -9.117 -101.821 -56.732 1.00 46.11 ? 133 TRP A CG 1 ATOM 1050 C CD1 . TRP A 1 133 ? -8.894 -100.508 -57.018 1.00 46.15 ? 133 TRP A CD1 1 ATOM 1051 C CD2 . TRP A 1 133 ? -8.096 -102.208 -55.808 1.00 45.58 ? 133 TRP A CD2 1 ATOM 1052 N NE1 . TRP A 1 133 ? -7.797 -100.048 -56.331 1.00 45.86 ? 133 TRP A NE1 1 ATOM 1053 C CE2 . TRP A 1 133 ? -7.288 -101.072 -55.579 1.00 45.41 ? 133 TRP A CE2 1 ATOM 1054 C CE3 . TRP A 1 133 ? -7.779 -103.406 -55.156 1.00 45.48 ? 133 TRP A CE3 1 ATOM 1055 C CZ2 . TRP A 1 133 ? -6.184 -101.096 -54.732 1.00 44.93 ? 133 TRP A CZ2 1 ATOM 1056 C CZ3 . TRP A 1 133 ? -6.683 -103.429 -54.309 1.00 45.64 ? 133 TRP A CZ3 1 ATOM 1057 C CH2 . TRP A 1 133 ? -5.896 -102.281 -54.106 1.00 45.24 ? 133 TRP A CH2 1 ATOM 1058 N N . GLN A 1 134 ? -11.003 -105.727 -58.004 1.00 48.90 ? 134 GLN A N 1 ATOM 1059 C CA . GLN A 1 134 ? -12.071 -106.694 -58.231 1.00 49.95 ? 134 GLN A CA 1 ATOM 1060 C C . GLN A 1 134 ? -12.566 -107.259 -56.919 1.00 50.27 ? 134 GLN A C 1 ATOM 1061 O O . GLN A 1 134 ? -11.774 -107.541 -56.018 1.00 50.46 ? 134 GLN A O 1 ATOM 1062 C CB . GLN A 1 134 ? -11.568 -107.852 -59.083 1.00 50.05 ? 134 GLN A CB 1 ATOM 1063 C CG . GLN A 1 134 ? -11.468 -107.556 -60.562 1.00 52.03 ? 134 GLN A CG 1 ATOM 1064 C CD . GLN A 1 134 ? -11.303 -108.819 -61.392 1.00 54.92 ? 134 GLN A CD 1 ATOM 1065 O OE1 . GLN A 1 134 ? -10.927 -108.753 -62.570 1.00 56.72 ? 134 GLN A OE1 1 ATOM 1066 N NE2 . GLN A 1 134 ? -11.578 -109.980 -60.782 1.00 54.97 ? 134 GLN A NE2 1 ATOM 1067 N N . THR A 1 135 ? -13.875 -107.435 -56.812 1.00 50.75 ? 135 THR A N 1 ATOM 1068 C CA . THR A 1 135 ? -14.431 -108.150 -55.674 1.00 51.24 ? 135 THR A CA 1 ATOM 1069 C C . THR A 1 135 ? -14.328 -109.636 -55.966 1.00 51.57 ? 135 THR A C 1 ATOM 1070 O O . THR A 1 135 ? -14.423 -110.042 -57.120 1.00 51.53 ? 135 THR A O 1 ATOM 1071 C CB . THR A 1 135 ? -15.900 -107.805 -55.443 1.00 51.22 ? 135 THR A CB 1 ATOM 1072 O OG1 . THR A 1 135 ? -16.677 -108.298 -56.540 1.00 51.34 ? 135 THR A OG1 1 ATOM 1073 C CG2 . THR A 1 135 ? -16.085 -106.301 -55.310 1.00 51.30 ? 135 THR A CG2 1 ATOM 1074 N N . VAL A 1 136 ? -14.143 -110.441 -54.925 1.00 52.08 ? 136 VAL A N 1 ATOM 1075 C CA . VAL A 1 136 ? -14.024 -111.888 -55.093 1.00 52.49 ? 136 VAL A CA 1 ATOM 1076 C C . VAL A 1 136 ? -15.359 -112.602 -54.814 1.00 52.84 ? 136 VAL A C 1 ATOM 1077 O O . VAL A 1 136 ? -16.254 -112.018 -54.193 1.00 52.76 ? 136 VAL A O 1 ATOM 1078 C CB . VAL A 1 136 ? -12.863 -112.464 -54.251 1.00 52.46 ? 136 VAL A CB 1 ATOM 1079 C CG1 . VAL A 1 136 ? -11.570 -111.701 -54.549 1.00 52.52 ? 136 VAL A CG1 1 ATOM 1080 C CG2 . VAL A 1 136 ? -13.190 -112.429 -52.772 1.00 52.30 ? 136 VAL A CG2 1 ATOM 1081 N N . PRO A 1 137 ? -15.512 -113.854 -55.301 1.00 53.15 ? 137 PRO A N 1 ATOM 1082 C CA . PRO A 1 137 ? -16.761 -114.574 -55.063 1.00 53.17 ? 137 PRO A CA 1 ATOM 1083 C C . PRO A 1 137 ? -17.092 -114.638 -53.581 1.00 53.22 ? 137 PRO A C 1 ATOM 1084 O O . PRO A 1 137 ? -16.224 -114.951 -52.751 1.00 53.15 ? 137 PRO A O 1 ATOM 1085 C CB . PRO A 1 137 ? -16.466 -115.975 -55.596 1.00 53.06 ? 137 PRO A CB 1 ATOM 1086 C CG . PRO A 1 137 ? -15.465 -115.755 -56.656 1.00 53.41 ? 137 PRO A CG 1 ATOM 1087 C CD . PRO A 1 137 ? -14.597 -114.628 -56.162 1.00 53.25 ? 137 PRO A CD 1 ATOM 1088 N N . GLY A 1 138 ? -18.342 -114.320 -53.265 1.00 53.26 ? 138 GLY A N 1 ATOM 1089 C CA . GLY A 1 138 ? -18.825 -114.354 -51.894 1.00 53.22 ? 138 GLY A CA 1 ATOM 1090 C C . GLY A 1 138 ? -18.688 -113.016 -51.200 1.00 53.10 ? 138 GLY A C 1 ATOM 1091 O O . GLY A 1 138 ? -19.057 -112.875 -50.032 1.00 53.20 ? 138 GLY A O 1 ATOM 1092 N N . ALA A 1 139 ? -18.152 -112.031 -51.915 1.00 52.86 ? 139 ALA A N 1 ATOM 1093 C CA . ALA A 1 139 ? -18.008 -110.690 -51.366 1.00 52.55 ? 139 ALA A CA 1 ATOM 1094 C C . ALA A 1 139 ? -19.378 -110.032 -51.227 1.00 52.29 ? 139 ALA A C 1 ATOM 1095 O O . ALA A 1 139 ? -20.259 -110.249 -52.070 1.00 51.95 ? 139 ALA A O 1 ATOM 1096 C CB . ALA A 1 139 ? -17.082 -109.843 -52.236 1.00 52.57 ? 139 ALA A CB 1 ATOM 1097 N N . PRO A 1 140 ? -19.569 -109.247 -50.147 1.00 52.15 ? 140 PRO A N 1 ATOM 1098 C CA . PRO A 1 140 ? -20.814 -108.513 -49.956 1.00 52.10 ? 140 PRO A CA 1 ATOM 1099 C C . PRO A 1 140 ? -21.030 -107.589 -51.129 1.00 52.21 ? 140 PRO A C 1 ATOM 1100 O O . PRO A 1 140 ? -20.102 -106.891 -51.544 1.00 52.55 ? 140 PRO A O 1 ATOM 1101 C CB . PRO A 1 140 ? -20.570 -107.700 -48.678 1.00 51.90 ? 140 PRO A CB 1 ATOM 1102 C CG . PRO A 1 140 ? -19.116 -107.734 -48.461 1.00 52.00 ? 140 PRO A CG 1 ATOM 1103 C CD . PRO A 1 140 ? -18.636 -109.024 -49.031 1.00 52.10 ? 140 PRO A CD 1 ATOM 1104 N N . SER A 1 141 ? -22.249 -107.599 -51.659 1.00 52.23 ? 141 SER A N 1 ATOM 1105 C CA . SER A 1 141 ? -22.588 -106.867 -52.881 1.00 51.98 ? 141 SER A CA 1 ATOM 1106 C C . SER A 1 141 ? -22.562 -105.346 -52.742 1.00 51.53 ? 141 SER A C 1 ATOM 1107 O O . SER A 1 141 ? -22.541 -104.645 -53.741 1.00 51.68 ? 141 SER A O 1 ATOM 1108 C CB . SER A 1 141 ? -23.942 -107.338 -53.414 1.00 52.06 ? 141 SER A CB 1 ATOM 1109 O OG . SER A 1 141 ? -24.865 -107.486 -52.348 1.00 52.88 ? 141 SER A OG 1 ATOM 1110 N N . TRP A 1 142 ? -22.553 -104.831 -51.519 1.00 51.19 ? 142 TRP A N 1 ATOM 1111 C CA . TRP A 1 142 ? -22.449 -103.389 -51.336 1.00 51.15 ? 142 TRP A CA 1 ATOM 1112 C C . TRP A 1 142 ? -21.062 -102.844 -51.675 1.00 50.58 ? 142 TRP A C 1 ATOM 1113 O O . TRP A 1 142 ? -20.896 -101.638 -51.840 1.00 50.82 ? 142 TRP A O 1 ATOM 1114 C CB . TRP A 1 142 ? -22.872 -102.953 -49.925 1.00 51.64 ? 142 TRP A CB 1 ATOM 1115 C CG . TRP A 1 142 ? -21.966 -103.420 -48.818 1.00 53.18 ? 142 TRP A CG 1 ATOM 1116 C CD1 . TRP A 1 142 ? -22.222 -104.419 -47.920 1.00 54.09 ? 142 TRP A CD1 1 ATOM 1117 C CD2 . TRP A 1 142 ? -20.662 -102.911 -48.489 1.00 54.10 ? 142 TRP A CD2 1 ATOM 1118 N NE1 . TRP A 1 142 ? -21.162 -104.562 -47.058 1.00 54.43 ? 142 TRP A NE1 1 ATOM 1119 C CE2 . TRP A 1 142 ? -20.191 -103.652 -47.387 1.00 54.38 ? 142 TRP A CE2 1 ATOM 1120 C CE3 . TRP A 1 142 ? -19.845 -101.905 -49.024 1.00 54.47 ? 142 TRP A CE3 1 ATOM 1121 C CZ2 . TRP A 1 142 ? -18.936 -103.422 -46.811 1.00 54.84 ? 142 TRP A CZ2 1 ATOM 1122 C CZ3 . TRP A 1 142 ? -18.597 -101.673 -48.447 1.00 54.69 ? 142 TRP A CZ3 1 ATOM 1123 C CH2 . TRP A 1 142 ? -18.158 -102.426 -47.352 1.00 54.85 ? 142 TRP A CH2 1 ATOM 1124 N N . LEU A 1 143 ? -20.068 -103.721 -51.767 1.00 49.85 ? 143 LEU A N 1 ATOM 1125 C CA . LEU A 1 143 ? -18.722 -103.297 -52.150 1.00 49.16 ? 143 LEU A CA 1 ATOM 1126 C C . LEU A 1 143 ? -18.628 -102.817 -53.596 1.00 48.82 ? 143 LEU A C 1 ATOM 1127 O O . LEU A 1 143 ? -17.746 -102.026 -53.920 1.00 48.64 ? 143 LEU A O 1 ATOM 1128 C CB . LEU A 1 143 ? -17.712 -104.415 -51.909 1.00 49.13 ? 143 LEU A CB 1 ATOM 1129 C CG . LEU A 1 143 ? -17.056 -104.456 -50.527 1.00 48.68 ? 143 LEU A CG 1 ATOM 1130 C CD1 . LEU A 1 143 ? -16.356 -105.789 -50.355 1.00 48.95 ? 143 LEU A CD1 1 ATOM 1131 C CD2 . LEU A 1 143 ? -16.078 -103.314 -50.317 1.00 47.33 ? 143 LEU A CD2 1 ATOM 1132 N N . ASP A 1 144 ? -19.543 -103.292 -54.444 1.00 48.53 ? 144 ASP A N 1 ATOM 1133 C CA . ASP A 1 144 ? -19.603 -102.952 -55.876 1.00 48.36 ? 144 ASP A CA 1 ATOM 1134 C C . ASP A 1 144 ? -19.383 -101.481 -56.216 1.00 48.03 ? 144 ASP A C 1 ATOM 1135 O O . ASP A 1 144 ? -18.682 -101.167 -57.174 1.00 48.08 ? 144 ASP A O 1 ATOM 1136 C CB . ASP A 1 144 ? -20.915 -103.440 -56.495 1.00 48.37 ? 144 ASP A CB 1 ATOM 1137 C CG . ASP A 1 144 ? -20.859 -104.910 -56.907 1.00 49.80 ? 144 ASP A CG 1 ATOM 1138 O OD1 . ASP A 1 144 ? -19.828 -105.575 -56.648 1.00 51.58 ? 144 ASP A OD1 1 ATOM 1139 O OD2 . ASP A 1 144 ? -21.845 -105.411 -57.497 1.00 50.71 ? 144 ASP A OD2 1 ATOM 1140 N N . LEU A 1 145 ? -19.976 -100.590 -55.429 1.00 47.55 ? 145 LEU A N 1 ATOM 1141 C CA . LEU A 1 145 ? -19.815 -99.157 -55.621 1.00 47.09 ? 145 LEU A CA 1 ATOM 1142 C C . LEU A 1 145 ? -18.408 -98.655 -55.275 1.00 46.93 ? 145 LEU A C 1 ATOM 1143 O O . LEU A 1 145 ? -17.720 -98.157 -56.154 1.00 47.07 ? 145 LEU A O 1 ATOM 1144 C CB . LEU A 1 145 ? -20.881 -98.382 -54.840 1.00 47.25 ? 145 LEU A CB 1 ATOM 1145 C CG . LEU A 1 145 ? -20.802 -96.851 -54.847 1.00 47.59 ? 145 LEU A CG 1 ATOM 1146 C CD1 . LEU A 1 145 ? -21.319 -96.280 -56.168 1.00 47.64 ? 145 LEU A CD1 1 ATOM 1147 C CD2 . LEU A 1 145 ? -21.561 -96.255 -53.666 1.00 47.46 ? 145 LEU A CD2 1 ATOM 1148 N N . PRO A 1 146 ? -17.973 -98.774 -53.998 1.00 46.79 ? 146 PRO A N 1 ATOM 1149 C CA . PRO A 1 146 ? -16.651 -98.252 -53.629 1.00 46.40 ? 146 PRO A CA 1 ATOM 1150 C C . PRO A 1 146 ? -15.544 -98.684 -54.583 1.00 46.17 ? 146 PRO A C 1 ATOM 1151 O O . PRO A 1 146 ? -14.655 -97.888 -54.896 1.00 46.16 ? 146 PRO A O 1 ATOM 1152 C CB . PRO A 1 146 ? -16.414 -98.863 -52.254 1.00 46.43 ? 146 PRO A CB 1 ATOM 1153 C CG . PRO A 1 146 ? -17.759 -99.004 -51.679 1.00 46.64 ? 146 PRO A CG 1 ATOM 1154 C CD . PRO A 1 146 ? -18.675 -99.329 -52.822 1.00 46.85 ? 146 PRO A CD 1 ATOM 1155 N N . ILE A 1 147 ? -15.607 -99.933 -55.041 1.00 45.89 ? 147 ILE A N 1 ATOM 1156 C CA . ILE A 1 147 ? -14.677 -100.441 -56.050 1.00 45.52 ? 147 ILE A CA 1 ATOM 1157 C C . ILE A 1 147 ? -14.727 -99.574 -57.311 1.00 45.35 ? 147 ILE A C 1 ATOM 1158 O O . ILE A 1 147 ? -13.686 -99.151 -57.807 1.00 45.48 ? 147 ILE A O 1 ATOM 1159 C CB . ILE A 1 147 ? -14.929 -101.947 -56.367 1.00 45.43 ? 147 ILE A CB 1 ATOM 1160 C CG1 . ILE A 1 147 ? -14.492 -102.839 -55.190 1.00 44.97 ? 147 ILE A CG1 1 ATOM 1161 C CG2 . ILE A 1 147 ? -14.249 -102.375 -57.670 1.00 45.56 ? 147 ILE A CG2 1 ATOM 1162 C CD1 . ILE A 1 147 ? -13.178 -102.442 -54.508 1.00 43.91 ? 147 ILE A CD1 1 ATOM 1163 N N . LYS A 1 148 ? -15.930 -99.292 -57.806 1.00 45.02 ? 148 LYS A N 1 ATOM 1164 C CA . LYS A 1 148 ? -16.090 -98.387 -58.938 1.00 44.83 ? 148 LYS A CA 1 ATOM 1165 C C . LYS A 1 148 ? -15.463 -97.037 -58.632 1.00 44.42 ? 148 LYS A C 1 ATOM 1166 O O . LYS A 1 148 ? -14.695 -96.509 -59.435 1.00 44.75 ? 148 LYS A O 1 ATOM 1167 C CB . LYS A 1 148 ? -17.560 -98.206 -59.309 1.00 44.89 ? 148 LYS A CB 1 ATOM 1168 C CG . LYS A 1 148 ? -18.157 -99.360 -60.095 1.00 45.95 ? 148 LYS A CG 1 ATOM 1169 C CD . LYS A 1 148 ? -19.544 -98.998 -60.635 1.00 47.91 ? 148 LYS A CD 1 ATOM 1170 C CE . LYS A 1 148 ? -20.279 -100.228 -61.169 1.00 48.74 ? 148 LYS A CE 1 ATOM 1171 N NZ . LYS A 1 148 ? -21.406 -99.825 -62.056 1.00 49.76 ? 148 LYS A NZ 1 ATOM 1172 N N . VAL A 1 149 ? -15.769 -96.493 -57.461 1.00 43.86 ? 149 VAL A N 1 ATOM 1173 C CA . VAL A 1 149 ? -15.228 -95.197 -57.057 1.00 43.43 ? 149 VAL A CA 1 ATOM 1174 C C . VAL A 1 149 ? -13.691 -95.200 -57.015 1.00 43.41 ? 149 VAL A C 1 ATOM 1175 O O . VAL A 1 149 ? -13.044 -94.219 -57.394 1.00 43.39 ? 149 VAL A O 1 ATOM 1176 C CB . VAL A 1 149 ? -15.814 -94.742 -55.705 1.00 43.25 ? 149 VAL A CB 1 ATOM 1177 C CG1 . VAL A 1 149 ? -15.153 -93.459 -55.227 1.00 42.69 ? 149 VAL A CG1 1 ATOM 1178 C CG2 . VAL A 1 149 ? -17.326 -94.564 -55.813 1.00 42.79 ? 149 VAL A CG2 1 ATOM 1179 N N . LEU A 1 150 ? -13.116 -96.311 -56.570 1.00 43.27 ? 150 LEU A N 1 ATOM 1180 C CA . LEU A 1 150 ? -11.664 -96.432 -56.500 1.00 43.14 ? 150 LEU A CA 1 ATOM 1181 C C . LEU A 1 150 ? -11.036 -96.775 -57.848 1.00 43.16 ? 150 LEU A C 1 ATOM 1182 O O . LEU A 1 150 ? -9.908 -96.380 -58.123 1.00 43.14 ? 150 LEU A O 1 ATOM 1183 C CB . LEU A 1 150 ? -11.252 -97.448 -55.426 1.00 42.92 ? 150 LEU A CB 1 ATOM 1184 C CG . LEU A 1 150 ? -11.361 -96.951 -53.981 1.00 42.16 ? 150 LEU A CG 1 ATOM 1185 C CD1 . LEU A 1 150 ? -11.489 -98.116 -53.042 1.00 42.32 ? 150 LEU A CD1 1 ATOM 1186 C CD2 . LEU A 1 150 ? -10.180 -96.086 -53.594 1.00 41.10 ? 150 LEU A CD2 1 ATOM 1187 N N . ASN A 1 151 ? -11.770 -97.501 -58.686 1.00 43.19 ? 151 ASN A N 1 ATOM 1188 C CA . ASN A 1 151 ? -11.243 -97.921 -59.972 1.00 43.38 ? 151 ASN A CA 1 ATOM 1189 C C . ASN A 1 151 ? -11.185 -96.800 -61.007 1.00 43.64 ? 151 ASN A C 1 ATOM 1190 O O . ASN A 1 151 ? -10.604 -96.961 -62.086 1.00 43.97 ? 151 ASN A O 1 ATOM 1191 C CB . ASN A 1 151 ? -11.976 -99.158 -60.498 1.00 43.22 ? 151 ASN A CB 1 ATOM 1192 C CG . ASN A 1 151 ? -11.181 -100.442 -60.273 1.00 43.20 ? 151 ASN A CG 1 ATOM 1193 O OD1 . ASN A 1 151 ? -9.947 -100.421 -60.172 1.00 42.82 ? 151 ASN A OD1 1 ATOM 1194 N ND2 . ASN A 1 151 ? -11.885 -101.566 -60.207 1.00 42.95 ? 151 ASN A ND2 1 ATOM 1195 N N . ALA A 1 152 ? -11.762 -95.656 -60.660 1.00 43.71 ? 152 ALA A N 1 ATOM 1196 C CA . ALA A 1 152 ? -11.653 -94.463 -61.489 1.00 43.85 ? 152 ALA A CA 1 ATOM 1197 C C . ALA A 1 152 ? -10.279 -93.790 -61.365 1.00 43.95 ? 152 ALA A C 1 ATOM 1198 O O . ALA A 1 152 ? -9.946 -92.912 -62.155 1.00 44.25 ? 152 ALA A O 1 ATOM 1199 C CB . ALA A 1 152 ? -12.770 -93.476 -61.152 1.00 43.83 ? 152 ALA A CB 1 ATOM 1200 N N . ASP A 1 153 ? -9.483 -94.205 -60.383 1.00 44.07 ? 153 ASP A N 1 ATOM 1201 C CA . ASP A 1 153 ? -8.182 -93.591 -60.130 1.00 44.35 ? 153 ASP A CA 1 ATOM 1202 C C . ASP A 1 153 ? -7.082 -94.330 -60.901 1.00 44.90 ? 153 ASP A C 1 ATOM 1203 O O . ASP A 1 153 ? -6.424 -95.239 -60.373 1.00 44.84 ? 153 ASP A O 1 ATOM 1204 C CB . ASP A 1 153 ? -7.907 -93.555 -58.620 1.00 44.14 ? 153 ASP A CB 1 ATOM 1205 C CG . ASP A 1 153 ? -6.570 -92.920 -58.262 1.00 43.94 ? 153 ASP A CG 1 ATOM 1206 O OD1 . ASP A 1 153 ? -5.666 -92.814 -59.118 1.00 43.96 ? 153 ASP A OD1 1 ATOM 1207 O OD2 . ASP A 1 153 ? -6.414 -92.542 -57.086 1.00 43.94 ? 153 ASP A OD2 1 ATOM 1208 N N . GLN A 1 154 ? -6.883 -93.920 -62.154 1.00 45.45 ? 154 GLN A N 1 ATOM 1209 C CA . GLN A 1 154 ? -5.919 -94.575 -63.037 1.00 46.00 ? 154 GLN A CA 1 ATOM 1210 C C . GLN A 1 154 ? -4.465 -94.391 -62.574 1.00 45.91 ? 154 GLN A C 1 ATOM 1211 O O . GLN A 1 154 ? -3.585 -95.155 -62.978 1.00 46.18 ? 154 GLN A O 1 ATOM 1212 C CB . GLN A 1 154 ? -6.106 -94.111 -64.487 1.00 46.25 ? 154 GLN A CB 1 ATOM 1213 C CG . GLN A 1 154 ? -7.514 -94.364 -65.068 1.00 48.47 ? 154 GLN A CG 1 ATOM 1214 C CD . GLN A 1 154 ? -7.755 -95.806 -65.580 1.00 51.71 ? 154 GLN A CD 1 ATOM 1215 O OE1 . GLN A 1 154 ? -8.844 -96.118 -66.074 1.00 52.62 ? 154 GLN A OE1 1 ATOM 1216 N NE2 . GLN A 1 154 ? -6.743 -96.677 -65.469 1.00 52.85 ? 154 GLN A NE2 1 ATOM 1217 N N . GLY A 1 155 ? -4.225 -93.390 -61.725 1.00 45.66 ? 155 GLY A N 1 ATOM 1218 C CA . GLY A 1 155 ? -2.904 -93.151 -61.147 1.00 45.36 ? 155 GLY A CA 1 ATOM 1219 C C . GLY A 1 155 ? -2.525 -94.239 -60.161 1.00 45.27 ? 155 GLY A C 1 ATOM 1220 O O . GLY A 1 155 ? -1.465 -94.856 -60.281 1.00 45.34 ? 155 GLY A O 1 ATOM 1221 N N . THR A 1 156 ? -3.403 -94.467 -59.184 1.00 45.08 ? 156 THR A N 1 ATOM 1222 C CA . THR A 1 156 ? -3.252 -95.547 -58.209 1.00 44.71 ? 156 THR A CA 1 ATOM 1223 C C . THR A 1 156 ? -3.053 -96.880 -58.919 1.00 44.53 ? 156 THR A C 1 ATOM 1224 O O . THR A 1 156 ? -2.159 -97.648 -58.569 1.00 44.46 ? 156 THR A O 1 ATOM 1225 C CB . THR A 1 156 ? -4.477 -95.610 -57.271 1.00 44.71 ? 156 THR A CB 1 ATOM 1226 O OG1 . THR A 1 156 ? -4.416 -94.517 -56.347 1.00 44.66 ? 156 THR A OG1 1 ATOM 1227 C CG2 . THR A 1 156 ? -4.527 -96.921 -56.497 1.00 44.62 ? 156 THR A CG2 1 ATOM 1228 N N . SER A 1 157 ? -3.877 -97.129 -59.931 1.00 44.40 ? 157 SER A N 1 ATOM 1229 C CA . SER A 1 157 ? -3.808 -98.359 -60.706 1.00 44.34 ? 157 SER A CA 1 ATOM 1230 C C . SER A 1 157 ? -2.445 -98.577 -61.368 1.00 44.44 ? 157 SER A C 1 ATOM 1231 O O . SER A 1 157 ? -1.943 -99.701 -61.401 1.00 44.93 ? 157 SER A O 1 ATOM 1232 C CB . SER A 1 157 ? -4.912 -98.391 -61.759 1.00 44.27 ? 157 SER A CB 1 ATOM 1233 O OG . SER A 1 157 ? -4.827 -99.574 -62.525 1.00 44.10 ? 157 SER A OG 1 ATOM 1234 N N . ALA A 1 158 ? -1.844 -97.506 -61.879 1.00 44.17 ? 158 ALA A N 1 ATOM 1235 C CA . ALA A 1 158 ? -0.585 -97.618 -62.601 1.00 43.73 ? 158 ALA A CA 1 ATOM 1236 C C . ALA A 1 158 ? 0.582 -97.760 -61.656 1.00 43.63 ? 158 ALA A C 1 ATOM 1237 O O . ALA A 1 158 ? 1.604 -98.332 -62.025 1.00 43.79 ? 158 ALA A O 1 ATOM 1238 C CB . ALA A 1 158 ? -0.388 -96.447 -63.472 1.00 43.70 ? 158 ALA A CB 1 ATOM 1239 N N . THR A 1 159 ? 0.431 -97.231 -60.445 1.00 43.48 ? 159 THR A N 1 ATOM 1240 C CA . THR A 1 159 ? 1.448 -97.378 -59.410 1.00 43.41 ? 159 THR A CA 1 ATOM 1241 C C . THR A 1 159 ? 1.447 -98.804 -58.901 1.00 43.21 ? 159 THR A C 1 ATOM 1242 O O . THR A 1 159 ? 2.503 -99.429 -58.789 1.00 43.35 ? 159 THR A O 1 ATOM 1243 C CB . THR A 1 159 ? 1.188 -96.458 -58.220 1.00 43.57 ? 159 THR A CB 1 ATOM 1244 O OG1 . THR A 1 159 ? 0.895 -95.138 -58.692 1.00 43.84 ? 159 THR A OG1 1 ATOM 1245 C CG2 . THR A 1 159 ? 2.407 -96.428 -57.285 1.00 43.68 ? 159 THR A CG2 1 ATOM 1246 N N . VAL A 1 160 ? 0.255 -99.309 -58.597 1.00 42.86 ? 160 VAL A N 1 ATOM 1247 C CA . VAL A 1 160 ? 0.102 -100.668 -58.123 1.00 42.75 ? 160 VAL A CA 1 ATOM 1248 C C . VAL A 1 160 ? 0.653 -101.633 -59.163 1.00 42.97 ? 160 VAL A C 1 ATOM 1249 O O . VAL A 1 160 ? 1.498 -102.471 -58.840 1.00 42.97 ? 160 VAL A O 1 ATOM 1250 C CB . VAL A 1 160 ? -1.358 -100.979 -57.744 1.00 42.67 ? 160 VAL A CB 1 ATOM 1251 C CG1 . VAL A 1 160 ? -1.569 -102.473 -57.529 1.00 42.50 ? 160 VAL A CG1 1 ATOM 1252 C CG2 . VAL A 1 160 ? -1.733 -100.222 -56.493 1.00 42.32 ? 160 VAL A CG2 1 ATOM 1253 N N . GLN A 1 161 ? 0.213 -101.490 -60.411 1.00 43.21 ? 161 GLN A N 1 ATOM 1254 C CA . GLN A 1 161 ? 0.726 -102.322 -61.502 1.00 43.78 ? 161 GLN A CA 1 ATOM 1255 C C . GLN A 1 161 ? 2.256 -102.396 -61.552 1.00 44.10 ? 161 GLN A C 1 ATOM 1256 O O . GLN A 1 161 ? 2.822 -103.421 -61.935 1.00 44.07 ? 161 GLN A O 1 ATOM 1257 C CB . GLN A 1 161 ? 0.199 -101.836 -62.843 1.00 43.73 ? 161 GLN A CB 1 ATOM 1258 C CG . GLN A 1 161 ? -1.198 -102.304 -63.161 1.00 44.17 ? 161 GLN A CG 1 ATOM 1259 C CD . GLN A 1 161 ? -1.698 -101.743 -64.479 1.00 44.94 ? 161 GLN A CD 1 ATOM 1260 O OE1 . GLN A 1 161 ? -1.210 -102.109 -65.553 1.00 45.57 ? 161 GLN A OE1 1 ATOM 1261 N NE2 . GLN A 1 161 ? -2.675 -100.846 -64.405 1.00 44.71 ? 161 GLN A NE2 1 ATOM 1262 N N . MET A 1 162 ? 2.918 -101.312 -61.165 1.00 44.52 ? 162 MET A N 1 ATOM 1263 C CA . MET A 1 162 ? 4.362 -101.269 -61.215 1.00 45.12 ? 162 MET A CA 1 ATOM 1264 C C . MET A 1 162 ? 4.965 -101.945 -60.000 1.00 45.45 ? 162 MET A C 1 ATOM 1265 O O . MET A 1 162 ? 5.976 -102.635 -60.115 1.00 45.91 ? 162 MET A O 1 ATOM 1266 C CB . MET A 1 162 ? 4.869 -99.840 -61.350 1.00 45.28 ? 162 MET A CB 1 ATOM 1267 C CG . MET A 1 162 ? 6.291 -99.762 -61.858 1.00 45.99 ? 162 MET A CG 1 ATOM 1268 S SD . MET A 1 162 ? 7.034 -98.239 -61.285 1.00 49.03 ? 162 MET A SD 1 ATOM 1269 C CE . MET A 1 162 ? 8.771 -98.694 -61.219 1.00 49.08 ? 162 MET A CE 1 ATOM 1270 N N . LEU A 1 163 ? 4.350 -101.753 -58.836 1.00 45.70 ? 163 LEU A N 1 ATOM 1271 C CA . LEU A 1 163 ? 4.785 -102.456 -57.630 1.00 45.85 ? 163 LEU A CA 1 ATOM 1272 C C . LEU A 1 163 ? 4.662 -103.961 -57.795 1.00 45.97 ? 163 LEU A C 1 ATOM 1273 O O . LEU A 1 163 ? 5.548 -104.699 -57.399 1.00 46.18 ? 163 LEU A O 1 ATOM 1274 C CB . LEU A 1 163 ? 3.988 -102.012 -56.406 1.00 45.73 ? 163 LEU A CB 1 ATOM 1275 C CG . LEU A 1 163 ? 4.264 -100.614 -55.849 1.00 45.94 ? 163 LEU A CG 1 ATOM 1276 C CD1 . LEU A 1 163 ? 3.338 -100.331 -54.687 1.00 44.88 ? 163 LEU A CD1 1 ATOM 1277 C CD2 . LEU A 1 163 ? 5.722 -100.441 -55.430 1.00 46.33 ? 163 LEU A CD2 1 ATOM 1278 N N . LEU A 1 164 ? 3.569 -104.406 -58.399 1.00 46.25 ? 164 LEU A N 1 ATOM 1279 C CA . LEU A 1 164 ? 3.317 -105.826 -58.548 1.00 46.66 ? 164 LEU A CA 1 ATOM 1280 C C . LEU A 1 164 ? 4.112 -106.450 -59.679 1.00 47.28 ? 164 LEU A C 1 ATOM 1281 O O . LEU A 1 164 ? 4.798 -107.444 -59.460 1.00 47.69 ? 164 LEU A O 1 ATOM 1282 C CB . LEU A 1 164 ? 1.828 -106.102 -58.742 1.00 46.53 ? 164 LEU A CB 1 ATOM 1283 C CG . LEU A 1 164 ? 0.878 -105.717 -57.609 1.00 46.10 ? 164 LEU A CG 1 ATOM 1284 C CD1 . LEU A 1 164 ? -0.496 -106.237 -57.931 1.00 45.95 ? 164 LEU A CD1 1 ATOM 1285 C CD2 . LEU A 1 164 ? 1.339 -106.242 -56.261 1.00 45.26 ? 164 LEU A CD2 1 ATOM 1286 N N . ASN A 1 165 ? 4.026 -105.870 -60.878 1.00 47.83 ? 165 ASN A N 1 ATOM 1287 C CA . ASN A 1 165 ? 4.641 -106.465 -62.068 1.00 48.20 ? 165 ASN A CA 1 ATOM 1288 C C . ASN A 1 165 ? 6.156 -106.396 -62.087 1.00 48.03 ? 165 ASN A C 1 ATOM 1289 O O . ASN A 1 165 ? 6.810 -107.335 -62.517 1.00 47.95 ? 165 ASN A O 1 ATOM 1290 C CB . ASN A 1 165 ? 4.078 -105.849 -63.350 1.00 48.52 ? 165 ASN A CB 1 ATOM 1291 C CG . ASN A 1 165 ? 2.598 -106.137 -63.543 1.00 50.09 ? 165 ASN A CG 1 ATOM 1292 O OD1 . ASN A 1 165 ? 1.906 -106.573 -62.622 1.00 51.54 ? 165 ASN A OD1 1 ATOM 1293 N ND2 . ASN A 1 165 ? 2.108 -105.890 -64.752 1.00 52.40 ? 165 ASN A ND2 1 ATOM 1294 N N . ASP A 1 166 ? 6.709 -105.284 -61.624 1.00 48.20 ? 166 ASP A N 1 ATOM 1295 C CA . ASP A 1 166 ? 8.147 -105.078 -61.701 1.00 48.74 ? 166 ASP A CA 1 ATOM 1296 C C . ASP A 1 166 ? 8.816 -104.996 -60.338 1.00 48.83 ? 166 ASP A C 1 ATOM 1297 O O . ASP A 1 166 ? 9.677 -105.817 -60.030 1.00 49.20 ? 166 ASP A O 1 ATOM 1298 C CB . ASP A 1 166 ? 8.492 -103.822 -62.512 1.00 48.92 ? 166 ASP A CB 1 ATOM 1299 C CG . ASP A 1 166 ? 7.749 -103.745 -63.829 1.00 49.84 ? 166 ASP A CG 1 ATOM 1300 O OD1 . ASP A 1 166 ? 7.412 -102.611 -64.230 1.00 50.67 ? 166 ASP A OD1 1 ATOM 1301 O OD2 . ASP A 1 166 ? 7.498 -104.803 -64.458 1.00 51.12 ? 166 ASP A OD2 1 ATOM 1302 N N . THR A 1 167 ? 8.430 -104.011 -59.527 1.00 48.67 ? 167 THR A N 1 ATOM 1303 C CA . THR A 1 167 ? 9.170 -103.698 -58.307 1.00 48.60 ? 167 THR A CA 1 ATOM 1304 C C . THR A 1 167 ? 9.296 -104.888 -57.367 1.00 48.94 ? 167 THR A C 1 ATOM 1305 O O . THR A 1 167 ? 10.385 -105.160 -56.853 1.00 49.21 ? 167 THR A O 1 ATOM 1306 C CB . THR A 1 167 ? 8.570 -102.513 -57.556 1.00 48.47 ? 167 THR A CB 1 ATOM 1307 O OG1 . THR A 1 167 ? 8.245 -101.478 -58.488 1.00 48.42 ? 167 THR A OG1 1 ATOM 1308 C CG2 . THR A 1 167 ? 9.561 -101.978 -56.525 1.00 47.75 ? 167 THR A CG2 1 ATOM 1309 N N . CYS A 1 168 ? 8.197 -105.610 -57.169 1.00 49.01 ? 168 CYS A N 1 ATOM 1310 C CA . CYS A 1 168 ? 8.199 -106.754 -56.277 1.00 49.14 ? 168 CYS A CA 1 ATOM 1311 C C . CYS A 1 168 ? 9.162 -107.858 -56.752 1.00 48.96 ? 168 CYS A C 1 ATOM 1312 O O . CYS A 1 168 ? 10.109 -108.168 -56.028 1.00 49.04 ? 168 CYS A O 1 ATOM 1313 C CB . CYS A 1 168 ? 6.776 -107.253 -56.008 1.00 49.24 ? 168 CYS A CB 1 ATOM 1314 S SG . CYS A 1 168 ? 6.639 -108.641 -54.864 1.00 51.05 ? 168 CYS A SG 1 ATOM 1315 N N . PRO A 1 169 ? 8.969 -108.423 -57.971 1.00 48.86 ? 169 PRO A N 1 ATOM 1316 C CA . PRO A 1 169 ? 9.873 -109.528 -58.330 1.00 48.84 ? 169 PRO A CA 1 ATOM 1317 C C . PRO A 1 169 ? 11.335 -109.091 -58.389 1.00 49.06 ? 169 PRO A C 1 ATOM 1318 O O . PRO A 1 169 ? 12.228 -109.901 -58.130 1.00 49.06 ? 169 PRO A O 1 ATOM 1319 C CB . PRO A 1 169 ? 9.382 -109.965 -59.717 1.00 48.61 ? 169 PRO A CB 1 ATOM 1320 C CG . PRO A 1 169 ? 7.997 -109.448 -59.823 1.00 48.55 ? 169 PRO A CG 1 ATOM 1321 C CD . PRO A 1 169 ? 7.994 -108.161 -59.045 1.00 48.79 ? 169 PRO A CD 1 ATOM 1322 N N . LEU A 1 170 ? 11.568 -107.818 -58.712 1.00 49.24 ? 170 LEU A N 1 ATOM 1323 C CA . LEU A 1 170 ? 12.912 -107.263 -58.738 1.00 49.43 ? 170 LEU A CA 1 ATOM 1324 C C . LEU A 1 170 ? 13.458 -107.231 -57.323 1.00 49.50 ? 170 LEU A C 1 ATOM 1325 O O . LEU A 1 170 ? 14.503 -107.825 -57.039 1.00 49.56 ? 170 LEU A O 1 ATOM 1326 C CB . LEU A 1 170 ? 12.925 -105.853 -59.357 1.00 49.56 ? 170 LEU A CB 1 ATOM 1327 C CG . LEU A 1 170 ? 14.211 -105.000 -59.268 1.00 50.15 ? 170 LEU A CG 1 ATOM 1328 C CD1 . LEU A 1 170 ? 15.326 -105.476 -60.215 1.00 50.29 ? 170 LEU A CD1 1 ATOM 1329 C CD2 . LEU A 1 170 ? 13.926 -103.515 -59.490 1.00 50.13 ? 170 LEU A CD2 1 ATOM 1330 N N . PHE A 1 171 ? 12.731 -106.556 -56.437 1.00 49.60 ? 171 PHE A N 1 ATOM 1331 C CA . PHE A 1 171 ? 13.193 -106.342 -55.072 1.00 49.81 ? 171 PHE A CA 1 ATOM 1332 C C . PHE A 1 171 ? 13.474 -107.613 -54.278 1.00 50.18 ? 171 PHE A C 1 ATOM 1333 O O . PHE A 1 171 ? 14.356 -107.619 -53.418 1.00 50.20 ? 171 PHE A O 1 ATOM 1334 C CB . PHE A 1 171 ? 12.208 -105.480 -54.303 1.00 49.58 ? 171 PHE A CB 1 ATOM 1335 C CG . PHE A 1 171 ? 12.602 -105.251 -52.884 1.00 49.15 ? 171 PHE A CG 1 ATOM 1336 C CD1 . PHE A 1 171 ? 13.731 -104.500 -52.579 1.00 48.88 ? 171 PHE A CD1 1 ATOM 1337 C CD2 . PHE A 1 171 ? 11.854 -105.789 -51.852 1.00 48.91 ? 171 PHE A CD2 1 ATOM 1338 C CE1 . PHE A 1 171 ? 14.115 -104.277 -51.271 1.00 48.48 ? 171 PHE A CE1 1 ATOM 1339 C CE2 . PHE A 1 171 ? 12.223 -105.572 -50.535 1.00 49.48 ? 171 PHE A CE2 1 ATOM 1340 C CZ . PHE A 1 171 ? 13.363 -104.810 -50.243 1.00 49.30 ? 171 PHE A CZ 1 ATOM 1341 N N . VAL A 1 172 ? 12.732 -108.680 -54.570 1.00 50.60 ? 172 VAL A N 1 ATOM 1342 C CA . VAL A 1 172 ? 12.882 -109.947 -53.841 1.00 51.13 ? 172 VAL A CA 1 ATOM 1343 C C . VAL A 1 172 ? 14.011 -110.854 -54.357 1.00 51.52 ? 172 VAL A C 1 ATOM 1344 O O . VAL A 1 172 ? 14.652 -111.554 -53.561 1.00 51.51 ? 172 VAL A O 1 ATOM 1345 C CB . VAL A 1 172 ? 11.548 -110.723 -53.725 1.00 51.06 ? 172 VAL A CB 1 ATOM 1346 C CG1 . VAL A 1 172 ? 10.513 -109.861 -53.040 1.00 50.81 ? 172 VAL A CG1 1 ATOM 1347 C CG2 . VAL A 1 172 ? 11.050 -111.150 -55.085 1.00 51.33 ? 172 VAL A CG2 1 ATOM 1348 N N . ARG A 1 173 ? 14.284 -110.787 -55.653 1.00 51.94 ? 173 ARG A N 1 ATOM 1349 C CA . ARG A 1 173 ? 15.437 -111.473 -56.199 1.00 52.29 ? 173 ARG A CA 1 ATOM 1350 C C . ARG A 1 173 ? 16.608 -110.835 -55.478 1.00 52.61 ? 173 ARG A C 1 ATOM 1351 O O . ARG A 1 173 ? 17.577 -111.502 -55.116 1.00 52.83 ? 173 ARG A O 1 ATOM 1352 C CB . ARG A 1 173 ? 15.544 -111.242 -57.704 1.00 52.23 ? 173 ARG A CB 1 ATOM 1353 C CG . ARG A 1 173 ? 14.591 -112.088 -58.532 1.00 52.95 ? 173 ARG A CG 1 ATOM 1354 C CD . ARG A 1 173 ? 14.775 -111.832 -60.019 1.00 52.87 ? 173 ARG A CD 1 ATOM 1355 N NE . ARG A 1 173 ? 13.505 -111.570 -60.690 0.00 75.91 ? 173 ARG A NE 1 ATOM 1356 C CZ . ARG A 1 173 ? 13.390 -110.924 -61.846 1.00 116.06 ? 173 ARG A CZ 1 ATOM 1357 N NH1 . ARG A 1 173 ? 14.472 -110.472 -62.465 1.00 116.23 ? 173 ARG A NH1 1 ATOM 1358 N NH2 . ARG A 1 173 ? 12.194 -110.730 -62.384 1.00 115.84 ? 173 ARG A NH2 1 ATOM 1359 N N . GLY A 1 174 ? 16.498 -109.527 -55.269 1.00 52.92 ? 174 GLY A N 1 ATOM 1360 C CA . GLY A 1 174 ? 17.490 -108.781 -54.514 1.00 53.48 ? 174 GLY A CA 1 ATOM 1361 C C . GLY A 1 174 ? 17.705 -109.302 -53.105 1.00 53.85 ? 174 GLY A C 1 ATOM 1362 O O . GLY A 1 174 ? 18.835 -109.333 -52.613 1.00 54.04 ? 174 GLY A O 1 ATOM 1363 N N . LEU A 1 175 ? 16.617 -109.708 -52.456 1.00 54.04 ? 175 LEU A N 1 ATOM 1364 C CA . LEU A 1 175 ? 16.678 -110.232 -51.095 1.00 54.09 ? 175 LEU A CA 1 ATOM 1365 C C . LEU A 1 175 ? 17.256 -111.638 -51.073 1.00 54.32 ? 175 LEU A C 1 ATOM 1366 O O . LEU A 1 175 ? 18.034 -111.983 -50.184 1.00 54.27 ? 175 LEU A O 1 ATOM 1367 C CB . LEU A 1 175 ? 15.289 -110.244 -50.454 1.00 53.88 ? 175 LEU A CB 1 ATOM 1368 C CG . LEU A 1 175 ? 14.577 -108.922 -50.205 1.00 53.11 ? 175 LEU A CG 1 ATOM 1369 C CD1 . LEU A 1 175 ? 13.138 -109.214 -49.912 1.00 52.44 ? 175 LEU A CD1 1 ATOM 1370 C CD2 . LEU A 1 175 ? 15.205 -108.150 -49.062 1.00 52.80 ? 175 LEU A CD2 1 ATOM 1371 N N . LEU A 1 176 ? 16.875 -112.442 -52.057 1.00 54.66 ? 176 LEU A N 1 ATOM 1372 C CA . LEU A 1 176 ? 17.311 -113.824 -52.107 1.00 55.28 ? 176 LEU A CA 1 ATOM 1373 C C . LEU A 1 176 ? 18.826 -113.941 -52.169 1.00 55.71 ? 176 LEU A C 1 ATOM 1374 O O . LEU A 1 176 ? 19.391 -114.894 -51.627 1.00 55.85 ? 176 LEU A O 1 ATOM 1375 C CB . LEU A 1 176 ? 16.652 -114.554 -53.268 1.00 55.28 ? 176 LEU A CB 1 ATOM 1376 C CG . LEU A 1 176 ? 15.168 -114.846 -53.035 1.00 55.76 ? 176 LEU A CG 1 ATOM 1377 C CD1 . LEU A 1 176 ? 14.411 -114.899 -54.347 1.00 56.79 ? 176 LEU A CD1 1 ATOM 1378 C CD2 . LEU A 1 176 ? 14.967 -116.138 -52.247 1.00 56.51 ? 176 LEU A CD2 1 ATOM 1379 N N . GLU A 1 177 ? 19.472 -112.968 -52.815 1.00 56.16 ? 177 GLU A N 1 ATOM 1380 C CA . GLU A 1 177 ? 20.931 -112.884 -52.845 1.00 56.65 ? 177 GLU A CA 1 ATOM 1381 C C . GLU A 1 177 ? 21.444 -112.353 -51.521 1.00 56.64 ? 177 GLU A C 1 ATOM 1382 O O . GLU A 1 177 ? 22.266 -112.993 -50.866 1.00 56.83 ? 177 GLU A O 1 ATOM 1383 C CB . GLU A 1 177 ? 21.419 -111.975 -53.973 1.00 56.80 ? 177 GLU A CB 1 ATOM 1384 C CG . GLU A 1 177 ? 21.504 -112.628 -55.351 1.00 58.29 ? 177 GLU A CG 1 ATOM 1385 C CD . GLU A 1 177 ? 21.915 -111.629 -56.436 1.00 59.90 ? 177 GLU A CD 1 ATOM 1386 O OE1 . GLU A 1 177 ? 21.099 -111.359 -57.352 1.00 59.86 ? 177 GLU A OE1 1 ATOM 1387 O OE2 . GLU A 1 177 ? 23.049 -111.100 -56.360 1.00 60.10 ? 177 GLU A OE2 1 ATOM 1388 N N . ALA A 1 178 ? 20.940 -111.188 -51.129 1.00 56.74 ? 178 ALA A N 1 ATOM 1389 C CA . ALA A 1 178 ? 21.415 -110.492 -49.937 1.00 56.89 ? 178 ALA A CA 1 ATOM 1390 C C . ALA A 1 178 ? 21.236 -111.296 -48.654 1.00 57.11 ? 178 ALA A C 1 ATOM 1391 O O . ALA A 1 178 ? 21.979 -111.110 -47.696 1.00 57.17 ? 178 ALA A O 1 ATOM 1392 C CB . ALA A 1 178 ? 20.741 -109.142 -49.813 1.00 56.89 ? 178 ALA A CB 1 ATOM 1393 N N . GLY A 1 179 ? 20.260 -112.196 -48.644 1.00 57.34 ? 179 GLY A N 1 ATOM 1394 C CA . GLY A 1 179 ? 19.998 -113.011 -47.474 1.00 57.74 ? 179 GLY A CA 1 ATOM 1395 C C . GLY A 1 179 ? 20.308 -114.486 -47.639 1.00 58.25 ? 179 GLY A C 1 ATOM 1396 O O . GLY A 1 179 ? 20.066 -115.267 -46.717 1.00 58.50 ? 179 GLY A O 1 ATOM 1397 N N . LYS A 1 180 ? 20.847 -114.878 -48.796 1.00 58.50 ? 180 LYS A N 1 ATOM 1398 C CA . LYS A 1 180 ? 21.110 -116.297 -49.103 1.00 58.72 ? 180 LYS A CA 1 ATOM 1399 C C . LYS A 1 180 ? 21.588 -117.095 -47.880 1.00 58.76 ? 180 LYS A C 1 ATOM 1400 O O . LYS A 1 180 ? 20.999 -118.131 -47.548 1.00 58.87 ? 180 LYS A O 1 ATOM 1401 C CB . LYS A 1 180 ? 22.098 -116.431 -50.273 1.00 58.83 ? 180 LYS A CB 1 ATOM 1402 C CG . LYS A 1 180 ? 22.310 -117.859 -50.803 1.00 59.32 ? 180 LYS A CG 1 ATOM 1403 C CD . LYS A 1 180 ? 23.094 -117.858 -52.131 1.00 60.24 ? 180 LYS A CD 1 ATOM 1404 C CE . LYS A 1 180 ? 23.952 -119.112 -52.303 1.00 60.45 ? 180 LYS A CE 1 ATOM 1405 N NZ . LYS A 1 180 ? 23.148 -120.375 -52.357 1.00 60.19 ? 180 LYS A NZ 1 ATOM 1406 N N . SER A 1 181 ? 22.631 -116.592 -47.211 1.00 58.63 ? 181 SER A N 1 ATOM 1407 C CA . SER A 1 181 ? 23.200 -117.227 -46.015 1.00 58.32 ? 181 SER A CA 1 ATOM 1408 C C . SER A 1 181 ? 22.144 -117.439 -44.925 1.00 58.03 ? 181 SER A C 1 ATOM 1409 O O . SER A 1 181 ? 21.840 -118.579 -44.568 1.00 58.07 ? 181 SER A O 1 ATOM 1410 C CB . SER A 1 181 ? 24.373 -116.406 -45.475 1.00 58.28 ? 181 SER A CB 1 ATOM 1411 O OG . SER A 1 181 ? 23.940 -115.109 -45.112 1.00 58.49 ? 181 SER A OG 1 ATOM 1412 N N . ASP A 1 182 ? 21.580 -116.345 -44.419 1.00 57.65 ? 182 ASP A N 1 ATOM 1413 C CA . ASP A 1 182 ? 20.499 -116.401 -43.428 1.00 57.35 ? 182 ASP A CA 1 ATOM 1414 C C . ASP A 1 182 ? 19.358 -117.323 -43.854 1.00 57.06 ? 182 ASP A C 1 ATOM 1415 O O . ASP A 1 182 ? 18.801 -118.043 -43.031 1.00 56.96 ? 182 ASP A O 1 ATOM 1416 C CB . ASP A 1 182 ? 19.937 -114.997 -43.151 1.00 57.45 ? 182 ASP A CB 1 ATOM 1417 C CG . ASP A 1 182 ? 20.557 -114.333 -41.928 1.00 57.46 ? 182 ASP A CG 1 ATOM 1418 O OD1 . ASP A 1 182 ? 21.436 -114.937 -41.277 1.00 57.98 ? 182 ASP A OD1 1 ATOM 1419 O OD2 . ASP A 1 182 ? 20.149 -113.195 -41.613 1.00 57.05 ? 182 ASP A OD2 1 ATOM 1420 N N . LEU A 1 183 ? 19.022 -117.300 -45.141 1.00 56.80 ? 183 LEU A N 1 ATOM 1421 C CA . LEU A 1 183 ? 17.885 -118.053 -45.664 1.00 56.61 ? 183 LEU A CA 1 ATOM 1422 C C . LEU A 1 183 ? 18.055 -119.569 -45.599 1.00 56.48 ? 183 LEU A C 1 ATOM 1423 O O . LEU A 1 183 ? 17.102 -120.288 -45.270 1.00 56.65 ? 183 LEU A O 1 ATOM 1424 C CB . LEU A 1 183 ? 17.597 -117.655 -47.112 1.00 56.67 ? 183 LEU A CB 1 ATOM 1425 C CG . LEU A 1 183 ? 16.810 -116.386 -47.441 1.00 56.66 ? 183 LEU A CG 1 ATOM 1426 C CD1 . LEU A 1 183 ? 16.795 -116.192 -48.949 1.00 56.34 ? 183 LEU A CD1 1 ATOM 1427 C CD2 . LEU A 1 183 ? 15.392 -116.447 -46.892 1.00 56.78 ? 183 LEU A CD2 1 ATOM 1428 N N . GLU A 1 184 ? 19.257 -120.048 -45.928 1.00 56.03 ? 184 GLU A N 1 ATOM 1429 C CA . GLU A 1 184 ? 19.505 -121.488 -46.090 1.00 55.50 ? 184 GLU A CA 1 ATOM 1430 C C . GLU A 1 184 ? 20.055 -122.124 -44.826 1.00 54.64 ? 184 GLU A C 1 ATOM 1431 O O . GLU A 1 184 ? 20.495 -123.274 -44.851 1.00 54.42 ? 184 GLU A O 1 ATOM 1432 C CB . GLU A 1 184 ? 20.468 -121.746 -47.258 1.00 55.81 ? 184 GLU A CB 1 ATOM 1433 C CG . GLU A 1 184 ? 19.871 -121.515 -48.646 1.00 56.75 ? 184 GLU A CG 1 ATOM 1434 C CD . GLU A 1 184 ? 20.932 -121.275 -49.712 1.00 57.74 ? 184 GLU A CD 1 ATOM 1435 O OE1 . GLU A 1 184 ? 22.034 -120.787 -49.365 1.00 57.69 ? 184 GLU A OE1 1 ATOM 1436 O OE2 . GLU A 1 184 ? 20.657 -121.568 -50.898 1.00 58.07 ? 184 GLU A OE2 1 ATOM 1437 N N . LYS A 1 185 ? 20.013 -121.374 -43.728 1.00 53.76 ? 185 LYS A N 1 ATOM 1438 C CA . LYS A 1 185 ? 20.643 -121.796 -42.480 1.00 53.03 ? 185 LYS A CA 1 ATOM 1439 C C . LYS A 1 185 ? 20.024 -123.051 -41.894 1.00 52.32 ? 185 LYS A C 1 ATOM 1440 O O . LYS A 1 185 ? 18.835 -123.304 -42.050 1.00 52.25 ? 185 LYS A O 1 ATOM 1441 C CB . LYS A 1 185 ? 20.670 -120.662 -41.437 1.00 53.18 ? 185 LYS A CB 1 ATOM 1442 C CG . LYS A 1 185 ? 19.335 -120.319 -40.760 1.00 53.34 ? 185 LYS A CG 1 ATOM 1443 C CD . LYS A 1 185 ? 19.539 -119.311 -39.615 1.00 53.56 ? 185 LYS A CD 1 ATOM 1444 C CE . LYS A 1 185 ? 18.233 -118.648 -39.163 1.00 53.37 ? 185 LYS A CE 1 ATOM 1445 N NZ . LYS A 1 185 ? 17.281 -119.592 -38.512 1.00 52.81 ? 185 LYS A NZ 1 ATOM 1446 N N . GLN A 1 186 ? 20.865 -123.839 -41.239 1.00 51.57 ? 186 GLN A N 1 ATOM 1447 C CA . GLN A 1 186 ? 20.437 -125.042 -40.564 1.00 50.83 ? 186 GLN A CA 1 ATOM 1448 C C . GLN A 1 186 ? 20.611 -124.820 -39.079 1.00 50.28 ? 186 GLN A C 1 ATOM 1449 O O . GLN A 1 186 ? 21.699 -124.484 -38.628 1.00 50.31 ? 186 GLN A O 1 ATOM 1450 C CB . GLN A 1 186 ? 21.278 -126.235 -41.016 1.00 50.96 ? 186 GLN A CB 1 ATOM 1451 C CG . GLN A 1 186 ? 21.115 -126.613 -42.480 1.00 51.40 ? 186 GLN A CG 1 ATOM 1452 C CD . GLN A 1 186 ? 19.663 -126.858 -42.875 1.00 52.48 ? 186 GLN A CD 1 ATOM 1453 O OE1 . GLN A 1 186 ? 19.148 -126.240 -43.812 1.00 52.98 ? 186 GLN A OE1 1 ATOM 1454 N NE2 . GLN A 1 186 ? 18.995 -127.755 -42.158 1.00 52.63 ? 186 GLN A NE2 1 ATOM 1455 N N . GLU A 1 187 ? 19.528 -124.965 -38.328 1.00 49.63 ? 187 GLU A N 1 ATOM 1456 C CA . GLU A 1 187 ? 19.608 -125.003 -36.880 1.00 49.11 ? 187 GLU A CA 1 ATOM 1457 C C . GLU A 1 187 ? 19.131 -126.381 -36.464 1.00 48.75 ? 187 GLU A C 1 ATOM 1458 O O . GLU A 1 187 ? 18.083 -126.829 -36.933 1.00 48.71 ? 187 GLU A O 1 ATOM 1459 C CB . GLU A 1 187 ? 18.757 -123.908 -36.243 1.00 49.12 ? 187 GLU A CB 1 ATOM 1460 C CG . GLU A 1 187 ? 19.100 -122.487 -36.686 1.00 50.03 ? 187 GLU A CG 1 ATOM 1461 C CD . GLU A 1 187 ? 20.538 -122.080 -36.392 1.00 51.66 ? 187 GLU A CD 1 ATOM 1462 O OE1 . GLU A 1 187 ? 20.994 -121.047 -36.926 1.00 53.08 ? 187 GLU A OE1 1 ATOM 1463 O OE2 . GLU A 1 187 ? 21.224 -122.780 -35.628 1.00 52.70 ? 187 GLU A OE2 1 ATOM 1464 N N . LYS A 1 188 ? 19.915 -127.064 -35.625 1.00 48.16 ? 188 LYS A N 1 ATOM 1465 C CA . LYS A 1 188 ? 19.625 -128.452 -35.253 1.00 47.55 ? 188 LYS A CA 1 ATOM 1466 C C . LYS A 1 188 ? 18.538 -128.517 -34.183 1.00 47.10 ? 188 LYS A C 1 ATOM 1467 O O . LYS A 1 188 ? 18.570 -127.740 -33.221 1.00 47.25 ? 188 LYS A O 1 ATOM 1468 C CB . LYS A 1 188 ? 20.891 -129.179 -34.785 1.00 47.56 ? 188 LYS A CB 1 ATOM 1469 C CG . LYS A 1 188 ? 21.803 -129.632 -35.917 1.00 48.15 ? 188 LYS A CG 1 ATOM 1470 C CD . LYS A 1 188 ? 23.105 -130.298 -35.418 1.00 48.76 ? 188 LYS A CD 1 ATOM 1471 C CE . LYS A 1 188 ? 24.305 -129.949 -36.330 1.00 48.18 ? 188 LYS A CE 1 ATOM 1472 N NZ . LYS A 1 188 ? 25.493 -130.824 -36.146 1.00 47.18 ? 188 LYS A NZ 1 ATOM 1473 N N . PRO A 1 189 ? 17.564 -129.434 -34.348 1.00 46.46 ? 189 PRO A N 1 ATOM 1474 C CA . PRO A 1 189 ? 16.526 -129.582 -33.335 1.00 46.08 ? 189 PRO A CA 1 ATOM 1475 C C . PRO A 1 189 ? 17.086 -130.189 -32.056 1.00 46.05 ? 189 PRO A C 1 ATOM 1476 O O . PRO A 1 189 ? 18.124 -130.847 -32.081 1.00 46.15 ? 189 PRO A O 1 ATOM 1477 C CB . PRO A 1 189 ? 15.531 -130.541 -33.985 1.00 45.83 ? 189 PRO A CB 1 ATOM 1478 C CG . PRO A 1 189 ? 16.292 -131.266 -35.009 1.00 45.89 ? 189 PRO A CG 1 ATOM 1479 C CD . PRO A 1 189 ? 17.361 -130.346 -35.488 1.00 46.33 ? 189 PRO A CD 1 ATOM 1480 N N . VAL A 1 190 ? 16.400 -129.950 -30.947 1.00 46.08 ? 190 VAL A N 1 ATOM 1481 C CA . VAL A 1 190 ? 16.794 -130.483 -29.646 1.00 46.09 ? 190 VAL A CA 1 ATOM 1482 C C . VAL A 1 190 ? 15.555 -131.131 -29.011 1.00 46.12 ? 190 VAL A C 1 ATOM 1483 O O . VAL A 1 190 ? 14.574 -130.452 -28.699 1.00 46.26 ? 190 VAL A O 1 ATOM 1484 C CB . VAL A 1 190 ? 17.431 -129.362 -28.770 1.00 46.08 ? 190 VAL A CB 1 ATOM 1485 C CG1 . VAL A 1 190 ? 17.408 -129.701 -27.293 1.00 46.22 ? 190 VAL A CG1 1 ATOM 1486 C CG2 . VAL A 1 190 ? 18.853 -129.088 -29.229 1.00 46.22 ? 190 VAL A CG2 1 ATOM 1487 N N . ALA A 1 191 ? 15.591 -132.449 -28.848 1.00 46.15 ? 191 ALA A N 1 ATOM 1488 C CA . ALA A 1 191 ? 14.397 -133.205 -28.460 1.00 46.26 ? 191 ALA A CA 1 ATOM 1489 C C . ALA A 1 191 ? 14.429 -133.757 -27.034 1.00 46.42 ? 191 ALA A C 1 ATOM 1490 O O . ALA A 1 191 ? 15.464 -134.248 -26.569 1.00 46.51 ? 191 ALA A O 1 ATOM 1491 C CB . ALA A 1 191 ? 14.147 -134.328 -29.450 1.00 46.13 ? 191 ALA A CB 1 ATOM 1492 N N . TRP A 1 192 ? 13.284 -133.684 -26.356 1.00 46.53 ? 192 TRP A N 1 ATOM 1493 C CA . TRP A 1 192 ? 13.136 -134.250 -25.010 1.00 46.74 ? 192 TRP A CA 1 ATOM 1494 C C . TRP A 1 192 ? 11.747 -134.845 -24.731 1.00 47.32 ? 192 TRP A C 1 ATOM 1495 O O . TRP A 1 192 ? 10.720 -134.252 -25.081 1.00 47.42 ? 192 TRP A O 1 ATOM 1496 C CB . TRP A 1 192 ? 13.499 -133.213 -23.948 1.00 46.56 ? 192 TRP A CB 1 ATOM 1497 C CG . TRP A 1 192 ? 12.512 -132.094 -23.782 1.00 45.53 ? 192 TRP A CG 1 ATOM 1498 C CD1 . TRP A 1 192 ? 11.515 -132.018 -22.861 1.00 44.86 ? 192 TRP A CD1 1 ATOM 1499 C CD2 . TRP A 1 192 ? 12.446 -130.884 -24.544 1.00 45.12 ? 192 TRP A CD2 1 ATOM 1500 N NE1 . TRP A 1 192 ? 10.823 -130.842 -23.003 1.00 44.75 ? 192 TRP A NE1 1 ATOM 1501 C CE2 . TRP A 1 192 ? 11.377 -130.125 -24.028 1.00 44.74 ? 192 TRP A CE2 1 ATOM 1502 C CE3 . TRP A 1 192 ? 13.179 -130.374 -25.624 1.00 45.35 ? 192 TRP A CE3 1 ATOM 1503 C CZ2 . TRP A 1 192 ? 11.024 -128.883 -24.548 1.00 44.51 ? 192 TRP A CZ2 1 ATOM 1504 C CZ3 . TRP A 1 192 ? 12.834 -129.138 -26.133 1.00 44.84 ? 192 TRP A CZ3 1 ATOM 1505 C CH2 . TRP A 1 192 ? 11.761 -128.408 -25.597 1.00 44.79 ? 192 TRP A CH2 1 ATOM 1506 N N . LEU A 1 193 ? 11.726 -136.012 -24.091 1.00 47.86 ? 193 LEU A N 1 ATOM 1507 C CA . LEU A 1 193 ? 10.479 -136.733 -23.838 1.00 48.57 ? 193 LEU A CA 1 ATOM 1508 C C . LEU A 1 193 ? 9.824 -136.299 -22.531 1.00 49.33 ? 193 LEU A C 1 ATOM 1509 O O . LEU A 1 193 ? 10.510 -135.838 -21.627 1.00 49.53 ? 193 LEU A O 1 ATOM 1510 C CB . LEU A 1 193 ? 10.740 -138.238 -23.810 1.00 48.17 ? 193 LEU A CB 1 ATOM 1511 C CG . LEU A 1 193 ? 11.587 -138.812 -24.942 1.00 48.02 ? 193 LEU A CG 1 ATOM 1512 C CD1 . LEU A 1 193 ? 11.786 -140.296 -24.760 1.00 49.17 ? 193 LEU A CD1 1 ATOM 1513 C CD2 . LEU A 1 193 ? 10.961 -138.548 -26.279 1.00 47.98 ? 193 LEU A CD2 1 ATOM 1514 N N . SER A 1 194 ? 8.500 -136.434 -22.447 1.00 50.42 ? 194 SER A N 1 ATOM 1515 C CA . SER A 1 194 ? 7.750 -136.279 -21.187 1.00 51.69 ? 194 SER A CA 1 ATOM 1516 C C . SER A 1 194 ? 6.446 -137.060 -21.289 1.00 52.59 ? 194 SER A C 1 ATOM 1517 O O . SER A 1 194 ? 6.205 -137.713 -22.298 1.00 52.78 ? 194 SER A O 1 ATOM 1518 C CB . SER A 1 194 ? 7.434 -134.815 -20.903 1.00 51.62 ? 194 SER A CB 1 ATOM 1519 O OG . SER A 1 194 ? 6.272 -134.417 -21.608 1.00 51.73 ? 194 SER A OG 1 ATOM 1520 N N . SER A 1 195 ? 5.603 -136.993 -20.260 1.00 53.85 ? 195 SER A N 1 ATOM 1521 C CA . SER A 1 195 ? 4.262 -137.590 -20.349 1.00 55.16 ? 195 SER A CA 1 ATOM 1522 C C . SER A 1 195 ? 3.251 -137.071 -19.327 1.00 56.12 ? 195 SER A C 1 ATOM 1523 O O . SER A 1 195 ? 3.613 -136.607 -18.241 1.00 56.22 ? 195 SER A O 1 ATOM 1524 C CB . SER A 1 195 ? 4.316 -139.124 -20.304 1.00 54.99 ? 195 SER A CB 1 ATOM 1525 O OG . SER A 1 195 ? 4.765 -139.586 -19.050 1.00 55.18 ? 195 SER A OG 1 ATOM 1526 N N . VAL A 1 196 ? 1.979 -137.148 -19.708 1.00 57.34 ? 196 VAL A N 1 ATOM 1527 C CA . VAL A 1 196 ? 0.864 -136.877 -18.808 1.00 58.66 ? 196 VAL A CA 1 ATOM 1528 C C . VAL A 1 196 ? -0.079 -138.074 -18.780 1.00 59.74 ? 196 VAL A C 1 ATOM 1529 O O . VAL A 1 196 ? -0.032 -138.923 -19.681 1.00 59.79 ? 196 VAL A O 1 ATOM 1530 C CB . VAL A 1 196 ? 0.060 -135.616 -19.212 1.00 58.54 ? 196 VAL A CB 1 ATOM 1531 C CG1 . VAL A 1 196 ? 0.919 -134.379 -19.091 1.00 58.66 ? 196 VAL A CG1 1 ATOM 1532 C CG2 . VAL A 1 196 ? -0.544 -135.760 -20.615 1.00 58.38 ? 196 VAL A CG2 1 ATOM 1533 N N . PRO A 1 197 ? -0.941 -138.146 -17.751 1.00 60.82 ? 197 PRO A N 1 ATOM 1534 C CA . PRO A 1 197 ? -1.950 -139.190 -17.738 1.00 62.00 ? 197 PRO A CA 1 ATOM 1535 C C . PRO A 1 197 ? -3.001 -138.906 -18.804 1.00 63.22 ? 197 PRO A C 1 ATOM 1536 O O . PRO A 1 197 ? -3.425 -137.758 -18.959 1.00 63.23 ? 197 PRO A O 1 ATOM 1537 C CB . PRO A 1 197 ? -2.558 -139.064 -16.343 1.00 61.95 ? 197 PRO A CB 1 ATOM 1538 C CG . PRO A 1 197 ? -2.363 -137.638 -15.984 1.00 61.39 ? 197 PRO A CG 1 ATOM 1539 C CD . PRO A 1 197 ? -1.052 -137.257 -16.582 1.00 60.80 ? 197 PRO A CD 1 ATOM 1540 N N . SER A 1 198 ? -3.396 -139.939 -19.543 1.00 64.69 ? 198 SER A N 1 ATOM 1541 C CA . SER A 1 198 ? -4.455 -139.796 -20.541 1.00 66.19 ? 198 SER A CA 1 ATOM 1542 C C . SER A 1 198 ? -5.830 -139.677 -19.868 1.00 67.07 ? 198 SER A C 1 ATOM 1543 O O . SER A 1 198 ? -5.976 -139.950 -18.665 1.00 67.27 ? 198 SER A O 1 ATOM 1544 C CB . SER A 1 198 ? -4.431 -140.967 -21.534 1.00 66.19 ? 198 SER A CB 1 ATOM 1545 O OG . SER A 1 198 ? -5.403 -140.805 -22.558 1.00 66.65 ? 198 SER A OG 1 ATOM 1546 N N . SER A 1 199 ? -6.824 -139.248 -20.647 1.00 68.06 ? 199 SER A N 1 ATOM 1547 C CA . SER A 1 199 ? -8.218 -139.214 -20.206 1.00 68.99 ? 199 SER A CA 1 ATOM 1548 C C . SER A 1 199 ? -8.677 -140.608 -19.743 1.00 69.64 ? 199 SER A C 1 ATOM 1549 O O . SER A 1 199 ? -9.077 -140.796 -18.579 1.00 69.79 ? 199 SER A O 1 ATOM 1550 C CB . SER A 1 199 ? -9.111 -138.695 -21.339 1.00 68.98 ? 199 SER A CB 1 ATOM 1551 O OG . SER A 1 199 ? -8.832 -139.374 -22.556 1.00 68.81 ? 199 SER A OG 1 ATOM 1552 N N . ALA A 1 200 ? -8.589 -141.578 -20.655 1.00 70.27 ? 200 ALA A N 1 ATOM 1553 C CA . ALA A 1 200 ? -8.926 -142.974 -20.368 1.00 70.74 ? 200 ALA A CA 1 ATOM 1554 C C . ALA A 1 200 ? -8.116 -143.507 -19.192 1.00 70.95 ? 200 ALA A C 1 ATOM 1555 O O . ALA A 1 200 ? -6.916 -143.234 -19.078 1.00 71.01 ? 200 ALA A O 1 ATOM 1556 C CB . ALA A 1 200 ? -8.707 -143.848 -21.612 1.00 70.79 ? 200 ALA A CB 1 ATOM 1557 N N . HIS A 1 201 ? -8.793 -144.253 -18.321 1.00 71.18 ? 201 HIS A N 1 ATOM 1558 C CA . HIS A 1 201 ? -8.167 -144.894 -17.165 1.00 71.48 ? 201 HIS A CA 1 ATOM 1559 C C . HIS A 1 201 ? -7.094 -145.912 -17.593 1.00 71.01 ? 201 HIS A C 1 ATOM 1560 O O . HIS A 1 201 ? -7.324 -146.720 -18.510 1.00 71.05 ? 201 HIS A O 1 ATOM 1561 C CB . HIS A 1 201 ? -9.244 -145.569 -16.298 1.00 71.94 ? 201 HIS A CB 1 ATOM 1562 C CG . HIS A 1 201 ? -8.702 -146.293 -15.099 1.00 73.91 ? 201 HIS A CG 1 ATOM 1563 N ND1 . HIS A 1 201 ? -8.667 -145.730 -13.838 1.00 75.31 ? 201 HIS A ND1 1 ATOM 1564 C CD2 . HIS A 1 201 ? -8.178 -147.538 -14.970 1.00 75.05 ? 201 HIS A CD2 1 ATOM 1565 C CE1 . HIS A 1 201 ? -8.143 -146.595 -12.986 1.00 75.83 ? 201 HIS A CE1 1 ATOM 1566 N NE2 . HIS A 1 201 ? -7.835 -147.698 -13.648 1.00 76.04 ? 201 HIS A NE2 1 ATOM 1567 N N . GLY A 1 202 ? -5.933 -145.854 -16.925 1.00 70.31 ? 202 GLY A N 1 ATOM 1568 C CA . GLY A 1 202 ? -4.811 -146.777 -17.170 1.00 69.12 ? 202 GLY A CA 1 ATOM 1569 C C . GLY A 1 202 ? -4.122 -146.558 -18.506 1.00 68.23 ? 202 GLY A C 1 ATOM 1570 O O . GLY A 1 202 ? -3.470 -147.461 -19.045 1.00 68.29 ? 202 GLY A O 1 ATOM 1571 N N . HIS A 1 203 ? -4.287 -145.351 -19.039 1.00 67.21 ? 203 HIS A N 1 ATOM 1572 C CA . HIS A 1 203 ? -3.712 -144.961 -20.317 1.00 66.21 ? 203 HIS A CA 1 ATOM 1573 C C . HIS A 1 203 ? -2.829 -143.743 -20.106 1.00 65.07 ? 203 HIS A C 1 ATOM 1574 O O . HIS A 1 203 ? -3.130 -142.892 -19.258 1.00 65.10 ? 203 HIS A O 1 ATOM 1575 C CB . HIS A 1 203 ? -4.818 -144.675 -21.346 1.00 66.44 ? 203 HIS A CB 1 ATOM 1576 C CG . HIS A 1 203 ? -5.213 -145.875 -22.154 1.00 67.43 ? 203 HIS A CG 1 ATOM 1577 N ND1 . HIS A 1 203 ? -4.876 -146.023 -23.485 1.00 68.09 ? 203 HIS A ND1 1 ATOM 1578 C CD2 . HIS A 1 203 ? -5.892 -146.997 -21.812 1.00 68.04 ? 203 HIS A CD2 1 ATOM 1579 C CE1 . HIS A 1 203 ? -5.337 -147.179 -23.930 1.00 68.12 ? 203 HIS A CE1 1 ATOM 1580 N NE2 . HIS A 1 203 ? -5.955 -147.790 -22.934 1.00 68.59 ? 203 HIS A NE2 1 ATOM 1581 N N . ARG A 1 204 ? -1.730 -143.673 -20.851 1.00 63.44 ? 204 ARG A N 1 ATOM 1582 C CA . ARG A 1 204 ? -0.842 -142.521 -20.767 1.00 61.84 ? 204 ARG A CA 1 ATOM 1583 C C . ARG A 1 204 ? -0.623 -141.875 -22.116 1.00 60.64 ? 204 ARG A C 1 ATOM 1584 O O . ARG A 1 204 ? -0.753 -142.517 -23.160 1.00 60.44 ? 204 ARG A O 1 ATOM 1585 C CB . ARG A 1 204 ? 0.508 -142.884 -20.150 1.00 61.94 ? 204 ARG A CB 1 ATOM 1586 C CG . ARG A 1 204 ? 0.484 -143.104 -18.655 1.00 62.11 ? 204 ARG A CG 1 ATOM 1587 C CD . ARG A 1 204 ? 1.558 -142.283 -17.955 1.00 62.56 ? 204 ARG A CD 1 ATOM 1588 N NE . ARG A 1 204 ? 0.959 -141.347 -16.999 1.00 63.45 ? 204 ARG A NE 1 ATOM 1589 C CZ . ARG A 1 204 ? 1.605 -140.362 -16.372 1.00 63.19 ? 204 ARG A CZ 1 ATOM 1590 N NH1 . ARG A 1 204 ? 2.893 -140.143 -16.593 1.00 63.47 ? 204 ARG A NH1 1 ATOM 1591 N NH2 . ARG A 1 204 ? 0.954 -139.582 -15.521 1.00 62.94 ? 204 ARG A NH2 1 ATOM 1592 N N . GLN A 1 205 ? -0.286 -140.590 -22.067 1.00 59.10 ? 205 GLN A N 1 ATOM 1593 C CA . GLN A 1 205 ? 0.041 -139.807 -23.244 1.00 57.55 ? 205 GLN A CA 1 ATOM 1594 C C . GLN A 1 205 ? 1.511 -139.404 -23.175 1.00 56.12 ? 205 GLN A C 1 ATOM 1595 O O . GLN A 1 205 ? 1.943 -138.769 -22.215 1.00 55.93 ? 205 GLN A O 1 ATOM 1596 C CB . GLN A 1 205 ? -0.867 -138.580 -23.312 1.00 57.78 ? 205 GLN A CB 1 ATOM 1597 C CG . GLN A 1 205 ? -0.633 -137.674 -24.502 1.00 58.83 ? 205 GLN A CG 1 ATOM 1598 C CD . GLN A 1 205 ? -1.887 -136.927 -24.918 1.00 60.38 ? 205 GLN A CD 1 ATOM 1599 O OE1 . GLN A 1 205 ? -2.700 -137.446 -25.682 1.00 61.20 ? 205 GLN A OE1 1 ATOM 1600 N NE2 . GLN A 1 205 ? -2.047 -135.701 -24.423 1.00 60.96 ? 205 GLN A NE2 1 ATOM 1601 N N . LEU A 1 206 ? 2.272 -139.796 -24.192 1.00 54.35 ? 206 LEU A N 1 ATOM 1602 C CA . LEU A 1 206 ? 3.703 -139.545 -24.236 1.00 52.71 ? 206 LEU A CA 1 ATOM 1603 C C . LEU A 1 206 ? 3.996 -138.415 -25.194 1.00 51.69 ? 206 LEU A C 1 ATOM 1604 O O . LEU A 1 206 ? 3.606 -138.468 -26.348 1.00 51.74 ? 206 LEU A O 1 ATOM 1605 C CB . LEU A 1 206 ? 4.451 -140.796 -24.698 1.00 52.71 ? 206 LEU A CB 1 ATOM 1606 C CG . LEU A 1 206 ? 4.166 -142.138 -24.026 1.00 52.33 ? 206 LEU A CG 1 ATOM 1607 C CD1 . LEU A 1 206 ? 4.942 -143.237 -24.717 1.00 52.40 ? 206 LEU A CD1 1 ATOM 1608 C CD2 . LEU A 1 206 ? 4.515 -142.101 -22.555 1.00 52.33 ? 206 LEU A CD2 1 ATOM 1609 N N . VAL A 1 207 ? 4.701 -137.401 -24.717 1.00 50.46 ? 207 VAL A N 1 ATOM 1610 C CA . VAL A 1 207 ? 4.966 -136.218 -25.514 1.00 49.23 ? 207 VAL A CA 1 ATOM 1611 C C . VAL A 1 207 ? 6.439 -136.103 -25.864 1.00 48.65 ? 207 VAL A C 1 ATOM 1612 O O . VAL A 1 207 ? 7.300 -136.086 -24.977 1.00 48.47 ? 207 VAL A O 1 ATOM 1613 C CB . VAL A 1 207 ? 4.541 -134.962 -24.772 1.00 49.18 ? 207 VAL A CB 1 ATOM 1614 C CG1 . VAL A 1 207 ? 4.635 -133.760 -25.685 1.00 49.33 ? 207 VAL A CG1 1 ATOM 1615 C CG2 . VAL A 1 207 ? 3.125 -135.121 -24.241 1.00 49.08 ? 207 VAL A CG2 1 ATOM 1616 N N . CYS A 1 208 ? 6.715 -136.011 -27.163 1.00 47.94 ? 208 CYS A N 1 ATOM 1617 C CA . CYS A 1 208 ? 8.082 -135.877 -27.674 1.00 47.10 ? 208 CYS A CA 1 ATOM 1618 C C . CYS A 1 208 ? 8.364 -134.457 -28.154 1.00 46.57 ? 208 CYS A C 1 ATOM 1619 O O . CYS A 1 208 ? 7.937 -134.078 -29.244 1.00 46.70 ? 208 CYS A O 1 ATOM 1620 C CB . CYS A 1 208 ? 8.326 -136.859 -28.824 1.00 47.00 ? 208 CYS A CB 1 ATOM 1621 S SG . CYS A 1 208 ? 9.892 -136.564 -29.626 1.00 46.44 ? 208 CYS A SG 1 ATOM 1622 N N . HIS A 1 209 ? 9.089 -133.679 -27.356 1.00 45.75 ? 209 HIS A N 1 ATOM 1623 C CA . HIS A 1 209 ? 9.323 -132.278 -27.699 1.00 45.10 ? 209 HIS A CA 1 ATOM 1624 C C . HIS A 1 209 ? 10.505 -132.086 -28.648 1.00 44.76 ? 209 HIS A C 1 ATOM 1625 O O . HIS A 1 209 ? 11.615 -132.554 -28.385 1.00 44.63 ? 209 HIS A O 1 ATOM 1626 C CB . HIS A 1 209 ? 9.555 -131.422 -26.456 1.00 45.10 ? 209 HIS A CB 1 ATOM 1627 C CG . HIS A 1 209 ? 8.530 -131.593 -25.383 1.00 44.79 ? 209 HIS A CG 1 ATOM 1628 N ND1 . HIS A 1 209 ? 8.399 -132.758 -24.661 1.00 45.21 ? 209 HIS A ND1 1 ATOM 1629 C CD2 . HIS A 1 209 ? 7.620 -130.731 -24.872 1.00 44.93 ? 209 HIS A CD2 1 ATOM 1630 C CE1 . HIS A 1 209 ? 7.433 -132.615 -23.769 1.00 45.27 ? 209 HIS A CE1 1 ATOM 1631 N NE2 . HIS A 1 209 ? 6.943 -131.394 -23.877 1.00 44.82 ? 209 HIS A NE2 1 ATOM 1632 N N . VAL A 1 210 ? 10.251 -131.370 -29.741 1.00 44.26 ? 210 VAL A N 1 ATOM 1633 C CA . VAL A 1 210 ? 11.287 -130.974 -30.689 1.00 43.75 ? 210 VAL A CA 1 ATOM 1634 C C . VAL A 1 210 ? 11.347 -129.447 -30.742 1.00 43.68 ? 210 VAL A C 1 ATOM 1635 O O . VAL A 1 210 ? 10.324 -128.789 -30.924 1.00 43.71 ? 210 VAL A O 1 ATOM 1636 C CB . VAL A 1 210 ? 10.982 -131.531 -32.075 1.00 43.53 ? 210 VAL A CB 1 ATOM 1637 C CG1 . VAL A 1 210 ? 12.159 -131.333 -32.988 1.00 43.49 ? 210 VAL A CG1 1 ATOM 1638 C CG2 . VAL A 1 210 ? 10.633 -133.001 -31.977 1.00 43.42 ? 210 VAL A CG2 1 ATOM 1639 N N . SER A 1 211 ? 12.534 -128.878 -30.566 1.00 43.56 ? 211 SER A N 1 ATOM 1640 C CA . SER A 1 211 ? 12.654 -127.422 -30.473 1.00 43.50 ? 211 SER A CA 1 ATOM 1641 C C . SER A 1 211 ? 13.959 -126.899 -31.058 1.00 43.70 ? 211 SER A C 1 ATOM 1642 O O . SER A 1 211 ? 14.992 -127.561 -30.974 1.00 43.72 ? 211 SER A O 1 ATOM 1643 C CB . SER A 1 211 ? 12.509 -126.966 -29.018 1.00 43.19 ? 211 SER A CB 1 ATOM 1644 O OG . SER A 1 211 ? 12.187 -125.593 -28.941 1.00 42.45 ? 211 SER A OG 1 ATOM 1645 N N . GLY A 1 212 ? 13.892 -125.714 -31.658 1.00 43.92 ? 212 GLY A N 1 ATOM 1646 C CA . GLY A 1 212 ? 15.076 -125.023 -32.162 1.00 44.56 ? 212 GLY A CA 1 ATOM 1647 C C . GLY A 1 212 ? 15.535 -125.342 -33.577 1.00 45.01 ? 212 GLY A C 1 ATOM 1648 O O . GLY A 1 212 ? 16.645 -124.968 -33.963 1.00 44.82 ? 212 GLY A O 1 ATOM 1649 N N . PHE A 1 213 ? 14.687 -126.011 -34.356 1.00 45.61 ? 213 PHE A N 1 ATOM 1650 C CA . PHE A 1 213 ? 15.045 -126.391 -35.721 1.00 46.29 ? 213 PHE A CA 1 ATOM 1651 C C . PHE A 1 213 ? 14.734 -125.343 -36.781 1.00 47.06 ? 213 PHE A C 1 ATOM 1652 O O . PHE A 1 213 ? 13.805 -124.552 -36.629 1.00 47.11 ? 213 PHE A O 1 ATOM 1653 C CB . PHE A 1 213 ? 14.430 -127.730 -36.109 1.00 46.07 ? 213 PHE A CB 1 ATOM 1654 C CG . PHE A 1 213 ? 12.948 -127.793 -35.965 1.00 45.88 ? 213 PHE A CG 1 ATOM 1655 C CD1 . PHE A 1 213 ? 12.365 -128.099 -34.740 1.00 46.25 ? 213 PHE A CD1 1 ATOM 1656 C CD2 . PHE A 1 213 ? 12.127 -127.600 -37.065 1.00 45.77 ? 213 PHE A CD2 1 ATOM 1657 C CE1 . PHE A 1 213 ? 10.972 -128.186 -34.612 1.00 46.45 ? 213 PHE A CE1 1 ATOM 1658 C CE2 . PHE A 1 213 ? 10.739 -127.685 -36.949 1.00 45.55 ? 213 PHE A CE2 1 ATOM 1659 C CZ . PHE A 1 213 ? 10.160 -127.977 -35.722 1.00 45.59 ? 213 PHE A CZ 1 ATOM 1660 N N . TYR A 1 214 ? 15.549 -125.352 -37.840 1.00 48.04 ? 214 TYR A N 1 ATOM 1661 C CA . TYR A 1 214 ? 15.382 -124.516 -39.026 1.00 48.91 ? 214 TYR A CA 1 ATOM 1662 C C . TYR A 1 214 ? 16.119 -125.160 -40.195 1.00 49.30 ? 214 TYR A C 1 ATOM 1663 O O . TYR A 1 214 ? 17.253 -125.604 -40.020 1.00 49.54 ? 214 TYR A O 1 ATOM 1664 C CB . TYR A 1 214 ? 15.937 -123.108 -38.795 1.00 49.14 ? 214 TYR A CB 1 ATOM 1665 C CG . TYR A 1 214 ? 15.394 -122.112 -39.795 1.00 50.59 ? 214 TYR A CG 1 ATOM 1666 C CD1 . TYR A 1 214 ? 14.192 -121.438 -39.554 1.00 51.16 ? 214 TYR A CD1 1 ATOM 1667 C CD2 . TYR A 1 214 ? 16.057 -121.870 -40.999 1.00 51.56 ? 214 TYR A CD2 1 ATOM 1668 C CE1 . TYR A 1 214 ? 13.676 -120.541 -40.478 1.00 51.47 ? 214 TYR A CE1 1 ATOM 1669 C CE2 . TYR A 1 214 ? 15.546 -120.976 -41.930 1.00 51.92 ? 214 TYR A CE2 1 ATOM 1670 C CZ . TYR A 1 214 ? 14.359 -120.313 -41.662 1.00 51.93 ? 214 TYR A CZ 1 ATOM 1671 O OH . TYR A 1 214 ? 13.854 -119.425 -42.584 1.00 52.35 ? 214 TYR A OH 1 ATOM 1672 N N . PRO A 1 215 ? 15.497 -125.210 -41.397 1.00 49.78 ? 215 PRO A N 1 ATOM 1673 C CA . PRO A 1 215 ? 14.196 -124.673 -41.797 1.00 50.06 ? 215 PRO A CA 1 ATOM 1674 C C . PRO A 1 215 ? 13.040 -125.580 -41.378 1.00 50.47 ? 215 PRO A C 1 ATOM 1675 O O . PRO A 1 215 ? 13.244 -126.530 -40.620 1.00 50.39 ? 215 PRO A O 1 ATOM 1676 C CB . PRO A 1 215 ? 14.310 -124.624 -43.318 1.00 50.06 ? 215 PRO A CB 1 ATOM 1677 C CG . PRO A 1 215 ? 15.148 -125.798 -43.650 1.00 49.83 ? 215 PRO A CG 1 ATOM 1678 C CD . PRO A 1 215 ? 16.137 -125.934 -42.514 1.00 49.69 ? 215 PRO A CD 1 ATOM 1679 N N . LYS A 1 216 ? 11.848 -125.301 -41.895 1.00 50.94 ? 216 LYS A N 1 ATOM 1680 C CA . LYS A 1 216 ? 10.628 -125.892 -41.355 1.00 51.65 ? 216 LYS A CA 1 ATOM 1681 C C . LYS A 1 216 ? 10.402 -127.400 -41.481 1.00 52.15 ? 216 LYS A C 1 ATOM 1682 O O . LYS A 1 216 ? 9.953 -128.013 -40.512 1.00 52.03 ? 216 LYS A O 1 ATOM 1683 C CB . LYS A 1 216 ? 9.393 -125.124 -41.814 1.00 51.70 ? 216 LYS A CB 1 ATOM 1684 C CG . LYS A 1 216 ? 8.706 -124.372 -40.683 1.00 52.25 ? 216 LYS A CG 1 ATOM 1685 C CD . LYS A 1 216 ? 7.348 -123.861 -41.120 1.00 53.29 ? 216 LYS A CD 1 ATOM 1686 C CE . LYS A 1 216 ? 6.442 -123.601 -39.940 1.00 53.46 ? 216 LYS A CE 1 ATOM 1687 N NZ . LYS A 1 216 ? 5.014 -123.490 -40.362 1.00 54.30 ? 216 LYS A NZ 1 ATOM 1688 N N . PRO A 1 217 ? 10.694 -128.011 -42.651 1.00 52.79 ? 217 PRO A N 1 ATOM 1689 C CA . PRO A 1 217 ? 10.335 -129.437 -42.758 1.00 53.24 ? 217 PRO A CA 1 ATOM 1690 C C . PRO A 1 217 ? 10.968 -130.289 -41.657 1.00 53.65 ? 217 PRO A C 1 ATOM 1691 O O . PRO A 1 217 ? 12.156 -130.143 -41.362 1.00 53.64 ? 217 PRO A O 1 ATOM 1692 C CB . PRO A 1 217 ? 10.866 -129.839 -44.139 1.00 53.17 ? 217 PRO A CB 1 ATOM 1693 C CG . PRO A 1 217 ? 10.911 -128.557 -44.901 1.00 53.12 ? 217 PRO A CG 1 ATOM 1694 C CD . PRO A 1 217 ? 11.326 -127.522 -43.890 1.00 52.87 ? 217 PRO A CD 1 ATOM 1695 N N . VAL A 1 218 ? 10.150 -131.140 -41.044 1.00 54.17 ? 218 VAL A N 1 ATOM 1696 C CA . VAL A 1 218 ? 10.562 -131.991 -39.932 1.00 54.75 ? 218 VAL A CA 1 ATOM 1697 C C . VAL A 1 218 ? 9.683 -133.237 -39.897 1.00 55.25 ? 218 VAL A C 1 ATOM 1698 O O . VAL A 1 218 ? 8.479 -133.169 -40.168 1.00 55.49 ? 218 VAL A O 1 ATOM 1699 C CB . VAL A 1 218 ? 10.529 -131.226 -38.563 1.00 54.71 ? 218 VAL A CB 1 ATOM 1700 C CG1 . VAL A 1 218 ? 9.108 -131.012 -38.065 1.00 54.63 ? 218 VAL A CG1 1 ATOM 1701 C CG2 . VAL A 1 218 ? 11.353 -131.944 -37.510 1.00 54.67 ? 218 VAL A CG2 1 ATOM 1702 N N . TRP A 1 219 ? 10.298 -134.371 -39.590 1.00 55.81 ? 219 TRP A N 1 ATOM 1703 C CA . TRP A 1 219 ? 9.599 -135.641 -39.478 1.00 56.50 ? 219 TRP A CA 1 ATOM 1704 C C . TRP A 1 219 ? 9.763 -136.069 -38.035 1.00 56.34 ? 219 TRP A C 1 ATOM 1705 O O . TRP A 1 219 ? 10.879 -136.119 -37.525 1.00 56.38 ? 219 TRP A O 1 ATOM 1706 C CB . TRP A 1 219 ? 10.245 -136.650 -40.428 1.00 57.08 ? 219 TRP A CB 1 ATOM 1707 C CG . TRP A 1 219 ? 9.553 -137.989 -40.614 1.00 59.06 ? 219 TRP A CG 1 ATOM 1708 C CD1 . TRP A 1 219 ? 8.586 -138.293 -41.533 1.00 60.52 ? 219 TRP A CD1 1 ATOM 1709 C CD2 . TRP A 1 219 ? 9.832 -139.210 -39.911 1.00 61.05 ? 219 TRP A CD2 1 ATOM 1710 N NE1 . TRP A 1 219 ? 8.226 -139.617 -41.428 1.00 61.47 ? 219 TRP A NE1 1 ATOM 1711 C CE2 . TRP A 1 219 ? 8.974 -140.205 -40.442 1.00 61.89 ? 219 TRP A CE2 1 ATOM 1712 C CE3 . TRP A 1 219 ? 10.709 -139.557 -38.873 1.00 61.87 ? 219 TRP A CE3 1 ATOM 1713 C CZ2 . TRP A 1 219 ? 8.972 -141.529 -39.973 1.00 62.80 ? 219 TRP A CZ2 1 ATOM 1714 C CZ3 . TRP A 1 219 ? 10.707 -140.875 -38.402 1.00 62.72 ? 219 TRP A CZ3 1 ATOM 1715 C CH2 . TRP A 1 219 ? 9.845 -141.844 -38.956 1.00 63.08 ? 219 TRP A CH2 1 ATOM 1716 N N . VAL A 1 220 ? 8.649 -136.329 -37.364 1.00 56.39 ? 220 VAL A N 1 ATOM 1717 C CA . VAL A 1 220 ? 8.667 -136.759 -35.967 1.00 56.49 ? 220 VAL A CA 1 ATOM 1718 C C . VAL A 1 220 ? 7.684 -137.912 -35.792 1.00 56.84 ? 220 VAL A C 1 ATOM 1719 O O . VAL A 1 220 ? 6.488 -137.767 -36.067 1.00 56.88 ? 220 VAL A O 1 ATOM 1720 C CB . VAL A 1 220 ? 8.299 -135.608 -34.997 1.00 56.31 ? 220 VAL A CB 1 ATOM 1721 C CG1 . VAL A 1 220 ? 8.478 -136.045 -33.563 1.00 55.96 ? 220 VAL A CG1 1 ATOM 1722 C CG2 . VAL A 1 220 ? 9.150 -134.387 -35.258 1.00 56.28 ? 220 VAL A CG2 1 ATOM 1723 N N . MET A 1 221 ? 8.193 -139.055 -35.341 1.00 57.16 ? 221 MET A N 1 ATOM 1724 C CA . MET A 1 221 ? 7.372 -140.250 -35.177 1.00 57.60 ? 221 MET A CA 1 ATOM 1725 C C . MET A 1 221 ? 7.767 -141.053 -33.959 1.00 57.69 ? 221 MET A C 1 ATOM 1726 O O . MET A 1 221 ? 8.942 -141.124 -33.613 1.00 57.83 ? 221 MET A O 1 ATOM 1727 C CB . MET A 1 221 ? 7.505 -141.149 -36.397 1.00 57.67 ? 221 MET A CB 1 ATOM 1728 C CG . MET A 1 221 ? 6.767 -140.644 -37.602 1.00 58.66 ? 221 MET A CG 1 ATOM 1729 S SD . MET A 1 221 ? 4.994 -140.879 -37.481 1.00 60.04 ? 221 MET A SD 1 ATOM 1730 C CE . MET A 1 221 ? 4.481 -139.837 -38.858 1.00 60.06 ? 221 MET A CE 1 ATOM 1731 N N . TRP A 1 222 ? 6.778 -141.664 -33.319 1.00 57.81 ? 222 TRP A N 1 ATOM 1732 C CA . TRP A 1 222 ? 7.031 -142.648 -32.278 1.00 57.85 ? 222 TRP A CA 1 ATOM 1733 C C . TRP A 1 222 ? 7.211 -144.028 -32.903 1.00 58.07 ? 222 TRP A C 1 ATOM 1734 O O . TRP A 1 222 ? 6.530 -144.370 -33.868 1.00 58.26 ? 222 TRP A O 1 ATOM 1735 C CB . TRP A 1 222 ? 5.896 -142.658 -31.270 1.00 57.70 ? 222 TRP A CB 1 ATOM 1736 C CG . TRP A 1 222 ? 5.922 -141.494 -30.325 1.00 57.43 ? 222 TRP A CG 1 ATOM 1737 C CD1 . TRP A 1 222 ? 5.202 -140.339 -30.426 1.00 57.22 ? 222 TRP A CD1 1 ATOM 1738 C CD2 . TRP A 1 222 ? 6.700 -141.378 -29.122 1.00 57.15 ? 222 TRP A CD2 1 ATOM 1739 N NE1 . TRP A 1 222 ? 5.482 -139.508 -29.362 1.00 56.84 ? 222 TRP A NE1 1 ATOM 1740 C CE2 . TRP A 1 222 ? 6.398 -140.122 -28.548 1.00 56.77 ? 222 TRP A CE2 1 ATOM 1741 C CE3 . TRP A 1 222 ? 7.626 -142.211 -28.477 1.00 56.47 ? 222 TRP A CE3 1 ATOM 1742 C CZ2 . TRP A 1 222 ? 6.984 -139.683 -27.360 1.00 56.21 ? 222 TRP A CZ2 1 ATOM 1743 C CZ3 . TRP A 1 222 ? 8.210 -141.770 -27.301 1.00 55.73 ? 222 TRP A CZ3 1 ATOM 1744 C CH2 . TRP A 1 222 ? 7.886 -140.519 -26.755 1.00 55.83 ? 222 TRP A CH2 1 ATOM 1745 N N . MET A 1 223 ? 8.130 -144.815 -32.349 1.00 58.27 ? 223 MET A N 1 ATOM 1746 C CA . MET A 1 223 ? 8.559 -146.064 -32.972 1.00 58.42 ? 223 MET A CA 1 ATOM 1747 C C . MET A 1 223 ? 8.738 -147.203 -31.972 1.00 58.72 ? 223 MET A C 1 ATOM 1748 O O . MET A 1 223 ? 9.256 -147.012 -30.870 1.00 58.87 ? 223 MET A O 1 ATOM 1749 C CB . MET A 1 223 ? 9.896 -145.859 -33.696 1.00 58.41 ? 223 MET A CB 1 ATOM 1750 C CG . MET A 1 223 ? 10.007 -144.597 -34.538 1.00 58.06 ? 223 MET A CG 1 ATOM 1751 S SD . MET A 1 223 ? 9.464 -144.841 -36.231 1.00 58.09 ? 223 MET A SD 1 ATOM 1752 C CE . MET A 1 223 ? 10.942 -145.532 -36.982 1.00 57.02 ? 223 MET A CE 1 ATOM 1753 N N . ARG A 1 224 ? 8.313 -148.393 -32.366 1.00 59.02 ? 224 ARG A N 1 ATOM 1754 C CA . ARG A 1 224 ? 8.790 -149.601 -31.716 1.00 59.40 ? 224 ARG A CA 1 ATOM 1755 C C . ARG A 1 224 ? 9.718 -150.305 -32.709 1.00 59.83 ? 224 ARG A C 1 ATOM 1756 O O . ARG A 1 224 ? 9.273 -151.043 -33.597 1.00 59.81 ? 224 ARG A O 1 ATOM 1757 C CB . ARG A 1 224 ? 7.640 -150.498 -31.243 1.00 59.29 ? 224 ARG A CB 1 ATOM 1758 C CG . ARG A 1 224 ? 8.097 -151.744 -30.493 1.00 59.08 ? 224 ARG A CG 1 ATOM 1759 C CD . ARG A 1 224 ? 6.985 -152.361 -29.668 1.00 58.58 ? 224 ARG A CD 1 ATOM 1760 N NE . ARG A 1 224 ? 6.911 -151.801 -28.318 1.00 57.99 ? 224 ARG A NE 1 ATOM 1761 C CZ . ARG A 1 224 ? 5.932 -151.016 -27.871 1.00 57.12 ? 224 ARG A CZ 1 ATOM 1762 N NH1 . ARG A 1 224 ? 4.917 -150.682 -28.659 1.00 56.33 ? 224 ARG A NH1 1 ATOM 1763 N NH2 . ARG A 1 224 ? 5.965 -150.569 -26.622 1.00 56.63 ? 224 ARG A NH2 1 ATOM 1764 N N . GLY A 1 225 ? 11.014 -150.042 -32.549 1.00 60.33 ? 225 GLY A N 1 ATOM 1765 C CA . GLY A 1 225 ? 12.026 -150.499 -33.485 1.00 60.90 ? 225 GLY A CA 1 ATOM 1766 C C . GLY A 1 225 ? 11.809 -149.793 -34.803 1.00 61.43 ? 225 GLY A C 1 ATOM 1767 O O . GLY A 1 225 ? 11.539 -148.592 -34.834 1.00 61.27 ? 225 GLY A O 1 ATOM 1768 N N . ASP A 1 226 ? 11.918 -150.558 -35.884 1.00 62.09 ? 226 ASP A N 1 ATOM 1769 C CA . ASP A 1 226 ? 11.655 -150.099 -37.251 1.00 62.72 ? 226 ASP A CA 1 ATOM 1770 C C . ASP A 1 226 ? 10.196 -149.669 -37.464 1.00 62.64 ? 226 ASP A C 1 ATOM 1771 O O . ASP A 1 226 ? 9.914 -148.777 -38.264 1.00 62.83 ? 226 ASP A O 1 ATOM 1772 C CB . ASP A 1 226 ? 12.008 -151.218 -38.239 1.00 63.10 ? 226 ASP A CB 1 ATOM 1773 C CG . ASP A 1 226 ? 11.390 -152.578 -37.844 1.00 64.67 ? 226 ASP A CG 1 ATOM 1774 O OD1 . ASP A 1 226 ? 11.638 -153.067 -36.699 1.00 65.37 ? 226 ASP A OD1 1 ATOM 1775 O OD2 . ASP A 1 226 ? 10.654 -153.163 -38.687 1.00 66.37 ? 226 ASP A OD2 1 ATOM 1776 N N . GLN A 1 227 ? 9.278 -150.304 -36.743 1.00 62.55 ? 227 GLN A N 1 ATOM 1777 C CA . GLN A 1 227 ? 7.853 -150.064 -36.914 1.00 62.56 ? 227 GLN A CA 1 ATOM 1778 C C . GLN A 1 227 ? 7.433 -148.687 -36.404 1.00 62.30 ? 227 GLN A C 1 ATOM 1779 O O . GLN A 1 227 ? 7.684 -148.343 -35.251 1.00 62.39 ? 227 GLN A O 1 ATOM 1780 C CB . GLN A 1 227 ? 7.053 -151.178 -36.228 1.00 62.75 ? 227 GLN A CB 1 ATOM 1781 C CG . GLN A 1 227 ? 5.685 -150.752 -35.704 1.00 63.68 ? 227 GLN A CG 1 ATOM 1782 C CD . GLN A 1 227 ? 4.845 -151.917 -35.204 1.00 64.99 ? 227 GLN A CD 1 ATOM 1783 O OE1 . GLN A 1 227 ? 4.688 -152.928 -35.896 1.00 65.22 ? 227 GLN A OE1 1 ATOM 1784 N NE2 . GLN A 1 227 ? 4.281 -151.771 -34.002 1.00 65.01 ? 227 GLN A NE2 1 ATOM 1785 N N . GLU A 1 228 ? 6.793 -147.912 -37.278 1.00 62.07 ? 228 GLU A N 1 ATOM 1786 C CA . GLU A 1 228 ? 6.221 -146.614 -36.917 1.00 61.73 ? 228 GLU A CA 1 ATOM 1787 C C . GLU A 1 228 ? 4.885 -146.807 -36.211 1.00 61.81 ? 228 GLU A C 1 ATOM 1788 O O . GLU A 1 228 ? 4.020 -147.525 -36.702 1.00 61.75 ? 228 GLU A O 1 ATOM 1789 C CB . GLU A 1 228 ? 6.025 -145.753 -38.166 1.00 61.52 ? 228 GLU A CB 1 ATOM 1790 C CG . GLU A 1 228 ? 7.118 -145.941 -39.213 1.00 61.15 ? 228 GLU A CG 1 ATOM 1791 C CD . GLU A 1 228 ? 7.187 -144.823 -40.244 1.00 60.01 ? 228 GLU A CD 1 ATOM 1792 O OE1 . GLU A 1 228 ? 6.426 -143.839 -40.138 1.00 59.65 ? 228 GLU A OE1 1 ATOM 1793 O OE2 . GLU A 1 228 ? 8.020 -144.933 -41.166 1.00 59.33 ? 228 GLU A OE2 1 ATOM 1794 N N . GLN A 1 229 ? 4.720 -146.173 -35.056 1.00 62.06 ? 229 GLN A N 1 ATOM 1795 C CA . GLN A 1 229 ? 3.457 -146.241 -34.314 1.00 62.50 ? 229 GLN A CA 1 ATOM 1796 C C . GLN A 1 229 ? 2.419 -145.320 -34.946 1.00 62.70 ? 229 GLN A C 1 ATOM 1797 O O . GLN A 1 229 ? 2.619 -144.106 -34.987 1.00 62.67 ? 229 GLN A O 1 ATOM 1798 C CB . GLN A 1 229 ? 3.658 -145.856 -32.839 1.00 62.58 ? 229 GLN A CB 1 ATOM 1799 C CG . GLN A 1 229 ? 4.722 -146.654 -32.094 1.00 62.31 ? 229 GLN A CG 1 ATOM 1800 C CD . GLN A 1 229 ? 4.502 -148.147 -32.183 1.00 61.80 ? 229 GLN A CD 1 ATOM 1801 O OE1 . GLN A 1 229 ? 3.631 -148.709 -31.510 1.00 61.08 ? 229 GLN A OE1 1 ATOM 1802 N NE2 . GLN A 1 229 ? 5.298 -148.803 -33.018 1.00 61.90 ? 229 GLN A NE2 1 ATOM 1803 N N . GLN A 1 230 ? 1.310 -145.887 -35.418 1.00 62.95 ? 230 GLN A N 1 ATOM 1804 C CA . GLN A 1 230 ? 0.334 -145.108 -36.193 1.00 63.21 ? 230 GLN A CA 1 ATOM 1805 C C . GLN A 1 230 ? -0.489 -144.120 -35.376 1.00 63.07 ? 230 GLN A C 1 ATOM 1806 O O . GLN A 1 230 ? -1.116 -143.228 -35.942 1.00 63.12 ? 230 GLN A O 1 ATOM 1807 C CB . GLN A 1 230 ? -0.588 -146.008 -37.034 1.00 63.49 ? 230 GLN A CB 1 ATOM 1808 C CG . GLN A 1 230 ? 0.092 -146.745 -38.209 1.00 64.43 ? 230 GLN A CG 1 ATOM 1809 C CD . GLN A 1 230 ? 1.047 -145.869 -39.034 1.00 65.46 ? 230 GLN A CD 1 ATOM 1810 O OE1 . GLN A 1 230 ? 0.972 -144.635 -39.017 1.00 65.98 ? 230 GLN A OE1 1 ATOM 1811 N NE2 . GLN A 1 230 ? 1.950 -146.518 -39.761 1.00 65.98 ? 230 GLN A NE2 1 ATOM 1812 N N . GLY A 1 231 ? -0.474 -144.268 -34.054 1.00 62.98 ? 231 GLY A N 1 ATOM 1813 C CA . GLY A 1 231 ? -1.233 -143.380 -33.174 1.00 62.89 ? 231 GLY A CA 1 ATOM 1814 C C . GLY A 1 231 ? -0.585 -142.034 -32.881 1.00 62.81 ? 231 GLY A C 1 ATOM 1815 O O . GLY A 1 231 ? -1.048 -141.303 -32.000 1.00 62.75 ? 231 GLY A O 1 ATOM 1816 N N . THR A 1 232 ? 0.480 -141.709 -33.617 1.00 62.78 ? 232 THR A N 1 ATOM 1817 C CA . THR A 1 232 ? 1.228 -140.459 -33.438 1.00 62.79 ? 232 THR A CA 1 ATOM 1818 C C . THR A 1 232 ? 0.438 -139.264 -33.957 1.00 62.73 ? 232 THR A C 1 ATOM 1819 O O . THR A 1 232 ? -0.029 -139.260 -35.098 1.00 62.75 ? 232 THR A O 1 ATOM 1820 C CB . THR A 1 232 ? 2.605 -140.484 -34.167 1.00 62.83 ? 232 THR A CB 1 ATOM 1821 O OG1 . THR A 1 232 ? 3.204 -141.780 -34.060 1.00 63.09 ? 232 THR A OG1 1 ATOM 1822 C CG2 . THR A 1 232 ? 3.555 -139.454 -33.574 1.00 62.83 ? 232 THR A CG2 1 ATOM 1823 N N . HIS A 1 233 ? 0.294 -138.251 -33.112 1.00 62.72 ? 233 HIS A N 1 ATOM 1824 C CA . HIS A 1 233 ? -0.387 -137.026 -33.502 1.00 62.91 ? 233 HIS A CA 1 ATOM 1825 C C . HIS A 1 233 ? 0.576 -135.848 -33.469 1.00 62.35 ? 233 HIS A C 1 ATOM 1826 O O . HIS A 1 233 ? 0.999 -135.426 -32.394 1.00 62.40 ? 233 HIS A O 1 ATOM 1827 C CB . HIS A 1 233 ? -1.588 -136.744 -32.584 1.00 63.35 ? 233 HIS A CB 1 ATOM 1828 C CG . HIS A 1 233 ? -2.700 -137.746 -32.699 1.00 65.08 ? 233 HIS A CG 1 ATOM 1829 N ND1 . HIS A 1 233 ? -3.550 -138.035 -31.651 1.00 66.50 ? 233 HIS A ND1 1 ATOM 1830 C CD2 . HIS A 1 233 ? -3.104 -138.525 -33.734 1.00 66.37 ? 233 HIS A CD2 1 ATOM 1831 C CE1 . HIS A 1 233 ? -4.432 -138.943 -32.036 1.00 66.77 ? 233 HIS A CE1 1 ATOM 1832 N NE2 . HIS A 1 233 ? -4.181 -139.260 -33.295 1.00 66.78 ? 233 HIS A NE2 1 ATOM 1833 N N . ARG A 1 234 ? 0.925 -135.327 -34.644 1.00 61.67 ? 234 ARG A N 1 ATOM 1834 C CA . ARG A 1 234 ? 1.730 -134.107 -34.735 1.00 61.03 ? 234 ARG A CA 1 ATOM 1835 C C . ARG A 1 234 ? 0.898 -132.904 -34.328 1.00 59.86 ? 234 ARG A C 1 ATOM 1836 O O . ARG A 1 234 ? -0.278 -132.815 -34.683 1.00 59.98 ? 234 ARG A O 1 ATOM 1837 C CB . ARG A 1 234 ? 2.256 -133.885 -36.155 1.00 61.49 ? 234 ARG A CB 1 ATOM 1838 C CG . ARG A 1 234 ? 3.372 -134.819 -36.575 1.00 63.71 ? 234 ARG A CG 1 ATOM 1839 C CD . ARG A 1 234 ? 4.070 -134.305 -37.831 1.00 67.96 ? 234 ARG A CD 1 ATOM 1840 N NE . ARG A 1 234 ? 4.660 -135.402 -38.606 1.00 71.32 ? 234 ARG A NE 1 ATOM 1841 C CZ . ARG A 1 234 ? 5.422 -135.246 -39.691 1.00 72.66 ? 234 ARG A CZ 1 ATOM 1842 N NH1 . ARG A 1 234 ? 5.709 -134.024 -40.147 1.00 72.94 ? 234 ARG A NH1 1 ATOM 1843 N NH2 . ARG A 1 234 ? 5.900 -136.320 -40.319 1.00 72.71 ? 234 ARG A NH2 1 ATOM 1844 N N . GLY A 1 235 ? 1.511 -131.991 -33.577 1.00 58.49 ? 235 GLY A N 1 ATOM 1845 C CA . GLY A 1 235 ? 0.893 -130.710 -33.231 1.00 56.63 ? 235 GLY A CA 1 ATOM 1846 C C . GLY A 1 235 ? 1.206 -129.693 -34.305 1.00 55.36 ? 235 GLY A C 1 ATOM 1847 O O . GLY A 1 235 ? 1.781 -130.031 -35.336 1.00 55.32 ? 235 GLY A O 1 ATOM 1848 N N . ASP A 1 236 ? 0.825 -128.446 -34.074 1.00 54.24 ? 236 ASP A N 1 ATOM 1849 C CA . ASP A 1 236 ? 1.101 -127.382 -35.034 1.00 53.19 ? 236 ASP A CA 1 ATOM 1850 C C . ASP A 1 236 ? 2.488 -126.783 -34.804 1.00 52.34 ? 236 ASP A C 1 ATOM 1851 O O . ASP A 1 236 ? 2.946 -126.681 -33.668 1.00 52.31 ? 236 ASP A O 1 ATOM 1852 C CB . ASP A 1 236 ? 0.056 -126.263 -34.931 1.00 53.34 ? 236 ASP A CB 1 ATOM 1853 C CG . ASP A 1 236 ? -1.376 -126.770 -34.982 1.00 53.37 ? 236 ASP A CG 1 ATOM 1854 O OD1 . ASP A 1 236 ? -2.245 -126.060 -34.426 1.00 53.23 ? 236 ASP A OD1 1 ATOM 1855 O OD2 . ASP A 1 236 ? -1.637 -127.850 -35.572 1.00 53.03 ? 236 ASP A OD2 1 ATOM 1856 N N . PHE A 1 237 ? 3.139 -126.370 -35.887 1.00 51.14 ? 237 PHE A N 1 ATOM 1857 C CA . PHE A 1 237 ? 4.429 -125.699 -35.810 1.00 49.93 ? 237 PHE A CA 1 ATOM 1858 C C . PHE A 1 237 ? 4.328 -124.401 -35.002 1.00 49.25 ? 237 PHE A C 1 ATOM 1859 O O . PHE A 1 237 ? 3.610 -123.481 -35.376 1.00 49.17 ? 237 PHE A O 1 ATOM 1860 C CB . PHE A 1 237 ? 4.945 -125.413 -37.222 1.00 49.95 ? 237 PHE A CB 1 ATOM 1861 C CG . PHE A 1 237 ? 5.294 -126.645 -38.003 1.00 49.85 ? 237 PHE A CG 1 ATOM 1862 C CD1 . PHE A 1 237 ? 6.617 -127.035 -38.149 1.00 49.73 ? 237 PHE A CD1 1 ATOM 1863 C CD2 . PHE A 1 237 ? 4.301 -127.423 -38.592 1.00 50.79 ? 237 PHE A CD2 1 ATOM 1864 C CE1 . PHE A 1 237 ? 6.952 -128.186 -38.868 1.00 50.03 ? 237 PHE A CE1 1 ATOM 1865 C CE2 . PHE A 1 237 ? 4.627 -128.583 -39.316 1.00 50.96 ? 237 PHE A CE2 1 ATOM 1866 C CZ . PHE A 1 237 ? 5.955 -128.962 -39.452 1.00 50.32 ? 237 PHE A CZ 1 ATOM 1867 N N . LEU A 1 238 ? 5.044 -124.338 -33.887 1.00 48.47 ? 238 LEU A N 1 ATOM 1868 C CA . LEU A 1 238 ? 5.039 -123.152 -33.038 1.00 47.74 ? 238 LEU A CA 1 ATOM 1869 C C . LEU A 1 238 ? 6.354 -122.391 -33.133 1.00 47.55 ? 238 LEU A C 1 ATOM 1870 O O . LEU A 1 238 ? 7.423 -122.995 -33.140 1.00 47.54 ? 238 LEU A O 1 ATOM 1871 C CB . LEU A 1 238 ? 4.795 -123.539 -31.583 1.00 47.54 ? 238 LEU A CB 1 ATOM 1872 C CG . LEU A 1 238 ? 3.629 -124.454 -31.236 1.00 46.84 ? 238 LEU A CG 1 ATOM 1873 C CD1 . LEU A 1 238 ? 3.647 -124.681 -29.759 1.00 46.20 ? 238 LEU A CD1 1 ATOM 1874 C CD2 . LEU A 1 238 ? 2.304 -123.859 -31.658 1.00 46.73 ? 238 LEU A CD2 1 ATOM 1875 N N . PRO A 1 239 ? 6.287 -121.055 -33.184 1.00 47.43 ? 239 PRO A N 1 ATOM 1876 C CA . PRO A 1 239 ? 7.525 -120.297 -33.332 1.00 47.35 ? 239 PRO A CA 1 ATOM 1877 C C . PRO A 1 239 ? 8.273 -120.101 -32.033 1.00 47.22 ? 239 PRO A C 1 ATOM 1878 O O . PRO A 1 239 ? 7.674 -119.822 -30.996 1.00 46.84 ? 239 PRO A O 1 ATOM 1879 C CB . PRO A 1 239 ? 7.040 -118.939 -33.844 1.00 47.45 ? 239 PRO A CB 1 ATOM 1880 C CG . PRO A 1 239 ? 5.665 -118.796 -33.261 1.00 47.27 ? 239 PRO A CG 1 ATOM 1881 C CD . PRO A 1 239 ? 5.095 -120.187 -33.179 1.00 47.32 ? 239 PRO A CD 1 ATOM 1882 N N . ASN A 1 240 ? 9.582 -120.252 -32.100 1.00 47.44 ? 240 ASN A N 1 ATOM 1883 C CA . ASN A 1 240 ? 10.437 -119.704 -31.076 1.00 48.13 ? 240 ASN A CA 1 ATOM 1884 C C . ASN A 1 240 ? 10.701 -118.256 -31.474 1.00 48.62 ? 240 ASN A C 1 ATOM 1885 O O . ASN A 1 240 ? 10.465 -117.884 -32.628 1.00 48.91 ? 240 ASN A O 1 ATOM 1886 C CB . ASN A 1 240 ? 11.738 -120.490 -30.990 1.00 48.10 ? 240 ASN A CB 1 ATOM 1887 C CG . ASN A 1 240 ? 11.529 -121.910 -30.508 1.00 48.42 ? 240 ASN A CG 1 ATOM 1888 O OD1 . ASN A 1 240 ? 10.865 -122.143 -29.498 1.00 49.00 ? 240 ASN A OD1 1 ATOM 1889 N ND2 . ASN A 1 240 ? 12.110 -122.869 -31.220 1.00 48.37 ? 240 ASN A ND2 1 ATOM 1890 N N . ALA A 1 241 ? 11.175 -117.442 -30.535 1.00 49.10 ? 241 ALA A N 1 ATOM 1891 C CA . ALA A 1 241 ? 11.446 -116.034 -30.815 1.00 49.55 ? 241 ALA A CA 1 ATOM 1892 C C . ALA A 1 241 ? 12.764 -115.822 -31.559 1.00 49.96 ? 241 ALA A C 1 ATOM 1893 O O . ALA A 1 241 ? 12.950 -114.795 -32.207 1.00 49.93 ? 241 ALA A O 1 ATOM 1894 C CB . ALA A 1 241 ? 11.401 -115.209 -29.536 1.00 49.53 ? 241 ALA A CB 1 ATOM 1895 N N . ASP A 1 242 ? 13.664 -116.798 -31.475 1.00 50.57 ? 242 ASP A N 1 ATOM 1896 C CA . ASP A 1 242 ? 14.953 -116.710 -32.145 1.00 51.45 ? 242 ASP A CA 1 ATOM 1897 C C . ASP A 1 242 ? 14.889 -117.254 -33.576 1.00 52.11 ? 242 ASP A C 1 ATOM 1898 O O . ASP A 1 242 ? 15.880 -117.781 -34.093 1.00 52.19 ? 242 ASP A O 1 ATOM 1899 C CB . ASP A 1 242 ? 16.020 -117.446 -31.330 1.00 51.53 ? 242 ASP A CB 1 ATOM 1900 C CG . ASP A 1 242 ? 15.857 -118.959 -31.376 1.00 52.07 ? 242 ASP A CG 1 ATOM 1901 O OD1 . ASP A 1 242 ? 14.703 -119.429 -31.441 1.00 52.97 ? 242 ASP A OD1 1 ATOM 1902 O OD2 . ASP A 1 242 ? 16.882 -119.677 -31.351 1.00 51.97 ? 242 ASP A OD2 1 ATOM 1903 N N . GLU A 1 243 ? 13.716 -117.126 -34.199 1.00 52.91 ? 243 GLU A N 1 ATOM 1904 C CA . GLU A 1 243 ? 13.458 -117.611 -35.568 1.00 53.69 ? 243 GLU A CA 1 ATOM 1905 C C . GLU A 1 243 ? 13.807 -119.082 -35.777 1.00 53.72 ? 243 GLU A C 1 ATOM 1906 O O . GLU A 1 243 ? 14.408 -119.453 -36.788 1.00 53.80 ? 243 GLU A O 1 ATOM 1907 C CB . GLU A 1 243 ? 14.181 -116.754 -36.610 1.00 53.95 ? 243 GLU A CB 1 ATOM 1908 C CG . GLU A 1 243 ? 13.815 -115.289 -36.557 1.00 55.78 ? 243 GLU A CG 1 ATOM 1909 C CD . GLU A 1 243 ? 14.125 -114.576 -37.849 1.00 57.96 ? 243 GLU A CD 1 ATOM 1910 O OE1 . GLU A 1 243 ? 15.294 -114.654 -38.306 1.00 58.58 ? 243 GLU A OE1 1 ATOM 1911 O OE2 . GLU A 1 243 ? 13.191 -113.950 -38.407 1.00 58.73 ? 243 GLU A OE2 1 ATOM 1912 N N . THR A 1 244 ? 13.444 -119.904 -34.800 1.00 53.88 ? 244 THR A N 1 ATOM 1913 C CA . THR A 1 244 ? 13.496 -121.354 -34.932 1.00 53.95 ? 244 THR A CA 1 ATOM 1914 C C . THR A 1 244 ? 12.093 -121.905 -34.668 1.00 54.08 ? 244 THR A C 1 ATOM 1915 O O . THR A 1 244 ? 11.186 -121.154 -34.296 1.00 54.23 ? 244 THR A O 1 ATOM 1916 C CB . THR A 1 244 ? 14.528 -121.981 -33.976 1.00 53.89 ? 244 THR A CB 1 ATOM 1917 O OG1 . THR A 1 244 ? 14.290 -121.530 -32.639 1.00 53.54 ? 244 THR A OG1 1 ATOM 1918 C CG2 . THR A 1 244 ? 15.937 -121.601 -34.383 1.00 54.05 ? 244 THR A CG2 1 ATOM 1919 N N . TRP A 1 245 ? 11.906 -123.203 -34.866 1.00 54.12 ? 245 TRP A N 1 ATOM 1920 C CA . TRP A 1 245 ? 10.584 -123.788 -34.734 1.00 54.43 ? 245 TRP A CA 1 ATOM 1921 C C . TRP A 1 245 ? 10.491 -124.824 -33.626 1.00 54.51 ? 245 TRP A C 1 ATOM 1922 O O . TRP A 1 245 ? 11.489 -125.421 -33.233 1.00 54.74 ? 245 TRP A O 1 ATOM 1923 C CB . TRP A 1 245 ? 10.142 -124.381 -36.067 1.00 54.60 ? 245 TRP A CB 1 ATOM 1924 C CG . TRP A 1 245 ? 9.857 -123.328 -37.084 1.00 55.77 ? 245 TRP A CG 1 ATOM 1925 C CD1 . TRP A 1 245 ? 10.666 -122.934 -38.113 1.00 56.46 ? 245 TRP A CD1 1 ATOM 1926 C CD2 . TRP A 1 245 ? 8.683 -122.510 -37.159 1.00 56.77 ? 245 TRP A CD2 1 ATOM 1927 N NE1 . TRP A 1 245 ? 10.066 -121.924 -38.828 1.00 56.98 ? 245 TRP A NE1 1 ATOM 1928 C CE2 . TRP A 1 245 ? 8.848 -121.644 -38.264 1.00 57.21 ? 245 TRP A CE2 1 ATOM 1929 C CE3 . TRP A 1 245 ? 7.505 -122.426 -36.402 1.00 56.48 ? 245 TRP A CE3 1 ATOM 1930 C CZ2 . TRP A 1 245 ? 7.877 -120.705 -38.630 1.00 57.56 ? 245 TRP A CZ2 1 ATOM 1931 C CZ3 . TRP A 1 245 ? 6.542 -121.495 -36.766 1.00 56.74 ? 245 TRP A CZ3 1 ATOM 1932 C CH2 . TRP A 1 245 ? 6.735 -120.647 -37.871 1.00 57.17 ? 245 TRP A CH2 1 ATOM 1933 N N . TYR A 1 246 ? 9.280 -125.019 -33.121 1.00 54.61 ? 246 TYR A N 1 ATOM 1934 C CA . TYR A 1 246 ? 9.007 -126.029 -32.112 1.00 54.67 ? 246 TYR A CA 1 ATOM 1935 C C . TYR A 1 246 ? 7.804 -126.870 -32.527 1.00 54.42 ? 246 TYR A C 1 ATOM 1936 O O . TYR A 1 246 ? 6.769 -126.331 -32.915 1.00 54.31 ? 246 TYR A O 1 ATOM 1937 C CB . TYR A 1 246 ? 8.756 -125.372 -30.747 1.00 54.99 ? 246 TYR A CB 1 ATOM 1938 C CG . TYR A 1 246 ? 8.219 -126.329 -29.699 1.00 56.21 ? 246 TYR A CG 1 ATOM 1939 C CD1 . TYR A 1 246 ? 8.961 -126.649 -28.567 1.00 57.37 ? 246 TYR A CD1 1 ATOM 1940 C CD2 . TYR A 1 246 ? 6.967 -126.920 -29.851 1.00 57.16 ? 246 TYR A CD2 1 ATOM 1941 C CE1 . TYR A 1 246 ? 8.462 -127.536 -27.616 1.00 58.31 ? 246 TYR A CE1 1 ATOM 1942 C CE2 . TYR A 1 246 ? 6.470 -127.809 -28.930 1.00 57.98 ? 246 TYR A CE2 1 ATOM 1943 C CZ . TYR A 1 246 ? 7.208 -128.113 -27.812 1.00 58.99 ? 246 TYR A CZ 1 ATOM 1944 O OH . TYR A 1 246 ? 6.670 -128.998 -26.902 1.00 60.29 ? 246 TYR A OH 1 ATOM 1945 N N . LEU A 1 247 ? 7.947 -128.190 -32.424 1.00 54.34 ? 247 LEU A N 1 ATOM 1946 C CA . LEU A 1 247 ? 6.871 -129.137 -32.712 1.00 54.29 ? 247 LEU A CA 1 ATOM 1947 C C . LEU A 1 247 ? 6.824 -130.237 -31.657 1.00 54.33 ? 247 LEU A C 1 ATOM 1948 O O . LEU A 1 247 ? 7.857 -130.606 -31.093 1.00 54.40 ? 247 LEU A O 1 ATOM 1949 C CB . LEU A 1 247 ? 7.096 -129.779 -34.076 1.00 54.32 ? 247 LEU A CB 1 ATOM 1950 C CG . LEU A 1 247 ? 5.967 -130.651 -34.623 1.00 54.72 ? 247 LEU A CG 1 ATOM 1951 C CD1 . LEU A 1 247 ? 5.020 -129.801 -35.447 1.00 56.02 ? 247 LEU A CD1 1 ATOM 1952 C CD2 . LEU A 1 247 ? 6.515 -131.781 -35.467 1.00 55.23 ? 247 LEU A CD2 1 ATOM 1953 N N . GLN A 1 248 ? 5.633 -130.774 -31.403 1.00 54.33 ? 248 GLN A N 1 ATOM 1954 C CA . GLN A 1 248 ? 5.494 -131.916 -30.493 1.00 54.25 ? 248 GLN A CA 1 ATOM 1955 C C . GLN A 1 248 ? 4.573 -133.024 -31.021 1.00 54.10 ? 248 GLN A C 1 ATOM 1956 O O . GLN A 1 248 ? 3.482 -132.755 -31.511 1.00 54.27 ? 248 GLN A O 1 ATOM 1957 C CB . GLN A 1 248 ? 5.054 -131.448 -29.104 1.00 54.23 ? 248 GLN A CB 1 ATOM 1958 C CG . GLN A 1 248 ? 3.596 -131.077 -28.981 1.00 54.53 ? 248 GLN A CG 1 ATOM 1959 C CD . GLN A 1 248 ? 3.208 -130.779 -27.553 1.00 55.61 ? 248 GLN A CD 1 ATOM 1960 O OE1 . GLN A 1 248 ? 3.765 -129.877 -26.917 1.00 55.76 ? 248 GLN A OE1 1 ATOM 1961 N NE2 . GLN A 1 248 ? 2.245 -131.533 -27.035 1.00 55.85 ? 248 GLN A NE2 1 ATOM 1962 N N . ALA A 1 249 ? 5.023 -134.269 -30.918 1.00 53.93 ? 249 ALA A N 1 ATOM 1963 C CA . ALA A 1 249 ? 4.219 -135.408 -31.338 1.00 53.87 ? 249 ALA A CA 1 ATOM 1964 C C . ALA A 1 249 ? 3.831 -136.273 -30.141 1.00 53.93 ? 249 ALA A C 1 ATOM 1965 O O . ALA A 1 249 ? 4.698 -136.778 -29.425 1.00 53.98 ? 249 ALA A O 1 ATOM 1966 C CB . ALA A 1 249 ? 4.968 -136.224 -32.379 1.00 53.79 ? 249 ALA A CB 1 ATOM 1967 N N . THR A 1 250 ? 2.531 -136.440 -29.920 1.00 54.12 ? 250 THR A N 1 ATOM 1968 C CA . THR A 1 250 ? 2.055 -137.195 -28.766 1.00 54.51 ? 250 THR A CA 1 ATOM 1969 C C . THR A 1 250 ? 1.371 -138.493 -29.167 1.00 55.10 ? 250 THR A C 1 ATOM 1970 O O . THR A 1 250 ? 0.457 -138.491 -29.989 1.00 55.26 ? 250 THR A O 1 ATOM 1971 C CB . THR A 1 250 ? 1.111 -136.363 -27.847 1.00 54.28 ? 250 THR A CB 1 ATOM 1972 O OG1 . THR A 1 250 ? -0.203 -136.323 -28.409 1.00 54.41 ? 250 THR A OG1 1 ATOM 1973 C CG2 . THR A 1 250 ? 1.620 -134.947 -27.662 1.00 53.70 ? 250 THR A CG2 1 ATOM 1974 N N . LEU A 1 251 ? 1.836 -139.594 -28.582 1.00 56.00 ? 251 LEU A N 1 ATOM 1975 C CA . LEU A 1 251 ? 1.209 -140.913 -28.722 1.00 57.01 ? 251 LEU A CA 1 ATOM 1976 C C . LEU A 1 251 ? 0.476 -141.291 -27.433 1.00 57.80 ? 251 LEU A C 1 ATOM 1977 O O . LEU A 1 251 ? 0.829 -140.825 -26.350 1.00 58.02 ? 251 LEU A O 1 ATOM 1978 C CB . LEU A 1 251 ? 2.255 -141.982 -29.087 1.00 56.83 ? 251 LEU A CB 1 ATOM 1979 C CG . LEU A 1 251 ? 1.921 -143.483 -29.080 1.00 56.69 ? 251 LEU A CG 1 ATOM 1980 C CD1 . LEU A 1 251 ? 0.775 -143.835 -30.021 1.00 57.36 ? 251 LEU A CD1 1 ATOM 1981 C CD2 . LEU A 1 251 ? 3.143 -144.303 -29.433 1.00 56.28 ? 251 LEU A CD2 1 ATOM 1982 N N . ASP A 1 252 ? -0.546 -142.132 -27.566 1.00 58.83 ? 252 ASP A N 1 ATOM 1983 C CA . ASP A 1 252 ? -1.360 -142.590 -26.442 1.00 59.67 ? 252 ASP A CA 1 ATOM 1984 C C . ASP A 1 252 ? -1.204 -144.111 -26.269 1.00 59.91 ? 252 ASP A C 1 ATOM 1985 O O . ASP A 1 252 ? -1.365 -144.871 -27.232 1.00 59.92 ? 252 ASP A O 1 ATOM 1986 C CB . ASP A 1 252 ? -2.822 -142.192 -26.688 1.00 59.95 ? 252 ASP A CB 1 ATOM 1987 C CG . ASP A 1 252 ? -3.764 -142.650 -25.581 1.00 61.16 ? 252 ASP A CG 1 ATOM 1988 O OD1 . ASP A 1 252 ? -4.210 -141.787 -24.793 1.00 62.56 ? 252 ASP A OD1 1 ATOM 1989 O OD2 . ASP A 1 252 ? -4.075 -143.862 -25.505 1.00 62.49 ? 252 ASP A OD2 1 ATOM 1990 N N . VAL A 1 253 ? -0.887 -144.545 -25.048 1.00 60.29 ? 253 VAL A N 1 ATOM 1991 C CA . VAL A 1 253 ? -0.632 -145.968 -24.767 1.00 60.72 ? 253 VAL A CA 1 ATOM 1992 C C . VAL A 1 253 ? -1.048 -146.441 -23.370 1.00 61.04 ? 253 VAL A C 1 ATOM 1993 O O . VAL A 1 253 ? -1.223 -145.633 -22.457 1.00 60.87 ? 253 VAL A O 1 ATOM 1994 C CB . VAL A 1 253 ? 0.855 -146.329 -24.976 1.00 60.72 ? 253 VAL A CB 1 ATOM 1995 C CG1 . VAL A 1 253 ? 1.189 -146.421 -26.466 1.00 61.06 ? 253 VAL A CG1 1 ATOM 1996 C CG2 . VAL A 1 253 ? 1.762 -145.337 -24.254 1.00 60.53 ? 253 VAL A CG2 1 ATOM 1997 N N . GLU A 1 254 ? -1.197 -147.759 -23.225 1.00 61.66 ? 254 GLU A N 1 ATOM 1998 C CA . GLU A 1 254 ? -1.453 -148.396 -21.927 1.00 62.44 ? 254 GLU A CA 1 ATOM 1999 C C . GLU A 1 254 ? -0.226 -148.265 -21.025 1.00 62.18 ? 254 GLU A C 1 ATOM 2000 O O . GLU A 1 254 ? 0.906 -148.445 -21.487 1.00 62.26 ? 254 GLU A O 1 ATOM 2001 C CB . GLU A 1 254 ? -1.768 -149.887 -22.105 1.00 62.94 ? 254 GLU A CB 1 ATOM 2002 C CG . GLU A 1 254 ? -3.148 -150.220 -22.671 1.00 65.12 ? 254 GLU A CG 1 ATOM 2003 C CD . GLU A 1 254 ? -3.228 -151.641 -23.248 1.00 68.33 ? 254 GLU A CD 1 ATOM 2004 O OE1 . GLU A 1 254 ? -2.175 -152.320 -23.389 1.00 69.40 ? 254 GLU A OE1 1 ATOM 2005 O OE2 . GLU A 1 254 ? -4.358 -152.075 -23.574 1.00 69.69 ? 254 GLU A OE2 1 ATOM 2006 N N . ALA A 1 255 ? -0.452 -147.971 -19.742 1.00 61.78 ? 255 ALA A N 1 ATOM 2007 C CA . ALA A 1 255 ? 0.639 -147.860 -18.765 1.00 61.27 ? 255 ALA A CA 1 ATOM 2008 C C . ALA A 1 255 ? 1.471 -149.143 -18.724 1.00 61.00 ? 255 ALA A C 1 ATOM 2009 O O . ALA A 1 255 ? 0.924 -150.243 -18.598 1.00 61.00 ? 255 ALA A O 1 ATOM 2010 C CB . ALA A 1 255 ? 0.096 -147.529 -17.389 1.00 61.19 ? 255 ALA A CB 1 ATOM 2011 N N . GLY A 1 256 ? 2.787 -148.991 -18.854 1.00 60.54 ? 256 GLY A N 1 ATOM 2012 C CA . GLY A 1 256 ? 3.704 -150.129 -18.923 1.00 60.04 ? 256 GLY A CA 1 ATOM 2013 C C . GLY A 1 256 ? 4.130 -150.459 -20.344 1.00 59.76 ? 256 GLY A C 1 ATOM 2014 O O . GLY A 1 256 ? 5.086 -151.203 -20.556 1.00 59.73 ? 256 GLY A O 1 ATOM 2015 N N . GLU A 1 257 ? 3.426 -149.895 -21.319 1.00 59.41 ? 257 GLU A N 1 ATOM 2016 C CA . GLU A 1 257 ? 3.691 -150.167 -22.728 1.00 59.15 ? 257 GLU A CA 1 ATOM 2017 C C . GLU A 1 257 ? 4.796 -149.251 -23.284 1.00 58.52 ? 257 GLU A C 1 ATOM 2018 O O . GLU A 1 257 ? 5.191 -149.378 -24.449 1.00 58.55 ? 257 GLU A O 1 ATOM 2019 C CB . GLU A 1 257 ? 2.388 -149.999 -23.517 1.00 59.49 ? 257 GLU A CB 1 ATOM 2020 C CG . GLU A 1 257 ? 2.265 -150.771 -24.834 1.00 60.62 ? 257 GLU A CG 1 ATOM 2021 C CD . GLU A 1 257 ? 0.962 -150.437 -25.583 1.00 62.23 ? 257 GLU A CD 1 ATOM 2022 O OE1 . GLU A 1 257 ? -0.064 -150.116 -24.927 1.00 61.15 ? 257 GLU A OE1 1 ATOM 2023 O OE2 . GLU A 1 257 ? 0.966 -150.496 -26.834 1.00 63.71 ? 257 GLU A OE2 1 ATOM 2024 N N . GLU A 1 258 ? 5.303 -148.351 -22.443 1.00 57.58 ? 258 GLU A N 1 ATOM 2025 C CA . GLU A 1 258 ? 6.268 -147.343 -22.874 1.00 56.84 ? 258 GLU A CA 1 ATOM 2026 C C . GLU A 1 258 ? 7.656 -147.899 -23.155 1.00 56.43 ? 258 GLU A C 1 ATOM 2027 O O . GLU A 1 258 ? 8.354 -147.400 -24.038 1.00 56.72 ? 258 GLU A O 1 ATOM 2028 C CB . GLU A 1 258 ? 6.385 -146.213 -21.859 1.00 56.74 ? 258 GLU A CB 1 ATOM 2029 C CG . GLU A 1 258 ? 5.073 -145.619 -21.417 1.00 56.74 ? 258 GLU A CG 1 ATOM 2030 C CD . GLU A 1 258 ? 4.565 -146.229 -20.129 1.00 57.10 ? 258 GLU A CD 1 ATOM 2031 O OE1 . GLU A 1 258 ? 4.691 -147.462 -19.967 1.00 57.50 ? 258 GLU A OE1 1 ATOM 2032 O OE2 . GLU A 1 258 ? 4.037 -145.474 -19.280 1.00 56.85 ? 258 GLU A OE2 1 ATOM 2033 N N . ALA A 1 259 ? 8.068 -148.912 -22.405 1.00 55.69 ? 259 ALA A N 1 ATOM 2034 C CA . ALA A 1 259 ? 9.380 -149.506 -22.611 1.00 55.10 ? 259 ALA A CA 1 ATOM 2035 C C . ALA A 1 259 ? 9.517 -150.022 -24.041 1.00 54.74 ? 259 ALA A C 1 ATOM 2036 O O . ALA A 1 259 ? 8.650 -150.754 -24.537 1.00 54.66 ? 259 ALA A O 1 ATOM 2037 C CB . ALA A 1 259 ? 9.626 -150.617 -21.611 1.00 55.31 ? 259 ALA A CB 1 ATOM 2038 N N . GLY A 1 260 ? 10.600 -149.613 -24.702 1.00 54.30 ? 260 GLY A N 1 ATOM 2039 C CA . GLY A 1 260 ? 10.878 -150.024 -26.079 1.00 53.70 ? 260 GLY A CA 1 ATOM 2040 C C . GLY A 1 260 ? 10.446 -149.004 -27.120 1.00 53.12 ? 260 GLY A C 1 ATOM 2041 O O . GLY A 1 260 ? 10.790 -149.117 -28.302 1.00 53.10 ? 260 GLY A O 1 ATOM 2042 N N . LEU A 1 261 ? 9.684 -148.009 -26.680 1.00 52.43 ? 261 LEU A N 1 ATOM 2043 C CA . LEU A 1 261 ? 9.263 -146.934 -27.558 1.00 51.64 ? 261 LEU A CA 1 ATOM 2044 C C . LEU A 1 261 ? 10.368 -145.902 -27.686 1.00 51.53 ? 261 LEU A C 1 ATOM 2045 O O . LEU A 1 261 ? 11.147 -145.696 -26.752 1.00 51.67 ? 261 LEU A O 1 ATOM 2046 C CB . LEU A 1 261 ? 7.980 -146.292 -27.047 1.00 51.31 ? 261 LEU A CB 1 ATOM 2047 C CG . LEU A 1 261 ? 6.726 -147.127 -27.269 1.00 50.42 ? 261 LEU A CG 1 ATOM 2048 C CD1 . LEU A 1 261 ? 5.519 -146.400 -26.725 1.00 49.35 ? 261 LEU A CD1 1 ATOM 2049 C CD2 . LEU A 1 261 ? 6.557 -147.441 -28.751 1.00 49.73 ? 261 LEU A CD2 1 ATOM 2050 N N . ALA A 1 262 ? 10.436 -145.275 -28.858 1.00 51.14 ? 262 ALA A N 1 ATOM 2051 C CA . ALA A 1 262 ? 11.455 -144.274 -29.170 1.00 50.73 ? 262 ALA A CA 1 ATOM 2052 C C . ALA A 1 262 ? 10.871 -143.151 -30.018 1.00 50.42 ? 262 ALA A C 1 ATOM 2053 O O . ALA A 1 262 ? 10.021 -143.400 -30.874 1.00 50.52 ? 262 ALA A O 1 ATOM 2054 C CB . ALA A 1 262 ? 12.617 -144.918 -29.903 1.00 50.75 ? 262 ALA A CB 1 ATOM 2055 N N . CYS A 1 263 ? 11.331 -141.922 -29.787 1.00 49.82 ? 263 CYS A N 1 ATOM 2056 C CA . CYS A 1 263 ? 10.919 -140.786 -30.601 1.00 49.06 ? 263 CYS A CA 1 ATOM 2057 C C . CYS A 1 263 ? 11.958 -140.438 -31.665 1.00 49.06 ? 263 CYS A C 1 ATOM 2058 O O . CYS A 1 263 ? 12.932 -139.749 -31.389 1.00 48.99 ? 263 CYS A O 1 ATOM 2059 C CB . CYS A 1 263 ? 10.603 -139.559 -29.746 1.00 48.73 ? 263 CYS A CB 1 ATOM 2060 S SG . CYS A 1 263 ? 10.200 -138.184 -30.809 1.00 47.48 ? 263 CYS A SG 1 ATOM 2061 N N . ARG A 1 264 ? 11.731 -140.910 -32.885 1.00 49.26 ? 264 ARG A N 1 ATOM 2062 C CA . ARG A 1 264 ? 12.622 -140.634 -34.011 1.00 49.65 ? 264 ARG A CA 1 ATOM 2063 C C . ARG A 1 264 ? 12.354 -139.261 -34.657 1.00 49.92 ? 264 ARG A C 1 ATOM 2064 O O . ARG A 1 264 ? 11.211 -138.932 -34.986 1.00 50.15 ? 264 ARG A O 1 ATOM 2065 C CB . ARG A 1 264 ? 12.519 -141.757 -35.048 1.00 49.50 ? 264 ARG A CB 1 ATOM 2066 C CG . ARG A 1 264 ? 13.527 -141.673 -36.170 1.00 49.78 ? 264 ARG A CG 1 ATOM 2067 C CD . ARG A 1 264 ? 13.868 -143.053 -36.666 1.00 51.00 ? 264 ARG A CD 1 ATOM 2068 N NE . ARG A 1 264 ? 14.962 -143.035 -37.634 1.00 52.76 ? 264 ARG A NE 1 ATOM 2069 C CZ . ARG A 1 264 ? 15.841 -144.025 -37.795 1.00 53.95 ? 264 ARG A CZ 1 ATOM 2070 N NH1 . ARG A 1 264 ? 15.768 -145.117 -37.042 1.00 54.58 ? 264 ARG A NH1 1 ATOM 2071 N NH2 . ARG A 1 264 ? 16.807 -143.926 -38.702 1.00 54.27 ? 264 ARG A NH2 1 ATOM 2072 N N . VAL A 1 265 ? 13.414 -138.468 -34.819 1.00 50.12 ? 265 VAL A N 1 ATOM 2073 C CA . VAL A 1 265 ? 13.348 -137.171 -35.502 1.00 50.18 ? 265 VAL A CA 1 ATOM 2074 C C . VAL A 1 265 ? 14.227 -137.195 -36.749 1.00 50.65 ? 265 VAL A C 1 ATOM 2075 O O . VAL A 1 265 ? 15.338 -137.736 -36.730 1.00 50.84 ? 265 VAL A O 1 ATOM 2076 C CB . VAL A 1 265 ? 13.802 -136.004 -34.592 1.00 49.98 ? 265 VAL A CB 1 ATOM 2077 C CG1 . VAL A 1 265 ? 13.646 -134.667 -35.298 1.00 49.58 ? 265 VAL A CG1 1 ATOM 2078 C CG2 . VAL A 1 265 ? 13.012 -135.996 -33.309 1.00 49.81 ? 265 VAL A CG2 1 ATOM 2079 N N . LYS A 1 266 ? 13.714 -136.623 -37.834 1.00 51.01 ? 266 LYS A N 1 ATOM 2080 C CA . LYS A 1 266 ? 14.483 -136.455 -39.056 1.00 51.36 ? 266 LYS A CA 1 ATOM 2081 C C . LYS A 1 266 ? 14.496 -134.982 -39.402 1.00 51.39 ? 266 LYS A C 1 ATOM 2082 O O . LYS A 1 266 ? 13.484 -134.296 -39.257 1.00 51.49 ? 266 LYS A O 1 ATOM 2083 C CB . LYS A 1 266 ? 13.894 -137.293 -40.191 1.00 51.34 ? 266 LYS A CB 1 ATOM 2084 C CG . LYS A 1 266 ? 14.209 -138.768 -40.047 1.00 52.76 ? 266 LYS A CG 1 ATOM 2085 C CD . LYS A 1 266 ? 13.506 -139.652 -41.069 1.00 55.52 ? 266 LYS A CD 1 ATOM 2086 C CE . LYS A 1 266 ? 13.599 -141.122 -40.631 1.00 57.57 ? 266 LYS A CE 1 ATOM 2087 N NZ . LYS A 1 266 ? 13.203 -142.129 -41.668 1.00 59.46 ? 266 LYS A NZ 1 ATOM 2088 N N . HIS A 1 267 ? 15.651 -134.491 -39.831 1.00 51.44 ? 267 HIS A N 1 ATOM 2089 C CA . HIS A 1 267 ? 15.783 -133.091 -40.179 1.00 51.60 ? 267 HIS A CA 1 ATOM 2090 C C . HIS A 1 267 ? 16.975 -132.872 -41.088 1.00 51.91 ? 267 HIS A C 1 ATOM 2091 O O . HIS A 1 267 ? 17.939 -133.642 -41.062 1.00 52.04 ? 267 HIS A O 1 ATOM 2092 C CB . HIS A 1 267 ? 15.918 -132.243 -38.917 1.00 51.56 ? 267 HIS A CB 1 ATOM 2093 C CG . HIS A 1 267 ? 15.673 -130.786 -39.141 1.00 51.32 ? 267 HIS A CG 1 ATOM 2094 N ND1 . HIS A 1 267 ? 16.680 -129.909 -39.479 1.00 51.20 ? 267 HIS A ND1 1 ATOM 2095 C CD2 . HIS A 1 267 ? 14.540 -130.049 -39.069 1.00 51.03 ? 267 HIS A CD2 1 ATOM 2096 C CE1 . HIS A 1 267 ? 16.177 -128.695 -39.609 1.00 51.24 ? 267 HIS A CE1 1 ATOM 2097 N NE2 . HIS A 1 267 ? 14.880 -128.752 -39.366 1.00 50.80 ? 267 HIS A NE2 1 ATOM 2098 N N . SER A 1 268 ? 16.892 -131.808 -41.886 1.00 52.17 ? 268 SER A N 1 ATOM 2099 C CA . SER A 1 268 ? 17.922 -131.437 -42.851 1.00 52.27 ? 268 SER A CA 1 ATOM 2100 C C . SER A 1 268 ? 19.233 -131.021 -42.202 1.00 52.55 ? 268 SER A C 1 ATOM 2101 O O . SER A 1 268 ? 20.282 -131.088 -42.839 1.00 52.93 ? 268 SER A O 1 ATOM 2102 C CB . SER A 1 268 ? 17.421 -130.293 -43.716 1.00 52.13 ? 268 SER A CB 1 ATOM 2103 O OG . SER A 1 268 ? 16.942 -129.247 -42.899 1.00 52.07 ? 268 SER A OG 1 ATOM 2104 N N . SER A 1 269 ? 19.178 -130.590 -40.944 1.00 52.66 ? 269 SER A N 1 ATOM 2105 C CA . SER A 1 269 ? 20.365 -130.084 -40.264 1.00 52.74 ? 269 SER A CA 1 ATOM 2106 C C . SER A 1 269 ? 21.245 -131.195 -39.714 1.00 53.02 ? 269 SER A C 1 ATOM 2107 O O . SER A 1 269 ? 22.376 -130.944 -39.303 1.00 53.30 ? 269 SER A O 1 ATOM 2108 C CB . SER A 1 269 ? 19.977 -129.112 -39.147 1.00 52.55 ? 269 SER A CB 1 ATOM 2109 O OG . SER A 1 269 ? 19.216 -129.760 -38.150 1.00 52.35 ? 269 SER A OG 1 ATOM 2110 N N . LEU A 1 270 ? 20.738 -132.423 -39.739 1.00 53.26 ? 270 LEU A N 1 ATOM 2111 C CA . LEU A 1 270 ? 21.335 -133.513 -38.968 1.00 53.52 ? 270 LEU A CA 1 ATOM 2112 C C . LEU A 1 270 ? 22.295 -134.398 -39.745 1.00 53.82 ? 270 LEU A C 1 ATOM 2113 O O . LEU A 1 270 ? 22.851 -135.355 -39.185 1.00 53.86 ? 270 LEU A O 1 ATOM 2114 C CB . LEU A 1 270 ? 20.229 -134.372 -38.355 1.00 53.38 ? 270 LEU A CB 1 ATOM 2115 C CG . LEU A 1 270 ? 19.260 -133.627 -37.438 1.00 53.48 ? 270 LEU A CG 1 ATOM 2116 C CD1 . LEU A 1 270 ? 18.166 -134.565 -36.969 1.00 53.67 ? 270 LEU A CD1 1 ATOM 2117 C CD2 . LEU A 1 270 ? 19.990 -132.991 -36.249 1.00 53.69 ? 270 LEU A CD2 1 ATOM 2118 N N . GLY A 1 271 ? 22.499 -134.073 -41.021 1.00 54.11 ? 271 GLY A N 1 ATOM 2119 C CA . GLY A 1 271 ? 23.191 -134.971 -41.937 1.00 54.34 ? 271 GLY A CA 1 ATOM 2120 C C . GLY A 1 271 ? 22.330 -136.210 -42.052 1.00 54.56 ? 271 GLY A C 1 ATOM 2121 O O . GLY A 1 271 ? 21.103 -136.120 -41.963 1.00 54.54 ? 271 GLY A O 1 ATOM 2122 N N . GLY A 1 272 ? 22.961 -137.368 -42.215 1.00 54.81 ? 272 GLY A N 1 ATOM 2123 C CA . GLY A 1 272 ? 22.223 -138.627 -42.293 1.00 55.11 ? 272 GLY A CA 1 ATOM 2124 C C . GLY A 1 272 ? 21.768 -139.155 -40.941 1.00 55.44 ? 272 GLY A C 1 ATOM 2125 O O . GLY A 1 272 ? 21.112 -140.195 -40.878 1.00 55.83 ? 272 GLY A O 1 ATOM 2126 N N . GLN A 1 273 ? 22.088 -138.426 -39.865 1.00 55.55 ? 273 GLN A N 1 ATOM 2127 C CA . GLN A 1 273 ? 21.959 -138.917 -38.474 1.00 55.32 ? 273 GLN A CA 1 ATOM 2128 C C . GLN A 1 273 ? 20.662 -138.545 -37.756 1.00 54.68 ? 273 GLN A C 1 ATOM 2129 O O . GLN A 1 273 ? 20.565 -137.485 -37.140 1.00 54.49 ? 273 GLN A O 1 ATOM 2130 C CB . GLN A 1 273 ? 23.133 -138.416 -37.633 1.00 55.61 ? 273 GLN A CB 1 ATOM 2131 C CG . GLN A 1 273 ? 24.459 -139.089 -37.926 1.00 57.03 ? 273 GLN A CG 1 ATOM 2132 C CD . GLN A 1 273 ? 25.611 -138.423 -37.189 1.00 59.36 ? 273 GLN A CD 1 ATOM 2133 O OE1 . GLN A 1 273 ? 25.420 -137.777 -36.143 1.00 59.94 ? 273 GLN A OE1 1 ATOM 2134 N NE2 . GLN A 1 273 ? 26.819 -138.576 -37.731 1.00 59.50 ? 273 GLN A NE2 1 ATOM 2135 N N . ASP A 1 274 ? 19.685 -139.441 -37.807 1.00 54.13 ? 274 ASP A N 1 ATOM 2136 C CA . ASP A 1 274 ? 18.397 -139.217 -37.155 1.00 53.68 ? 274 ASP A CA 1 ATOM 2137 C C . ASP A 1 274 ? 18.508 -139.211 -35.636 1.00 52.96 ? 274 ASP A C 1 ATOM 2138 O O . ASP A 1 274 ? 19.180 -140.063 -35.045 1.00 52.97 ? 274 ASP A O 1 ATOM 2139 C CB . ASP A 1 274 ? 17.388 -140.289 -37.574 1.00 53.99 ? 274 ASP A CB 1 ATOM 2140 C CG . ASP A 1 274 ? 17.190 -140.360 -39.078 1.00 55.20 ? 274 ASP A CG 1 ATOM 2141 O OD1 . ASP A 1 274 ? 17.785 -139.544 -39.819 1.00 56.79 ? 274 ASP A OD1 1 ATOM 2142 O OD2 . ASP A 1 274 ? 16.426 -141.241 -39.523 1.00 56.20 ? 274 ASP A OD2 1 ATOM 2143 N N . ILE A 1 275 ? 17.841 -138.243 -35.015 1.00 52.03 ? 275 ILE A N 1 ATOM 2144 C CA . ILE A 1 275 ? 17.693 -138.200 -33.566 1.00 51.09 ? 275 ILE A CA 1 ATOM 2145 C C . ILE A 1 275 ? 16.728 -139.289 -33.102 1.00 50.63 ? 275 ILE A C 1 ATOM 2146 O O . ILE A 1 275 ? 15.526 -139.216 -33.347 1.00 50.31 ? 275 ILE A O 1 ATOM 2147 C CB . ILE A 1 275 ? 17.184 -136.819 -33.091 1.00 51.09 ? 275 ILE A CB 1 ATOM 2148 C CG1 . ILE A 1 275 ? 18.290 -135.769 -33.212 1.00 50.84 ? 275 ILE A CG1 1 ATOM 2149 C CG2 . ILE A 1 275 ? 16.642 -136.888 -31.652 1.00 50.83 ? 275 ILE A CG2 1 ATOM 2150 C CD1 . ILE A 1 275 ? 17.845 -134.351 -32.845 1.00 50.53 ? 275 ILE A CD1 1 ATOM 2151 N N . ILE A 1 276 ? 17.261 -140.301 -32.431 1.00 50.25 ? 276 ILE A N 1 ATOM 2152 C CA . ILE A 1 276 ? 16.424 -141.356 -31.878 1.00 49.87 ? 276 ILE A CA 1 ATOM 2153 C C . ILE A 1 276 ? 16.497 -141.343 -30.349 1.00 49.73 ? 276 ILE A C 1 ATOM 2154 O O . ILE A 1 276 ? 17.529 -141.661 -29.768 1.00 50.03 ? 276 ILE A O 1 ATOM 2155 C CB . ILE A 1 276 ? 16.812 -142.741 -32.442 1.00 49.77 ? 276 ILE A CB 1 ATOM 2156 C CG1 . ILE A 1 276 ? 16.833 -142.714 -33.977 1.00 49.52 ? 276 ILE A CG1 1 ATOM 2157 C CG2 . ILE A 1 276 ? 15.842 -143.794 -31.946 1.00 49.81 ? 276 ILE A CG2 1 ATOM 2158 C CD1 . ILE A 1 276 ? 17.759 -143.734 -34.617 1.00 48.99 ? 276 ILE A CD1 1 ATOM 2159 N N . LEU A 1 277 ? 15.401 -140.953 -29.709 1.00 49.47 ? 277 LEU A N 1 ATOM 2160 C CA . LEU A 1 277 ? 15.298 -140.947 -28.249 1.00 49.51 ? 277 LEU A CA 1 ATOM 2161 C C . LEU A 1 277 ? 14.507 -142.151 -27.745 1.00 49.41 ? 277 LEU A C 1 ATOM 2162 O O . LEU A 1 277 ? 13.272 -142.160 -27.847 1.00 49.74 ? 277 LEU A O 1 ATOM 2163 C CB . LEU A 1 277 ? 14.568 -139.694 -27.773 1.00 49.58 ? 277 LEU A CB 1 ATOM 2164 C CG . LEU A 1 277 ? 15.339 -138.523 -27.190 1.00 50.45 ? 277 LEU A CG 1 ATOM 2165 C CD1 . LEU A 1 277 ? 16.390 -138.025 -28.170 1.00 52.35 ? 277 LEU A CD1 1 ATOM 2166 C CD2 . LEU A 1 277 ? 14.365 -137.414 -26.852 1.00 50.66 ? 277 LEU A CD2 1 ATOM 2167 N N . TYR A 1 278 ? 15.191 -143.151 -27.183 1.00 48.63 ? 278 TYR A N 1 ATOM 2168 C CA . TYR A 1 278 ? 14.488 -144.300 -26.612 1.00 47.37 ? 278 TYR A CA 1 ATOM 2169 C C . TYR A 1 278 ? 13.876 -143.908 -25.267 1.00 46.72 ? 278 TYR A C 1 ATOM 2170 O O . TYR A 1 278 ? 14.412 -143.055 -24.575 1.00 46.46 ? 278 TYR A O 1 ATOM 2171 C CB . TYR A 1 278 ? 15.423 -145.487 -26.484 1.00 47.28 ? 278 TYR A CB 1 ATOM 2172 C CG . TYR A 1 278 ? 15.847 -146.102 -27.800 1.00 46.91 ? 278 TYR A CG 1 ATOM 2173 C CD1 . TYR A 1 278 ? 16.988 -145.659 -28.465 1.00 47.50 ? 278 TYR A CD1 1 ATOM 2174 C CD2 . TYR A 1 278 ? 15.121 -147.150 -28.369 1.00 47.00 ? 278 TYR A CD2 1 ATOM 2175 C CE1 . TYR A 1 278 ? 17.393 -146.243 -29.679 1.00 47.86 ? 278 TYR A CE1 1 ATOM 2176 C CE2 . TYR A 1 278 ? 15.513 -147.742 -29.579 1.00 46.55 ? 278 TYR A CE2 1 ATOM 2177 C CZ . TYR A 1 278 ? 16.648 -147.283 -30.225 1.00 47.13 ? 278 TYR A CZ 1 ATOM 2178 O OH . TYR A 1 278 ? 17.038 -147.856 -31.412 1.00 46.96 ? 278 TYR A OH 1 ATOM 2179 N N . TRP A 1 279 ? 12.752 -144.523 -24.910 1.00 46.25 ? 279 TRP A N 1 ATOM 2180 C CA . TRP A 1 279 ? 11.929 -144.026 -23.801 1.00 45.71 ? 279 TRP A CA 1 ATOM 2181 C C . TRP A 1 279 ? 12.643 -143.928 -22.463 1.00 45.51 ? 279 TRP A C 1 ATOM 2182 O O . TRP A 1 279 ? 12.837 -142.833 -21.960 1.00 45.81 ? 279 TRP A O 1 ATOM 2183 C CB . TRP A 1 279 ? 10.606 -144.790 -23.657 1.00 45.64 ? 279 TRP A CB 1 ATOM 2184 C CG . TRP A 1 279 ? 9.883 -144.493 -22.353 1.00 44.81 ? 279 TRP A CG 1 ATOM 2185 C CD1 . TRP A 1 279 ? 9.797 -145.318 -21.274 1.00 45.01 ? 279 TRP A CD1 1 ATOM 2186 C CD2 . TRP A 1 279 ? 9.173 -143.294 -21.992 1.00 43.51 ? 279 TRP A CD2 1 ATOM 2187 N NE1 . TRP A 1 279 ? 9.078 -144.722 -20.267 1.00 44.48 ? 279 TRP A NE1 1 ATOM 2188 C CE2 . TRP A 1 279 ? 8.680 -143.480 -20.679 1.00 43.32 ? 279 TRP A CE2 1 ATOM 2189 C CE3 . TRP A 1 279 ? 8.904 -142.088 -22.645 1.00 42.96 ? 279 TRP A CE3 1 ATOM 2190 C CZ2 . TRP A 1 279 ? 7.933 -142.505 -20.002 1.00 42.14 ? 279 TRP A CZ2 1 ATOM 2191 C CZ3 . TRP A 1 279 ? 8.149 -141.115 -21.966 1.00 43.03 ? 279 TRP A CZ3 1 ATOM 2192 C CH2 . TRP A 1 279 ? 7.677 -141.336 -20.657 1.00 41.50 ? 279 TRP A CH2 1 ATOM 2193 N N . GLY A 1 280 ? 13.029 -145.053 -21.881 1.00 45.04 ? 280 GLY A N 1 ATOM 2194 C CA . GLY A 1 280 ? 13.674 -145.016 -20.574 1.00 44.77 ? 280 GLY A CA 1 ATOM 2195 C C . GLY A 1 280 ? 15.176 -144.909 -20.694 1.00 44.56 ? 280 GLY A C 1 ATOM 2196 O O . GLY A 1 280 ? 15.915 -145.624 -20.008 1.00 44.56 ? 280 GLY A O 1 ATOM 2197 N N . SER A 1 281 ? 15.627 -144.021 -21.575 1.00 44.33 ? 281 SER A N 1 ATOM 2198 C CA . SER A 1 281 ? 17.044 -143.932 -21.904 1.00 44.28 ? 281 SER A CA 1 ATOM 2199 C C . SER A 1 281 ? 17.835 -143.366 -20.740 1.00 44.15 ? 281 SER A C 1 ATOM 2200 O O . SER A 1 281 ? 17.251 -142.711 -19.862 1.00 44.29 ? 281 SER A O 1 ATOM 2201 C CB . SER A 1 281 ? 17.265 -143.102 -23.172 1.00 44.20 ? 281 SER A CB 1 ATOM 2202 O OG . SER A 1 281 ? 16.731 -141.803 -23.027 1.00 44.97 ? 281 SER A OG 1 ATOM 2203 N N . LEU A 1 282 ? 19.147 -143.626 -20.728 1.00 43.72 ? 282 LEU A N 1 ATOM 2204 C CA . LEU A 1 282 ? 20.051 -143.041 -19.728 1.00 43.46 ? 282 LEU A CA 1 ATOM 2205 C C . LEU A 1 282 ? 19.794 -141.540 -19.537 1.00 43.47 ? 282 LEU A C 1 ATOM 2206 O O . LEU A 1 282 ? 19.858 -141.017 -18.421 1.00 43.30 ? 282 LEU A O 1 ATOM 2207 C CB . LEU A 1 282 ? 21.515 -143.292 -20.112 1.00 43.26 ? 282 LEU A CB 1 ATOM 2208 C CG . LEU A 1 282 ? 22.656 -142.536 -19.416 1.00 42.58 ? 282 LEU A CG 1 ATOM 2209 C CD1 . LEU A 1 282 ? 22.557 -142.569 -17.907 1.00 42.31 ? 282 LEU A CD1 1 ATOM 2210 C CD2 . LEU A 1 282 ? 23.986 -143.101 -19.851 1.00 42.27 ? 282 LEU A CD2 1 ATOM 2211 N N . HIS A 1 283 ? 19.474 -140.874 -20.639 1.00 43.50 ? 283 HIS A N 1 ATOM 2212 C CA . HIS A 1 283 ? 19.300 -139.438 -20.678 1.00 43.65 ? 283 HIS A CA 1 ATOM 2213 C C . HIS A 1 283 ? 17.893 -139.001 -20.320 1.00 43.58 ? 283 HIS A C 1 ATOM 2214 O O . HIS A 1 283 ? 17.704 -137.943 -19.714 1.00 43.24 ? 283 HIS A O 1 ATOM 2215 C CB . HIS A 1 283 ? 19.680 -138.961 -22.057 1.00 43.84 ? 283 HIS A CB 1 ATOM 2216 C CG . HIS A 1 283 ? 20.919 -139.614 -22.565 1.00 44.87 ? 283 HIS A CG 1 ATOM 2217 N ND1 . HIS A 1 283 ? 22.172 -139.251 -22.125 1.00 46.41 ? 283 HIS A ND1 1 ATOM 2218 C CD2 . HIS A 1 283 ? 21.101 -140.639 -23.431 1.00 45.58 ? 283 HIS A CD2 1 ATOM 2219 C CE1 . HIS A 1 283 ? 23.077 -140.006 -22.720 1.00 47.20 ? 283 HIS A CE1 1 ATOM 2220 N NE2 . HIS A 1 283 ? 22.453 -140.856 -23.518 1.00 47.02 ? 283 HIS A NE2 1 ATOM 2221 N N . HIS A 1 284 ? 16.905 -139.815 -20.681 1.00 43.73 ? 284 HIS A N 1 ATOM 2222 C CA . HIS A 1 284 ? 15.540 -139.514 -20.284 1.00 43.97 ? 284 HIS A CA 1 ATOM 2223 C C . HIS A 1 284 ? 15.461 -139.529 -18.772 1.00 44.32 ? 284 HIS A C 1 ATOM 2224 O O . HIS A 1 284 ? 15.018 -138.558 -18.174 1.00 44.26 ? 284 HIS A O 1 ATOM 2225 C CB . HIS A 1 284 ? 14.507 -140.462 -20.911 1.00 43.70 ? 284 HIS A CB 1 ATOM 2226 C CG . HIS A 1 284 ? 13.087 -140.128 -20.546 1.00 43.30 ? 284 HIS A CG 1 ATOM 2227 N ND1 . HIS A 1 284 ? 12.096 -141.082 -20.444 1.00 42.84 ? 284 HIS A ND1 1 ATOM 2228 C CD2 . HIS A 1 284 ? 12.500 -138.947 -20.233 1.00 42.77 ? 284 HIS A CD2 1 ATOM 2229 C CE1 . HIS A 1 284 ? 10.962 -140.503 -20.094 1.00 42.44 ? 284 HIS A CE1 1 ATOM 2230 N NE2 . HIS A 1 284 ? 11.178 -139.208 -19.960 1.00 42.08 ? 284 HIS A NE2 1 ATOM 2231 N N . ILE A 1 285 ? 15.934 -140.617 -18.168 1.00 45.09 ? 285 ILE A N 1 ATOM 2232 C CA . ILE A 1 285 ? 15.955 -140.764 -16.711 1.00 45.87 ? 285 ILE A CA 1 ATOM 2233 C C . ILE A 1 285 ? 16.544 -139.528 -16.023 1.00 46.71 ? 285 ILE A C 1 ATOM 2234 O O . ILE A 1 285 ? 15.963 -139.009 -15.062 1.00 46.85 ? 285 ILE A O 1 ATOM 2235 C CB . ILE A 1 285 ? 16.725 -142.030 -16.279 1.00 45.57 ? 285 ILE A CB 1 ATOM 2236 C CG1 . ILE A 1 285 ? 16.073 -143.275 -16.883 1.00 45.52 ? 285 ILE A CG1 1 ATOM 2237 C CG2 . ILE A 1 285 ? 16.764 -142.144 -14.762 1.00 45.34 ? 285 ILE A CG2 1 ATOM 2238 C CD1 . ILE A 1 285 ? 16.911 -144.537 -16.761 1.00 45.19 ? 285 ILE A CD1 1 ATOM 2239 N N . LEU A 1 286 ? 17.675 -139.051 -16.538 1.00 47.65 ? 286 LEU A N 1 ATOM 2240 C CA . LEU A 1 286 ? 18.383 -137.931 -15.935 1.00 48.64 ? 286 LEU A CA 1 ATOM 2241 C C . LEU A 1 286 ? 17.709 -136.588 -16.188 1.00 49.44 ? 286 LEU A C 1 ATOM 2242 O O . LEU A 1 286 ? 17.613 -135.766 -15.275 1.00 49.54 ? 286 LEU A O 1 ATOM 2243 C CB . LEU A 1 286 ? 19.847 -137.890 -16.392 1.00 48.67 ? 286 LEU A CB 1 ATOM 2244 C CG . LEU A 1 286 ? 20.875 -138.847 -15.767 1.00 48.97 ? 286 LEU A CG 1 ATOM 2245 C CD1 . LEU A 1 286 ? 22.284 -138.326 -16.039 1.00 49.39 ? 286 LEU A CD1 1 ATOM 2246 C CD2 . LEU A 1 286 ? 20.672 -139.042 -14.260 1.00 48.96 ? 286 LEU A CD2 1 ATOM 2247 N N . ASP A 1 287 ? 17.250 -136.361 -17.418 1.00 50.44 ? 287 ASP A N 1 ATOM 2248 C CA . ASP A 1 287 ? 16.613 -135.085 -17.765 1.00 51.23 ? 287 ASP A CA 1 ATOM 2249 C C . ASP A 1 287 ? 15.295 -134.885 -17.042 1.00 51.72 ? 287 ASP A C 1 ATOM 2250 O O . ASP A 1 287 ? 14.962 -133.761 -16.658 1.00 51.68 ? 287 ASP A O 1 ATOM 2251 C CB . ASP A 1 287 ? 16.379 -134.980 -19.264 1.00 51.35 ? 287 ASP A CB 1 ATOM 2252 C CG . ASP A 1 287 ? 17.654 -134.944 -20.039 1.00 51.80 ? 287 ASP A CG 1 ATOM 2253 O OD1 . ASP A 1 287 ? 18.630 -134.346 -19.544 1.00 52.71 ? 287 ASP A OD1 1 ATOM 2254 O OD2 . ASP A 1 287 ? 17.679 -135.517 -21.146 1.00 52.87 ? 287 ASP A OD2 1 ATOM 2255 N N . ALA A 1 288 ? 14.552 -135.982 -16.873 1.00 52.36 ? 288 ALA A N 1 ATOM 2256 C CA . ALA A 1 288 ? 13.275 -135.967 -16.176 1.00 53.01 ? 288 ALA A CA 1 ATOM 2257 C C . ALA A 1 288 ? 13.496 -135.598 -14.717 1.00 53.76 ? 288 ALA A C 1 ATOM 2258 O O . ALA A 1 288 ? 12.670 -134.907 -14.117 1.00 53.94 ? 288 ALA A O 1 ATOM 2259 C CB . ALA A 1 288 ? 12.590 -137.309 -16.292 1.00 52.78 ? 288 ALA A CB 1 ATOM 2260 N N . GLN A 1 289 ? 14.622 -136.049 -14.161 1.00 54.55 ? 289 GLN A N 1 ATOM 2261 C CA . GLN A 1 289 ? 15.021 -135.701 -12.794 1.00 55.34 ? 289 GLN A CA 1 ATOM 2262 C C . GLN A 1 289 ? 15.262 -134.201 -12.621 1.00 55.67 ? 289 GLN A C 1 ATOM 2263 O O . GLN A 1 289 ? 14.962 -133.632 -11.570 1.00 55.68 ? 289 GLN A O 1 ATOM 2264 C CB . GLN A 1 289 ? 16.264 -136.491 -12.371 1.00 55.44 ? 289 GLN A CB 1 ATOM 2265 C CG . GLN A 1 289 ? 15.969 -137.932 -11.952 1.00 56.08 ? 289 GLN A CG 1 ATOM 2266 C CD . GLN A 1 289 ? 17.221 -138.758 -11.664 1.00 56.15 ? 289 GLN A CD 1 ATOM 2267 O OE1 . GLN A 1 289 ? 18.353 -138.265 -11.740 1.00 56.43 ? 289 GLN A OE1 1 ATOM 2268 N NE2 . GLN A 1 289 ? 17.014 -140.030 -11.332 1.00 56.10 ? 289 GLN A NE2 1 ATOM 2269 N N . LYS A 1 290 ? 15.793 -133.569 -13.663 1.00 56.16 ? 290 LYS A N 1 ATOM 2270 C CA . LYS A 1 290 ? 16.028 -132.130 -13.661 1.00 56.58 ? 290 LYS A CA 1 ATOM 2271 C C . LYS A 1 290 ? 14.714 -131.347 -13.865 1.00 56.92 ? 290 LYS A C 1 ATOM 2272 O O . LYS A 1 290 ? 14.693 -130.117 -13.779 1.00 56.81 ? 290 LYS A O 1 ATOM 2273 C CB . LYS A 1 290 ? 17.067 -131.763 -14.731 1.00 56.54 ? 290 LYS A CB 1 ATOM 2274 C CG . LYS A 1 290 ? 18.320 -132.654 -14.767 1.00 56.79 ? 290 LYS A CG 1 ATOM 2275 C CD . LYS A 1 290 ? 19.326 -132.172 -15.830 1.00 58.20 ? 290 LYS A CD 1 ATOM 2276 C CE . LYS A 1 290 ? 20.557 -133.092 -15.982 1.00 58.77 ? 290 LYS A CE 1 ATOM 2277 N NZ . LYS A 1 290 ? 21.612 -132.531 -16.901 1.00 58.14 ? 290 LYS A NZ 1 ATOM 2278 N N . MET A 1 291 ? 13.621 -132.072 -14.105 1.00 57.54 ? 291 MET A N 1 ATOM 2279 C CA . MET A 1 291 ? 12.323 -131.479 -14.457 1.00 58.21 ? 291 MET A CA 1 ATOM 2280 C C . MET A 1 291 ? 11.256 -131.569 -13.375 1.00 58.36 ? 291 MET A C 1 ATOM 2281 O O . MET A 1 291 ? 10.281 -130.815 -13.401 1.00 58.38 ? 291 MET A O 1 ATOM 2282 C CB . MET A 1 291 ? 11.759 -132.146 -15.710 1.00 58.40 ? 291 MET A CB 1 ATOM 2283 C CG . MET A 1 291 ? 12.289 -131.600 -17.013 1.00 59.21 ? 291 MET A CG 1 ATOM 2284 S SD . MET A 1 291 ? 11.406 -132.296 -18.419 1.00 61.15 ? 291 MET A SD 1 ATOM 2285 C CE . MET A 1 291 ? 9.797 -131.521 -18.224 1.00 59.70 ? 291 MET A CE 1 ATOM 2286 N N . VAL A 1 292 ? 11.421 -132.506 -12.448 1.00 58.65 ? 292 VAL A N 1 ATOM 2287 C CA . VAL A 1 292 ? 10.430 -132.730 -11.399 1.00 59.02 ? 292 VAL A CA 1 ATOM 2288 C C . VAL A 1 292 ? 9.866 -131.409 -10.893 1.00 59.11 ? 292 VAL A C 1 ATOM 2289 O O . VAL A 1 292 ? 10.605 -130.452 -10.643 1.00 59.14 ? 292 VAL A O 1 ATOM 2290 C CB . VAL A 1 292 ? 11.003 -133.593 -10.234 1.00 59.07 ? 292 VAL A CB 1 ATOM 2291 C CG1 . VAL A 1 292 ? 10.230 -133.376 -8.923 1.00 59.52 ? 292 VAL A CG1 1 ATOM 2292 C CG2 . VAL A 1 292 ? 10.985 -135.070 -10.616 1.00 59.17 ? 292 VAL A CG2 1 ATOM 2293 N N . TRP A 1 293 ? 8.546 -131.356 -10.781 1.00 59.27 ? 293 TRP A N 1 ATOM 2294 C CA . TRP A 1 293 ? 7.885 -130.183 -10.238 1.00 59.60 ? 293 TRP A CA 1 ATOM 2295 C C . TRP A 1 293 ? 6.656 -130.569 -9.439 1.00 59.84 ? 293 TRP A C 1 ATOM 2296 O O . TRP A 1 293 ? 6.123 -131.668 -9.599 1.00 59.83 ? 293 TRP A O 1 ATOM 2297 C CB . TRP A 1 293 ? 7.538 -129.187 -11.347 1.00 59.70 ? 293 TRP A CB 1 ATOM 2298 C CG . TRP A 1 293 ? 6.577 -129.697 -12.394 1.00 59.29 ? 293 TRP A CG 1 ATOM 2299 C CD1 . TRP A 1 293 ? 6.722 -130.808 -13.188 1.00 58.90 ? 293 TRP A CD1 1 ATOM 2300 C CD2 . TRP A 1 293 ? 5.344 -129.087 -12.780 1.00 58.60 ? 293 TRP A CD2 1 ATOM 2301 N NE1 . TRP A 1 293 ? 5.647 -130.929 -14.030 1.00 58.33 ? 293 TRP A NE1 1 ATOM 2302 C CE2 . TRP A 1 293 ? 4.786 -129.886 -13.805 1.00 58.63 ? 293 TRP A CE2 1 ATOM 2303 C CE3 . TRP A 1 293 ? 4.653 -127.944 -12.359 1.00 58.26 ? 293 TRP A CE3 1 ATOM 2304 C CZ2 . TRP A 1 293 ? 3.568 -129.577 -14.414 1.00 58.71 ? 293 TRP A CZ2 1 ATOM 2305 C CZ3 . TRP A 1 293 ? 3.441 -127.638 -12.963 1.00 58.56 ? 293 TRP A CZ3 1 ATOM 2306 C CH2 . TRP A 1 293 ? 2.911 -128.452 -13.980 1.00 58.71 ? 293 TRP A CH2 1 ATOM 2307 N N . ASN A 1 294 ? 6.214 -129.651 -8.586 1.00 60.20 ? 294 ASN A N 1 ATOM 2308 C CA . ASN A 1 294 ? 5.165 -129.929 -7.614 1.00 60.70 ? 294 ASN A CA 1 ATOM 2309 C C . ASN A 1 294 ? 3.760 -130.173 -8.195 1.00 60.82 ? 294 ASN A C 1 ATOM 2310 O O . ASN A 1 294 ? 2.870 -130.616 -7.468 1.00 61.11 ? 294 ASN A O 1 ATOM 2311 C CB . ASN A 1 294 ? 5.128 -128.824 -6.547 1.00 60.74 ? 294 ASN A CB 1 ATOM 2312 C CG . ASN A 1 294 ? 4.473 -127.531 -7.045 1.00 61.53 ? 294 ASN A CG 1 ATOM 2313 O OD1 . ASN A 1 294 ? 3.963 -127.451 -8.174 1.00 61.67 ? 294 ASN A OD1 1 ATOM 2314 N ND2 . ASN A 1 294 ? 4.481 -126.509 -6.191 1.00 62.20 ? 294 ASN A ND2 1 ATOM 2315 N N . HIS A 1 295 ? 3.569 -129.901 -9.488 1.00 60.93 ? 295 HIS A N 1 ATOM 2316 C CA . HIS A 1 295 ? 2.246 -129.987 -10.138 1.00 60.90 ? 295 HIS A CA 1 ATOM 2317 C C . HIS A 1 295 ? 1.239 -129.099 -9.397 1.00 60.77 ? 295 HIS A C 1 ATOM 2318 O O . HIS A 1 295 ? 0.129 -128.857 -9.866 1.00 60.67 ? 295 HIS A O 1 ATOM 2319 C CB . HIS A 1 295 ? 1.744 -131.441 -10.223 1.00 60.74 ? 295 HIS A CB 1 ATOM 2320 C CG . HIS A 1 295 ? 2.533 -132.311 -11.156 1.00 61.35 ? 295 HIS A CG 1 ATOM 2321 N ND1 . HIS A 1 295 ? 3.838 -132.685 -10.908 1.00 62.00 ? 295 HIS A ND1 1 ATOM 2322 C CD2 . HIS A 1 295 ? 2.191 -132.903 -12.327 1.00 61.93 ? 295 HIS A CD2 1 ATOM 2323 C CE1 . HIS A 1 295 ? 4.271 -133.454 -11.893 1.00 61.92 ? 295 HIS A CE1 1 ATOM 2324 N NE2 . HIS A 1 295 ? 3.290 -133.603 -12.767 1.00 61.73 ? 295 HIS A NE2 1 ATOM 2325 N N . ILE B 2 1 ? -17.199 -110.264 -30.165 1.00 62.57 ? 1 ILE B N 1 ATOM 2326 C CA . ILE B 2 1 ? -16.092 -110.072 -31.143 1.00 62.64 ? 1 ILE B CA 1 ATOM 2327 C C . ILE B 2 1 ? -15.824 -111.337 -31.972 1.00 62.60 ? 1 ILE B C 1 ATOM 2328 O O . ILE B 2 1 ? -16.024 -112.463 -31.502 1.00 62.55 ? 1 ILE B O 1 ATOM 2329 C CB . ILE B 2 1 ? -14.837 -109.618 -30.427 1.00 62.88 ? 1 ILE B CB 1 ATOM 2330 N N . GLN B 2 2 ? -15.355 -111.125 -33.199 1.00 62.46 ? 2 GLN B N 1 ATOM 2331 C CA . GLN B 2 2 ? -15.237 -112.174 -34.215 1.00 62.31 ? 2 GLN B CA 1 ATOM 2332 C C . GLN B 2 2 ? -14.704 -113.526 -33.732 1.00 61.81 ? 2 GLN B C 1 ATOM 2333 O O . GLN B 2 2 ? -15.373 -114.537 -33.929 1.00 62.03 ? 2 GLN B O 1 ATOM 2334 C CB . GLN B 2 2 ? -14.392 -111.681 -35.400 1.00 62.74 ? 2 GLN B CB 1 ATOM 2335 C CG . GLN B 2 2 ? -14.688 -112.368 -36.725 1.00 62.88 ? 2 GLN B CG 1 ATOM 2336 C CD . GLN B 2 2 ? -16.033 -111.961 -37.281 1.00 63.65 ? 2 GLN B CD 1 ATOM 2337 O OE1 . GLN B 2 2 ? -16.258 -110.797 -37.624 1.00 63.97 ? 2 GLN B OE1 1 ATOM 2338 N NE2 . GLN B 2 2 ? -16.943 -112.919 -37.365 1.00 63.66 ? 2 GLN B NE2 1 ATOM 2339 N N . LYS B 2 3 ? -13.513 -113.559 -33.127 1.00 60.88 ? 3 LYS B N 1 ATOM 2340 C CA . LYS B 2 3 ? -12.873 -114.846 -32.802 1.00 60.03 ? 3 LYS B CA 1 ATOM 2341 C C . LYS B 2 3 ? -12.129 -114.919 -31.462 1.00 59.16 ? 3 LYS B C 1 ATOM 2342 O O . LYS B 2 3 ? -11.663 -113.907 -30.931 1.00 59.10 ? 3 LYS B O 1 ATOM 2343 C CB . LYS B 2 3 ? -11.957 -115.304 -33.946 1.00 60.25 ? 3 LYS B CB 1 ATOM 2344 C CG . LYS B 2 3 ? -12.700 -115.857 -35.151 1.00 60.86 ? 3 LYS B CG 1 ATOM 2345 C CD . LYS B 2 3 ? -11.764 -116.210 -36.291 1.00 62.10 ? 3 LYS B CD 1 ATOM 2346 C CE . LYS B 2 3 ? -12.573 -116.490 -37.548 1.00 63.17 ? 3 LYS B CE 1 ATOM 2347 N NZ . LYS B 2 3 ? -11.798 -117.248 -38.568 1.00 64.63 ? 3 LYS B NZ 1 ATOM 2348 N N . THR B 2 4 ? -12.013 -116.142 -30.946 1.00 58.00 ? 4 THR B N 1 ATOM 2349 C CA . THR B 2 4 ? -11.425 -116.415 -29.637 1.00 56.83 ? 4 THR B CA 1 ATOM 2350 C C . THR B 2 4 ? -9.991 -116.921 -29.761 1.00 55.80 ? 4 THR B C 1 ATOM 2351 O O . THR B 2 4 ? -9.717 -117.828 -30.547 1.00 55.62 ? 4 THR B O 1 ATOM 2352 C CB . THR B 2 4 ? -12.256 -117.459 -28.881 1.00 56.90 ? 4 THR B CB 1 ATOM 2353 O OG1 . THR B 2 4 ? -13.574 -117.504 -29.441 1.00 57.24 ? 4 THR B OG1 1 ATOM 2354 C CG2 . THR B 2 4 ? -12.347 -117.113 -27.397 1.00 56.93 ? 4 THR B CG2 1 ATOM 2355 N N . PRO B 2 5 ? -9.072 -116.334 -28.980 1.00 54.89 ? 5 PRO B N 1 ATOM 2356 C CA . PRO B 2 5 ? -7.660 -116.696 -29.010 1.00 54.41 ? 5 PRO B CA 1 ATOM 2357 C C . PRO B 2 5 ? -7.408 -118.151 -28.637 1.00 54.02 ? 5 PRO B C 1 ATOM 2358 O O . PRO B 2 5 ? -7.992 -118.654 -27.678 1.00 54.14 ? 5 PRO B O 1 ATOM 2359 C CB . PRO B 2 5 ? -7.047 -115.795 -27.940 1.00 54.32 ? 5 PRO B CB 1 ATOM 2360 C CG . PRO B 2 5 ? -7.991 -114.676 -27.791 1.00 54.33 ? 5 PRO B CG 1 ATOM 2361 C CD . PRO B 2 5 ? -9.334 -115.240 -28.031 1.00 54.73 ? 5 PRO B CD 1 ATOM 2362 N N . GLN B 2 6 ? -6.564 -118.821 -29.413 1.00 53.34 ? 6 GLN B N 1 ATOM 2363 C CA . GLN B 2 6 ? -6.005 -120.089 -29.002 1.00 52.71 ? 6 GLN B CA 1 ATOM 2364 C C . GLN B 2 6 ? -4.674 -119.728 -28.332 1.00 52.03 ? 6 GLN B C 1 ATOM 2365 O O . GLN B 2 6 ? -3.875 -118.962 -28.894 1.00 51.98 ? 6 GLN B O 1 ATOM 2366 C CB . GLN B 2 6 ? -5.811 -121.017 -30.205 1.00 52.85 ? 6 GLN B CB 1 ATOM 2367 C CG . GLN B 2 6 ? -6.084 -122.510 -29.921 1.00 54.34 ? 6 GLN B CG 1 ATOM 2368 C CD . GLN B 2 6 ? -5.310 -123.482 -30.844 1.00 56.10 ? 6 GLN B CD 1 ATOM 2369 O OE1 . GLN B 2 6 ? -5.113 -124.658 -30.505 1.00 55.96 ? 6 GLN B OE1 1 ATOM 2370 N NE2 . GLN B 2 6 ? -4.872 -122.989 -32.007 1.00 57.10 ? 6 GLN B NE2 1 ATOM 2371 N N . ILE B 2 7 ? -4.464 -120.241 -27.117 1.00 51.01 ? 7 ILE B N 1 ATOM 2372 C CA . ILE B 2 7 ? -3.256 -119.948 -26.339 1.00 49.90 ? 7 ILE B CA 1 ATOM 2373 C C . ILE B 2 7 ? -2.412 -121.201 -26.123 1.00 49.29 ? 7 ILE B C 1 ATOM 2374 O O . ILE B 2 7 ? -2.930 -122.258 -25.759 1.00 49.27 ? 7 ILE B O 1 ATOM 2375 C CB . ILE B 2 7 ? -3.584 -119.324 -24.976 1.00 49.81 ? 7 ILE B CB 1 ATOM 2376 C CG1 . ILE B 2 7 ? -4.509 -118.120 -25.142 1.00 49.80 ? 7 ILE B CG1 1 ATOM 2377 C CG2 . ILE B 2 7 ? -2.314 -118.882 -24.270 1.00 49.88 ? 7 ILE B CG2 1 ATOM 2378 C CD1 . ILE B 2 7 ? -5.218 -117.707 -23.858 1.00 49.57 ? 7 ILE B CD1 1 ATOM 2379 N N . GLN B 2 8 ? -1.110 -121.063 -26.364 1.00 48.47 ? 8 GLN B N 1 ATOM 2380 C CA . GLN B 2 8 ? -0.141 -122.133 -26.169 1.00 47.65 ? 8 GLN B CA 1 ATOM 2381 C C . GLN B 2 8 ? 1.092 -121.592 -25.447 1.00 46.97 ? 8 GLN B C 1 ATOM 2382 O O . GLN B 2 8 ? 1.698 -120.610 -25.885 1.00 46.84 ? 8 GLN B O 1 ATOM 2383 C CB . GLN B 2 8 ? 0.246 -122.755 -27.510 1.00 47.71 ? 8 GLN B CB 1 ATOM 2384 C CG . GLN B 2 8 ? -0.867 -123.572 -28.152 1.00 48.54 ? 8 GLN B CG 1 ATOM 2385 C CD . GLN B 2 8 ? -0.646 -123.831 -29.637 1.00 49.78 ? 8 GLN B CD 1 ATOM 2386 O OE1 . GLN B 2 8 ? -0.481 -122.899 -30.437 1.00 50.13 ? 8 GLN B OE1 1 ATOM 2387 N NE2 . GLN B 2 8 ? -0.660 -125.106 -30.016 1.00 50.04 ? 8 GLN B NE2 1 ATOM 2388 N N . VAL B 2 9 ? 1.439 -122.237 -24.330 1.00 46.15 ? 9 VAL B N 1 ATOM 2389 C CA . VAL B 2 9 ? 2.564 -121.839 -23.475 1.00 45.01 ? 9 VAL B CA 1 ATOM 2390 C C . VAL B 2 9 ? 3.609 -122.944 -23.416 1.00 44.71 ? 9 VAL B C 1 ATOM 2391 O O . VAL B 2 9 ? 3.327 -124.051 -22.940 1.00 44.71 ? 9 VAL B O 1 ATOM 2392 C CB . VAL B 2 9 ? 2.108 -121.570 -22.042 1.00 44.72 ? 9 VAL B CB 1 ATOM 2393 C CG1 . VAL B 2 9 ? 3.187 -120.842 -21.295 1.00 44.35 ? 9 VAL B CG1 1 ATOM 2394 C CG2 . VAL B 2 9 ? 0.822 -120.775 -22.032 1.00 44.25 ? 9 VAL B CG2 1 ATOM 2395 N N . TYR B 2 10 ? 4.816 -122.633 -23.879 1.00 44.15 ? 10 TYR B N 1 ATOM 2396 C CA . TYR B 2 10 ? 5.887 -123.622 -23.998 1.00 43.79 ? 10 TYR B CA 1 ATOM 2397 C C . TYR B 2 10 ? 7.254 -122.950 -23.827 1.00 43.91 ? 10 TYR B C 1 ATOM 2398 O O . TYR B 2 10 ? 7.350 -121.723 -23.887 1.00 44.16 ? 10 TYR B O 1 ATOM 2399 C CB . TYR B 2 10 ? 5.782 -124.329 -25.349 1.00 43.45 ? 10 TYR B CB 1 ATOM 2400 C CG . TYR B 2 10 ? 5.760 -123.379 -26.519 1.00 42.70 ? 10 TYR B CG 1 ATOM 2401 C CD1 . TYR B 2 10 ? 4.634 -122.612 -26.801 1.00 41.59 ? 10 TYR B CD1 1 ATOM 2402 C CD2 . TYR B 2 10 ? 6.870 -123.238 -27.339 1.00 42.53 ? 10 TYR B CD2 1 ATOM 2403 C CE1 . TYR B 2 10 ? 4.614 -121.739 -27.868 1.00 41.14 ? 10 TYR B CE1 1 ATOM 2404 C CE2 . TYR B 2 10 ? 6.861 -122.366 -28.406 1.00 42.02 ? 10 TYR B CE2 1 ATOM 2405 C CZ . TYR B 2 10 ? 5.730 -121.621 -28.669 1.00 41.54 ? 10 TYR B CZ 1 ATOM 2406 O OH . TYR B 2 10 ? 5.731 -120.756 -29.739 1.00 41.74 ? 10 TYR B OH 1 ATOM 2407 N N . SER B 2 11 ? 8.304 -123.738 -23.602 1.00 43.81 ? 11 SER B N 1 ATOM 2408 C CA . SER B 2 11 ? 9.639 -123.168 -23.372 1.00 43.79 ? 11 SER B CA 1 ATOM 2409 C C . SER B 2 11 ? 10.596 -123.373 -24.548 1.00 43.49 ? 11 SER B C 1 ATOM 2410 O O . SER B 2 11 ? 10.445 -124.310 -25.331 1.00 43.38 ? 11 SER B O 1 ATOM 2411 C CB . SER B 2 11 ? 10.251 -123.697 -22.066 1.00 44.00 ? 11 SER B CB 1 ATOM 2412 O OG . SER B 2 11 ? 10.207 -125.116 -22.003 1.00 44.77 ? 11 SER B OG 1 ATOM 2413 N N . ARG B 2 12 ? 11.575 -122.480 -24.663 1.00 43.25 ? 12 ARG B N 1 ATOM 2414 C CA . ARG B 2 12 ? 12.532 -122.511 -25.759 1.00 43.08 ? 12 ARG B CA 1 ATOM 2415 C C . ARG B 2 12 ? 13.368 -123.767 -25.698 1.00 42.92 ? 12 ARG B C 1 ATOM 2416 O O . ARG B 2 12 ? 13.528 -124.457 -26.704 1.00 42.93 ? 12 ARG B O 1 ATOM 2417 C CB . ARG B 2 12 ? 13.438 -121.274 -25.720 1.00 43.14 ? 12 ARG B CB 1 ATOM 2418 C CG . ARG B 2 12 ? 14.564 -121.261 -26.762 1.00 43.89 ? 12 ARG B CG 1 ATOM 2419 C CD . ARG B 2 12 ? 14.043 -121.510 -28.170 1.00 43.98 ? 12 ARG B CD 1 ATOM 2420 N NE . ARG B 2 12 ? 15.094 -121.596 -29.179 1.00 43.92 ? 12 ARG B NE 1 ATOM 2421 C CZ . ARG B 2 12 ? 15.758 -122.705 -29.493 1.00 44.56 ? 12 ARG B CZ 1 ATOM 2422 N NH1 . ARG B 2 12 ? 15.512 -123.854 -28.864 1.00 44.38 ? 12 ARG B NH1 1 ATOM 2423 N NH2 . ARG B 2 12 ? 16.680 -122.661 -30.446 1.00 45.05 ? 12 ARG B NH2 1 ATOM 2424 N N . HIS B 2 13 ? 13.892 -124.049 -24.507 1.00 42.80 ? 13 HIS B N 1 ATOM 2425 C CA . HIS B 2 13 ? 14.761 -125.194 -24.279 1.00 42.63 ? 13 HIS B CA 1 ATOM 2426 C C . HIS B 2 13 ? 14.102 -126.176 -23.322 1.00 42.98 ? 13 HIS B C 1 ATOM 2427 O O . HIS B 2 13 ? 13.133 -125.810 -22.646 1.00 42.93 ? 13 HIS B O 1 ATOM 2428 C CB . HIS B 2 13 ? 16.089 -124.734 -23.687 1.00 42.39 ? 13 HIS B CB 1 ATOM 2429 C CG . HIS B 2 13 ? 16.768 -123.670 -24.482 1.00 40.93 ? 13 HIS B CG 1 ATOM 2430 N ND1 . HIS B 2 13 ? 17.384 -123.926 -25.685 1.00 39.53 ? 13 HIS B ND1 1 ATOM 2431 C CD2 . HIS B 2 13 ? 16.936 -122.350 -24.240 1.00 39.68 ? 13 HIS B CD2 1 ATOM 2432 C CE1 . HIS B 2 13 ? 17.902 -122.805 -26.153 1.00 40.17 ? 13 HIS B CE1 1 ATOM 2433 N NE2 . HIS B 2 13 ? 17.643 -121.834 -25.295 1.00 39.52 ? 13 HIS B NE2 1 ATOM 2434 N N . PRO B 2 14 ? 14.625 -127.424 -23.256 1.00 43.24 ? 14 PRO B N 1 ATOM 2435 C CA . PRO B 2 14 ? 14.160 -128.376 -22.251 1.00 43.54 ? 14 PRO B CA 1 ATOM 2436 C C . PRO B 2 14 ? 14.374 -127.769 -20.870 1.00 44.20 ? 14 PRO B C 1 ATOM 2437 O O . PRO B 2 14 ? 15.423 -127.157 -20.623 1.00 44.30 ? 14 PRO B O 1 ATOM 2438 C CB . PRO B 2 14 ? 15.086 -129.575 -22.429 1.00 43.43 ? 14 PRO B CB 1 ATOM 2439 C CG . PRO B 2 14 ? 15.751 -129.392 -23.724 1.00 43.30 ? 14 PRO B CG 1 ATOM 2440 C CD . PRO B 2 14 ? 15.743 -127.955 -24.054 1.00 43.09 ? 14 PRO B CD 1 ATOM 2441 N N . PRO B 2 15 ? 13.391 -127.922 -19.970 1.00 44.76 ? 15 PRO B N 1 ATOM 2442 C CA . PRO B 2 15 ? 13.468 -127.247 -18.675 1.00 45.31 ? 15 PRO B CA 1 ATOM 2443 C C . PRO B 2 15 ? 14.289 -128.021 -17.647 1.00 45.87 ? 15 PRO B C 1 ATOM 2444 O O . PRO B 2 15 ? 13.965 -129.160 -17.331 1.00 46.07 ? 15 PRO B O 1 ATOM 2445 C CB . PRO B 2 15 ? 12.001 -127.162 -18.231 1.00 45.16 ? 15 PRO B CB 1 ATOM 2446 C CG . PRO B 2 15 ? 11.222 -128.061 -19.182 1.00 45.15 ? 15 PRO B CG 1 ATOM 2447 C CD . PRO B 2 15 ? 12.194 -128.768 -20.073 1.00 44.68 ? 15 PRO B CD 1 ATOM 2448 N N . GLU B 2 16 ? 15.359 -127.410 -17.156 1.00 46.43 ? 16 GLU B N 1 ATOM 2449 C CA . GLU B 2 16 ? 16.100 -127.947 -16.032 1.00 47.11 ? 16 GLU B CA 1 ATOM 2450 C C . GLU B 2 16 ? 15.872 -127.009 -14.861 1.00 47.42 ? 16 GLU B C 1 ATOM 2451 O O . GLU B 2 16 ? 16.110 -125.800 -14.969 1.00 47.58 ? 16 GLU B O 1 ATOM 2452 C CB . GLU B 2 16 ? 17.583 -128.040 -16.358 1.00 47.20 ? 16 GLU B CB 1 ATOM 2453 C CG . GLU B 2 16 ? 17.917 -129.079 -17.418 1.00 49.38 ? 16 GLU B CG 1 ATOM 2454 C CD . GLU B 2 16 ? 19.395 -129.079 -17.824 1.00 51.89 ? 16 GLU B CD 1 ATOM 2455 O OE1 . GLU B 2 16 ? 20.273 -129.292 -16.947 1.00 52.96 ? 16 GLU B OE1 1 ATOM 2456 O OE2 . GLU B 2 16 ? 19.671 -128.878 -19.032 1.00 52.06 ? 16 GLU B OE2 1 ATOM 2457 N N . ASN B 2 17 ? 15.393 -127.558 -13.749 1.00 47.71 ? 17 ASN B N 1 ATOM 2458 C CA . ASN B 2 17 ? 15.106 -126.756 -12.567 1.00 48.04 ? 17 ASN B CA 1 ATOM 2459 C C . ASN B 2 17 ? 16.275 -125.848 -12.164 1.00 48.41 ? 17 ASN B C 1 ATOM 2460 O O . ASN B 2 17 ? 17.432 -126.278 -12.117 1.00 48.75 ? 17 ASN B O 1 ATOM 2461 C CB . ASN B 2 17 ? 14.648 -127.642 -11.409 1.00 48.01 ? 17 ASN B CB 1 ATOM 2462 C CG . ASN B 2 17 ? 13.218 -128.133 -11.585 1.00 48.02 ? 17 ASN B CG 1 ATOM 2463 O OD1 . ASN B 2 17 ? 12.331 -127.366 -11.946 1.00 47.72 ? 17 ASN B OD1 1 ATOM 2464 N ND2 . ASN B 2 17 ? 12.991 -129.413 -11.325 1.00 48.20 ? 17 ASN B ND2 1 ATOM 2465 N N . GLY B 2 18 ? 15.963 -124.578 -11.924 1.00 48.51 ? 18 GLY B N 1 ATOM 2466 C CA . GLY B 2 18 ? 16.957 -123.585 -11.545 1.00 48.35 ? 18 GLY B CA 1 ATOM 2467 C C . GLY B 2 18 ? 17.992 -123.252 -12.606 1.00 48.25 ? 18 GLY B C 1 ATOM 2468 O O . GLY B 2 18 ? 19.022 -122.671 -12.281 1.00 48.76 ? 18 GLY B O 1 ATOM 2469 N N . LYS B 2 19 ? 17.743 -123.617 -13.861 1.00 47.81 ? 19 LYS B N 1 ATOM 2470 C CA . LYS B 2 19 ? 18.612 -123.181 -14.962 1.00 47.67 ? 19 LYS B CA 1 ATOM 2471 C C . LYS B 2 19 ? 17.840 -122.302 -15.943 1.00 47.22 ? 19 LYS B C 1 ATOM 2472 O O . LYS B 2 19 ? 16.772 -122.695 -16.400 1.00 47.26 ? 19 LYS B O 1 ATOM 2473 C CB . LYS B 2 19 ? 19.258 -124.375 -15.677 1.00 47.86 ? 19 LYS B CB 1 ATOM 2474 C CG . LYS B 2 19 ? 20.417 -125.008 -14.903 1.00 48.52 ? 19 LYS B CG 1 ATOM 2475 C CD . LYS B 2 19 ? 20.619 -126.472 -15.307 1.00 49.47 ? 19 LYS B CD 1 ATOM 2476 C CE . LYS B 2 19 ? 21.135 -127.319 -14.134 1.00 49.58 ? 19 LYS B CE 1 ATOM 2477 N NZ . LYS B 2 19 ? 20.595 -128.718 -14.138 1.00 48.84 ? 19 LYS B NZ 1 ATOM 2478 N N . PRO B 2 20 ? 18.387 -121.116 -16.278 1.00 46.85 ? 20 PRO B N 1 ATOM 2479 C CA . PRO B 2 20 ? 17.671 -120.092 -17.045 1.00 46.46 ? 20 PRO B CA 1 ATOM 2480 C C . PRO B 2 20 ? 17.280 -120.567 -18.436 1.00 45.87 ? 20 PRO B C 1 ATOM 2481 O O . PRO B 2 20 ? 18.087 -121.202 -19.120 1.00 45.87 ? 20 PRO B O 1 ATOM 2482 C CB . PRO B 2 20 ? 18.686 -118.943 -17.157 1.00 46.57 ? 20 PRO B CB 1 ATOM 2483 C CG . PRO B 2 20 ? 19.767 -119.259 -16.193 1.00 46.96 ? 20 PRO B CG 1 ATOM 2484 C CD . PRO B 2 20 ? 19.799 -120.749 -16.090 1.00 47.03 ? 20 PRO B CD 1 ATOM 2485 N N . ASN B 2 21 ? 16.051 -120.231 -18.829 1.00 45.17 ? 21 ASN B N 1 ATOM 2486 C CA . ASN B 2 21 ? 15.416 -120.666 -20.075 1.00 44.52 ? 21 ASN B CA 1 ATOM 2487 C C . ASN B 2 21 ? 14.645 -119.474 -20.668 1.00 43.97 ? 21 ASN B C 1 ATOM 2488 O O . ASN B 2 21 ? 14.802 -118.337 -20.203 1.00 43.92 ? 21 ASN B O 1 ATOM 2489 C CB . ASN B 2 21 ? 14.466 -121.840 -19.775 1.00 44.66 ? 21 ASN B CB 1 ATOM 2490 C CG . ASN B 2 21 ? 14.232 -122.759 -20.972 1.00 44.95 ? 21 ASN B CG 1 ATOM 2491 O OD1 . ASN B 2 21 ? 14.174 -122.321 -22.118 1.00 45.19 ? 21 ASN B OD1 1 ATOM 2492 N ND2 . ASN B 2 21 ? 14.071 -124.047 -20.695 1.00 45.80 ? 21 ASN B ND2 1 ATOM 2493 N N . ILE B 2 22 ? 13.837 -119.726 -21.699 1.00 43.29 ? 22 ILE B N 1 ATOM 2494 C CA . ILE B 2 22 ? 12.952 -118.712 -22.285 1.00 42.72 ? 22 ILE B CA 1 ATOM 2495 C C . ILE B 2 22 ? 11.563 -119.312 -22.400 1.00 42.49 ? 22 ILE B C 1 ATOM 2496 O O . ILE B 2 22 ? 11.399 -120.434 -22.889 1.00 42.57 ? 22 ILE B O 1 ATOM 2497 C CB . ILE B 2 22 ? 13.380 -118.254 -23.715 1.00 42.51 ? 22 ILE B CB 1 ATOM 2498 C CG1 . ILE B 2 22 ? 14.853 -117.850 -23.788 1.00 42.58 ? 22 ILE B CG1 1 ATOM 2499 C CG2 . ILE B 2 22 ? 12.515 -117.095 -24.177 1.00 42.51 ? 22 ILE B CG2 1 ATOM 2500 C CD1 . ILE B 2 22 ? 15.155 -116.449 -23.281 1.00 43.33 ? 22 ILE B CD1 1 ATOM 2501 N N . LEU B 2 23 ? 10.556 -118.569 -21.962 1.00 42.04 ? 23 LEU B N 1 ATOM 2502 C CA . LEU B 2 23 ? 9.197 -119.063 -22.046 1.00 41.62 ? 23 LEU B CA 1 ATOM 2503 C C . LEU B 2 23 ? 8.398 -118.353 -23.126 1.00 41.64 ? 23 LEU B C 1 ATOM 2504 O O . LEU B 2 23 ? 8.263 -117.128 -23.108 1.00 41.61 ? 23 LEU B O 1 ATOM 2505 C CB . LEU B 2 23 ? 8.502 -118.923 -20.705 1.00 41.52 ? 23 LEU B CB 1 ATOM 2506 C CG . LEU B 2 23 ? 7.218 -119.725 -20.587 1.00 41.31 ? 23 LEU B CG 1 ATOM 2507 C CD1 . LEU B 2 23 ? 7.520 -121.225 -20.652 1.00 41.04 ? 23 LEU B CD1 1 ATOM 2508 C CD2 . LEU B 2 23 ? 6.504 -119.345 -19.299 1.00 40.77 ? 23 LEU B CD2 1 ATOM 2509 N N . ASN B 2 24 ? 7.869 -119.140 -24.059 1.00 41.52 ? 24 ASN B N 1 ATOM 2510 C CA . ASN B 2 24 ? 7.045 -118.633 -25.145 1.00 41.34 ? 24 ASN B CA 1 ATOM 2511 C C . ASN B 2 24 ? 5.554 -118.718 -24.812 1.00 41.78 ? 24 ASN B C 1 ATOM 2512 O O . ASN B 2 24 ? 5.084 -119.711 -24.244 1.00 41.81 ? 24 ASN B O 1 ATOM 2513 C CB . ASN B 2 24 ? 7.331 -119.419 -26.423 1.00 40.89 ? 24 ASN B CB 1 ATOM 2514 C CG . ASN B 2 24 ? 8.781 -119.331 -26.862 1.00 40.62 ? 24 ASN B CG 1 ATOM 2515 O OD1 . ASN B 2 24 ? 9.458 -118.330 -26.637 1.00 40.22 ? 24 ASN B OD1 1 ATOM 2516 N ND2 . ASN B 2 24 ? 9.262 -120.382 -27.508 1.00 40.37 ? 24 ASN B ND2 1 ATOM 2517 N N . CYS B 2 25 ? 4.818 -117.664 -25.152 1.00 42.22 ? 25 CYS B N 1 ATOM 2518 C CA . CYS B 2 25 ? 3.362 -117.709 -25.158 1.00 42.79 ? 25 CYS B CA 1 ATOM 2519 C C . CYS B 2 25 ? 2.844 -117.248 -26.516 1.00 42.68 ? 25 CYS B C 1 ATOM 2520 O O . CYS B 2 25 ? 2.895 -116.057 -26.831 1.00 42.55 ? 25 CYS B O 1 ATOM 2521 C CB . CYS B 2 25 ? 2.779 -116.843 -24.055 1.00 43.26 ? 25 CYS B CB 1 ATOM 2522 S SG . CYS B 2 25 ? 0.981 -116.808 -24.084 1.00 45.47 ? 25 CYS B SG 1 ATOM 2523 N N . TYR B 2 26 ? 2.346 -118.204 -27.302 1.00 42.66 ? 26 TYR B N 1 ATOM 2524 C CA . TYR B 2 26 ? 1.946 -117.992 -28.692 1.00 42.58 ? 26 TYR B CA 1 ATOM 2525 C C . TYR B 2 26 ? 0.435 -117.954 -28.797 1.00 43.15 ? 26 TYR B C 1 ATOM 2526 O O . TYR B 2 26 ? -0.220 -118.990 -28.667 1.00 43.14 ? 26 TYR B O 1 ATOM 2527 C CB . TYR B 2 26 ? 2.507 -119.126 -29.543 1.00 42.06 ? 26 TYR B CB 1 ATOM 2528 C CG . TYR B 2 26 ? 2.226 -119.085 -31.026 1.00 41.15 ? 26 TYR B CG 1 ATOM 2529 C CD1 . TYR B 2 26 ? 2.337 -117.905 -31.766 1.00 40.46 ? 26 TYR B CD1 1 ATOM 2530 C CD2 . TYR B 2 26 ? 1.903 -120.253 -31.702 1.00 41.01 ? 26 TYR B CD2 1 ATOM 2531 C CE1 . TYR B 2 26 ? 2.098 -117.897 -33.148 1.00 40.30 ? 26 TYR B CE1 1 ATOM 2532 C CE2 . TYR B 2 26 ? 1.666 -120.261 -33.075 1.00 40.96 ? 26 TYR B CE2 1 ATOM 2533 C CZ . TYR B 2 26 ? 1.765 -119.087 -33.796 1.00 40.58 ? 26 TYR B CZ 1 ATOM 2534 O OH . TYR B 2 26 ? 1.521 -119.138 -35.154 1.00 40.02 ? 26 TYR B OH 1 ATOM 2535 N N . VAL B 2 27 ? -0.107 -116.753 -29.024 1.00 43.89 ? 27 VAL B N 1 ATOM 2536 C CA . VAL B 2 27 ? -1.560 -116.537 -29.148 1.00 44.60 ? 27 VAL B CA 1 ATOM 2537 C C . VAL B 2 27 ? -1.979 -116.476 -30.610 1.00 45.01 ? 27 VAL B C 1 ATOM 2538 O O . VAL B 2 27 ? -1.384 -115.740 -31.396 1.00 44.87 ? 27 VAL B O 1 ATOM 2539 C CB . VAL B 2 27 ? -2.026 -115.233 -28.458 1.00 44.62 ? 27 VAL B CB 1 ATOM 2540 C CG1 . VAL B 2 27 ? -3.531 -115.095 -28.562 1.00 44.61 ? 27 VAL B CG1 1 ATOM 2541 C CG2 . VAL B 2 27 ? -1.603 -115.205 -27.002 1.00 44.44 ? 27 VAL B CG2 1 ATOM 2542 N N . THR B 2 28 ? -3.009 -117.244 -30.961 1.00 45.64 ? 28 THR B N 1 ATOM 2543 C CA . THR B 2 28 ? -3.415 -117.396 -32.357 1.00 46.45 ? 28 THR B CA 1 ATOM 2544 C C . THR B 2 28 ? -4.923 -117.395 -32.563 1.00 46.99 ? 28 THR B C 1 ATOM 2545 O O . THR B 2 28 ? -5.688 -117.435 -31.606 1.00 47.30 ? 28 THR B O 1 ATOM 2546 C CB . THR B 2 28 ? -2.898 -118.717 -32.946 1.00 46.37 ? 28 THR B CB 1 ATOM 2547 O OG1 . THR B 2 28 ? -3.587 -119.816 -32.337 1.00 46.83 ? 28 THR B OG1 1 ATOM 2548 C CG2 . THR B 2 28 ? -1.419 -118.858 -32.714 1.00 46.42 ? 28 THR B CG2 1 ATOM 2549 N N . GLN B 2 29 ? -5.325 -117.358 -33.834 1.00 47.66 ? 29 GLN B N 1 ATOM 2550 C CA . GLN B 2 29 ? -6.710 -117.550 -34.263 1.00 48.21 ? 29 GLN B CA 1 ATOM 2551 C C . GLN B 2 29 ? -7.676 -116.541 -33.650 1.00 48.41 ? 29 GLN B C 1 ATOM 2552 O O . GLN B 2 29 ? -8.823 -116.878 -33.361 1.00 48.57 ? 29 GLN B O 1 ATOM 2553 C CB . GLN B 2 29 ? -7.170 -118.986 -33.971 1.00 48.24 ? 29 GLN B CB 1 ATOM 2554 C CG . GLN B 2 29 ? -6.427 -120.068 -34.754 1.00 49.67 ? 29 GLN B CG 1 ATOM 2555 C CD . GLN B 2 29 ? -6.770 -120.069 -36.249 1.00 52.26 ? 29 GLN B CD 1 ATOM 2556 O OE1 . GLN B 2 29 ? -5.884 -120.190 -37.102 1.00 52.62 ? 29 GLN B OE1 1 ATOM 2557 N NE2 . GLN B 2 29 ? -8.062 -119.932 -36.569 1.00 53.38 ? 29 GLN B NE2 1 ATOM 2558 N N . PHE B 2 30 ? -7.219 -115.308 -33.455 1.00 48.64 ? 30 PHE B N 1 ATOM 2559 C CA . PHE B 2 30 ? -8.067 -114.295 -32.836 1.00 49.10 ? 30 PHE B CA 1 ATOM 2560 C C . PHE B 2 30 ? -8.382 -113.111 -33.731 1.00 49.74 ? 30 PHE B C 1 ATOM 2561 O O . PHE B 2 30 ? -7.632 -112.800 -34.659 1.00 49.97 ? 30 PHE B O 1 ATOM 2562 C CB . PHE B 2 30 ? -7.510 -113.831 -31.486 1.00 49.06 ? 30 PHE B CB 1 ATOM 2563 C CG . PHE B 2 30 ? -6.154 -113.185 -31.554 1.00 48.18 ? 30 PHE B CG 1 ATOM 2564 C CD1 . PHE B 2 30 ? -4.998 -113.956 -31.669 1.00 47.64 ? 30 PHE B CD1 1 ATOM 2565 C CD2 . PHE B 2 30 ? -6.029 -111.807 -31.442 1.00 47.33 ? 30 PHE B CD2 1 ATOM 2566 C CE1 . PHE B 2 30 ? -3.742 -113.356 -31.703 1.00 47.57 ? 30 PHE B CE1 1 ATOM 2567 C CE2 . PHE B 2 30 ? -4.777 -111.201 -31.476 1.00 47.24 ? 30 PHE B CE2 1 ATOM 2568 C CZ . PHE B 2 30 ? -3.632 -111.976 -31.607 1.00 46.99 ? 30 PHE B CZ 1 ATOM 2569 N N . HIS B 2 31 ? -9.515 -112.471 -33.443 1.00 50.38 ? 31 HIS B N 1 ATOM 2570 C CA . HIS B 2 31 ? -10.028 -111.356 -34.233 1.00 50.99 ? 31 HIS B CA 1 ATOM 2571 C C . HIS B 2 31 ? -11.119 -110.641 -33.464 1.00 51.45 ? 31 HIS B C 1 ATOM 2572 O O . HIS B 2 31 ? -12.038 -111.296 -32.969 1.00 51.46 ? 31 HIS B O 1 ATOM 2573 C CB . HIS B 2 31 ? -10.620 -111.841 -35.553 1.00 50.93 ? 31 HIS B CB 1 ATOM 2574 C CG . HIS B 2 31 ? -10.862 -110.740 -36.534 1.00 51.30 ? 31 HIS B CG 1 ATOM 2575 N ND1 . HIS B 2 31 ? -10.060 -110.541 -37.638 1.00 51.37 ? 31 HIS B ND1 1 ATOM 2576 C CD2 . HIS B 2 31 ? -11.795 -109.759 -36.562 1.00 51.39 ? 31 HIS B CD2 1 ATOM 2577 C CE1 . HIS B 2 31 ? -10.498 -109.491 -38.309 1.00 51.95 ? 31 HIS B CE1 1 ATOM 2578 N NE2 . HIS B 2 31 ? -11.551 -108.999 -37.678 1.00 51.74 ? 31 HIS B NE2 1 ATOM 2579 N N . PRO B 2 32 ? -11.051 -109.298 -33.373 1.00 51.95 ? 32 PRO B N 1 ATOM 2580 C CA . PRO B 2 32 ? -10.091 -108.284 -33.836 1.00 52.52 ? 32 PRO B CA 1 ATOM 2581 C C . PRO B 2 32 ? -8.639 -108.411 -33.332 1.00 53.20 ? 32 PRO B C 1 ATOM 2582 O O . PRO B 2 32 ? -8.378 -109.156 -32.390 1.00 53.16 ? 32 PRO B O 1 ATOM 2583 C CB . PRO B 2 32 ? -10.701 -106.974 -33.315 1.00 52.57 ? 32 PRO B CB 1 ATOM 2584 C CG . PRO B 2 32 ? -11.758 -107.379 -32.341 1.00 52.40 ? 32 PRO B CG 1 ATOM 2585 C CD . PRO B 2 32 ? -12.270 -108.656 -32.865 1.00 51.95 ? 32 PRO B CD 1 ATOM 2586 N N . PRO B 2 33 ? -7.699 -107.676 -33.966 1.00 53.88 ? 33 PRO B N 1 ATOM 2587 C CA . PRO B 2 33 ? -6.288 -107.689 -33.599 1.00 54.51 ? 33 PRO B CA 1 ATOM 2588 C C . PRO B 2 33 ? -5.969 -107.058 -32.251 1.00 55.24 ? 33 PRO B C 1 ATOM 2589 O O . PRO B 2 33 ? -4.930 -107.374 -31.676 1.00 55.58 ? 33 PRO B O 1 ATOM 2590 C CB . PRO B 2 33 ? -5.634 -106.854 -34.700 1.00 54.42 ? 33 PRO B CB 1 ATOM 2591 C CG . PRO B 2 33 ? -6.707 -106.001 -35.208 1.00 54.17 ? 33 PRO B CG 1 ATOM 2592 C CD . PRO B 2 33 ? -7.918 -106.856 -35.169 1.00 53.92 ? 33 PRO B CD 1 ATOM 2593 N N . HIS B 2 34 ? -6.816 -106.163 -31.752 1.00 55.92 ? 34 HIS B N 1 ATOM 2594 C CA . HIS B 2 34 ? -6.541 -105.578 -30.444 1.00 56.58 ? 34 HIS B CA 1 ATOM 2595 C C . HIS B 2 34 ? -6.685 -106.624 -29.347 1.00 56.64 ? 34 HIS B C 1 ATOM 2596 O O . HIS B 2 34 ? -7.712 -107.304 -29.253 1.00 56.92 ? 34 HIS B O 1 ATOM 2597 C CB . HIS B 2 34 ? -7.432 -104.376 -30.151 1.00 57.00 ? 34 HIS B CB 1 ATOM 2598 C CG . HIS B 2 34 ? -7.035 -103.638 -28.909 1.00 58.68 ? 34 HIS B CG 1 ATOM 2599 N ND1 . HIS B 2 34 ? -5.850 -102.936 -28.808 1.00 60.56 ? 34 HIS B ND1 1 ATOM 2600 C CD2 . HIS B 2 34 ? -7.653 -103.505 -27.711 1.00 59.57 ? 34 HIS B CD2 1 ATOM 2601 C CE1 . HIS B 2 34 ? -5.759 -102.399 -27.604 1.00 60.41 ? 34 HIS B CE1 1 ATOM 2602 N NE2 . HIS B 2 34 ? -6.841 -102.727 -26.920 1.00 60.30 ? 34 HIS B NE2 1 ATOM 2603 N N . ILE B 2 35 ? -5.646 -106.753 -28.528 1.00 56.58 ? 35 ILE B N 1 ATOM 2604 C CA . ILE B 2 35 ? -5.568 -107.803 -27.516 1.00 56.39 ? 35 ILE B CA 1 ATOM 2605 C C . ILE B 2 35 ? -4.597 -107.375 -26.422 1.00 56.63 ? 35 ILE B C 1 ATOM 2606 O O . ILE B 2 35 ? -3.706 -106.570 -26.665 1.00 56.64 ? 35 ILE B O 1 ATOM 2607 C CB . ILE B 2 35 ? -5.136 -109.152 -28.154 1.00 56.23 ? 35 ILE B CB 1 ATOM 2608 C CG1 . ILE B 2 35 ? -5.299 -110.311 -27.170 1.00 55.65 ? 35 ILE B CG1 1 ATOM 2609 C CG2 . ILE B 2 35 ? -3.718 -109.066 -28.722 1.00 56.09 ? 35 ILE B CG2 1 ATOM 2610 C CD1 . ILE B 2 35 ? -5.032 -111.652 -27.784 1.00 54.94 ? 35 ILE B CD1 1 ATOM 2611 N N . GLU B 2 36 ? -4.770 -107.908 -25.218 1.00 57.09 ? 36 GLU B N 1 ATOM 2612 C CA . GLU B 2 36 ? -3.902 -107.557 -24.100 1.00 57.44 ? 36 GLU B CA 1 ATOM 2613 C C . GLU B 2 36 ? -3.263 -108.827 -23.557 1.00 57.31 ? 36 GLU B C 1 ATOM 2614 O O . GLU B 2 36 ? -3.966 -109.731 -23.112 1.00 57.47 ? 36 GLU B O 1 ATOM 2615 C CB . GLU B 2 36 ? -4.709 -106.829 -23.023 1.00 57.60 ? 36 GLU B CB 1 ATOM 2616 C CG . GLU B 2 36 ? -4.018 -105.608 -22.414 1.00 58.95 ? 36 GLU B CG 1 ATOM 2617 C CD . GLU B 2 36 ? -3.172 -105.936 -21.177 1.00 60.86 ? 36 GLU B CD 1 ATOM 2618 O OE1 . GLU B 2 36 ? -3.672 -106.618 -20.247 1.00 61.89 ? 36 GLU B OE1 1 ATOM 2619 O OE2 . GLU B 2 36 ? -2.005 -105.488 -21.126 1.00 60.88 ? 36 GLU B OE2 1 ATOM 2620 N N . ILE B 2 37 ? -1.935 -108.902 -23.626 1.00 57.30 ? 37 ILE B N 1 ATOM 2621 C CA . ILE B 2 37 ? -1.197 -110.083 -23.167 1.00 57.37 ? 37 ILE B CA 1 ATOM 2622 C C . ILE B 2 37 ? -0.223 -109.742 -22.041 1.00 57.59 ? 37 ILE B C 1 ATOM 2623 O O . ILE B 2 37 ? 0.459 -108.718 -22.090 1.00 57.69 ? 37 ILE B O 1 ATOM 2624 C CB . ILE B 2 37 ? -0.404 -110.749 -24.309 1.00 57.23 ? 37 ILE B CB 1 ATOM 2625 C CG1 . ILE B 2 37 ? -1.338 -111.187 -25.436 1.00 57.29 ? 37 ILE B CG1 1 ATOM 2626 C CG2 . ILE B 2 37 ? 0.378 -111.950 -23.797 1.00 57.15 ? 37 ILE B CG2 1 ATOM 2627 C CD1 . ILE B 2 37 ? -0.619 -111.564 -26.730 1.00 56.79 ? 37 ILE B CD1 1 ATOM 2628 N N . GLN B 2 38 ? -0.173 -110.607 -21.029 1.00 57.83 ? 38 GLN B N 1 ATOM 2629 C CA . GLN B 2 38 ? 0.836 -110.525 -19.970 1.00 58.08 ? 38 GLN B CA 1 ATOM 2630 C C . GLN B 2 38 ? 1.253 -111.907 -19.498 1.00 58.03 ? 38 GLN B C 1 ATOM 2631 O O . GLN B 2 38 ? 0.472 -112.858 -19.570 1.00 58.00 ? 38 GLN B O 1 ATOM 2632 C CB . GLN B 2 38 ? 0.350 -109.683 -18.790 1.00 58.22 ? 38 GLN B CB 1 ATOM 2633 C CG . GLN B 2 38 ? -1.015 -110.069 -18.235 1.00 58.97 ? 38 GLN B CG 1 ATOM 2634 C CD . GLN B 2 38 ? -1.622 -108.946 -17.414 1.00 60.29 ? 38 GLN B CD 1 ATOM 2635 O OE1 . GLN B 2 38 ? -2.770 -108.543 -17.633 1.00 60.82 ? 38 GLN B OE1 1 ATOM 2636 N NE2 . GLN B 2 38 ? -0.841 -108.416 -16.476 1.00 60.45 ? 38 GLN B NE2 1 ATOM 2637 N N . MET B 2 39 ? 2.493 -112.008 -19.029 1.00 58.04 ? 39 MET B N 1 ATOM 2638 C CA . MET B 2 39 ? 3.026 -113.269 -18.539 1.00 58.02 ? 39 MET B CA 1 ATOM 2639 C C . MET B 2 39 ? 3.285 -113.172 -17.043 1.00 58.34 ? 39 MET B C 1 ATOM 2640 O O . MET B 2 39 ? 3.774 -112.151 -16.558 1.00 58.22 ? 39 MET B O 1 ATOM 2641 C CB . MET B 2 39 ? 4.270 -113.673 -19.336 1.00 57.79 ? 39 MET B CB 1 ATOM 2642 C CG . MET B 2 39 ? 3.936 -114.096 -20.775 1.00 57.08 ? 39 MET B CG 1 ATOM 2643 S SD . MET B 2 39 ? 5.337 -114.592 -21.805 1.00 56.02 ? 39 MET B SD 1 ATOM 2644 C CE . MET B 2 39 ? 5.523 -116.313 -21.383 1.00 56.35 ? 39 MET B CE 1 ATOM 2645 N N . LEU B 2 40 ? 2.931 -114.236 -16.321 1.00 59.00 ? 40 LEU B N 1 ATOM 2646 C CA . LEU B 2 40 ? 2.901 -114.229 -14.851 1.00 59.61 ? 40 LEU B CA 1 ATOM 2647 C C . LEU B 2 40 ? 3.793 -115.271 -14.165 1.00 60.17 ? 40 LEU B C 1 ATOM 2648 O O . LEU B 2 40 ? 3.675 -116.470 -14.425 1.00 60.08 ? 40 LEU B O 1 ATOM 2649 C CB . LEU B 2 40 ? 1.463 -114.414 -14.356 1.00 59.47 ? 40 LEU B CB 1 ATOM 2650 C CG . LEU B 2 40 ? 0.367 -113.522 -14.936 1.00 59.24 ? 40 LEU B CG 1 ATOM 2651 C CD1 . LEU B 2 40 ? -0.979 -114.204 -14.786 1.00 59.30 ? 40 LEU B CD1 1 ATOM 2652 C CD2 . LEU B 2 40 ? 0.361 -112.144 -14.287 1.00 58.96 ? 40 LEU B CD2 1 ATOM 2653 N N . LYS B 2 41 ? 4.672 -114.801 -13.280 1.00 61.04 ? 41 LYS B N 1 ATOM 2654 C CA . LYS B 2 41 ? 5.419 -115.671 -12.361 1.00 61.82 ? 41 LYS B CA 1 ATOM 2655 C C . LYS B 2 41 ? 4.746 -115.635 -10.990 1.00 62.43 ? 41 LYS B C 1 ATOM 2656 O O . LYS B 2 41 ? 4.865 -114.639 -10.263 1.00 62.76 ? 41 LYS B O 1 ATOM 2657 C CB . LYS B 2 41 ? 6.874 -115.210 -12.239 1.00 61.72 ? 41 LYS B CB 1 ATOM 2658 C CG . LYS B 2 41 ? 7.685 -115.929 -11.175 1.00 61.49 ? 41 LYS B CG 1 ATOM 2659 C CD . LYS B 2 41 ? 9.010 -115.229 -10.959 1.00 62.01 ? 41 LYS B CD 1 ATOM 2660 C CE . LYS B 2 41 ? 9.961 -116.076 -10.144 1.00 62.15 ? 41 LYS B CE 1 ATOM 2661 N NZ . LYS B 2 41 ? 11.363 -115.601 -10.280 1.00 62.18 ? 41 LYS B NZ 1 ATOM 2662 N N . ASN B 2 42 ? 4.041 -116.713 -10.642 1.00 62.93 ? 42 ASN B N 1 ATOM 2663 C CA . ASN B 2 42 ? 3.286 -116.787 -9.382 1.00 63.49 ? 42 ASN B CA 1 ATOM 2664 C C . ASN B 2 42 ? 2.247 -115.676 -9.244 1.00 63.99 ? 42 ASN B C 1 ATOM 2665 O O . ASN B 2 42 ? 2.314 -114.870 -8.310 1.00 64.13 ? 42 ASN B O 1 ATOM 2666 C CB . ASN B 2 42 ? 4.222 -116.788 -8.163 1.00 63.31 ? 42 ASN B CB 1 ATOM 2667 C CG . ASN B 2 42 ? 4.822 -118.146 -7.892 1.00 63.33 ? 42 ASN B CG 1 ATOM 2668 O OD1 . ASN B 2 42 ? 4.107 -119.110 -7.621 1.00 63.50 ? 42 ASN B OD1 1 ATOM 2669 N ND2 . ASN B 2 42 ? 6.147 -118.231 -7.955 1.00 63.03 ? 42 ASN B ND2 1 ATOM 2670 N N . GLY B 2 43 ? 1.305 -115.632 -10.188 1.00 64.52 ? 43 GLY B N 1 ATOM 2671 C CA . GLY B 2 43 ? 0.197 -114.668 -10.167 1.00 64.95 ? 43 GLY B CA 1 ATOM 2672 C C . GLY B 2 43 ? 0.600 -113.217 -10.350 1.00 65.30 ? 43 GLY B C 1 ATOM 2673 O O . GLY B 2 43 ? -0.254 -112.347 -10.479 1.00 65.24 ? 43 GLY B O 1 ATOM 2674 N N . LYS B 2 44 ? 1.906 -112.964 -10.361 1.00 65.91 ? 44 LYS B N 1 ATOM 2675 C CA . LYS B 2 44 ? 2.458 -111.614 -10.498 1.00 66.67 ? 44 LYS B CA 1 ATOM 2676 C C . LYS B 2 44 ? 2.929 -111.349 -11.938 1.00 66.92 ? 44 LYS B C 1 ATOM 2677 O O . LYS B 2 44 ? 3.362 -112.263 -12.644 1.00 66.93 ? 44 LYS B O 1 ATOM 2678 C CB . LYS B 2 44 ? 3.620 -111.392 -9.503 1.00 66.79 ? 44 LYS B CB 1 ATOM 2679 C CG . LYS B 2 44 ? 3.335 -111.775 -8.036 1.00 67.07 ? 44 LYS B CG 1 ATOM 2680 C CD . LYS B 2 44 ? 2.497 -110.720 -7.318 1.00 67.92 ? 44 LYS B CD 1 ATOM 2681 C CE . LYS B 2 44 ? 2.116 -111.158 -5.908 1.00 68.24 ? 44 LYS B CE 1 ATOM 2682 N NZ . LYS B 2 44 ? 0.890 -112.010 -5.884 1.00 68.49 ? 44 LYS B NZ 1 ATOM 2683 N N . LYS B 2 45 ? 2.852 -110.089 -12.353 1.00 67.18 ? 45 LYS B N 1 ATOM 2684 C CA . LYS B 2 45 ? 3.168 -109.673 -13.717 1.00 67.58 ? 45 LYS B CA 1 ATOM 2685 C C . LYS B 2 45 ? 4.683 -109.674 -13.958 1.00 67.54 ? 45 LYS B C 1 ATOM 2686 O O . LYS B 2 45 ? 5.421 -109.042 -13.200 1.00 67.71 ? 45 LYS B O 1 ATOM 2687 C CB . LYS B 2 45 ? 2.591 -108.272 -13.944 1.00 67.80 ? 45 LYS B CB 1 ATOM 2688 C CG . LYS B 2 45 ? 1.449 -107.941 -12.978 1.00 68.94 ? 45 LYS B CG 1 ATOM 2689 C CD . LYS B 2 45 ? 0.357 -107.118 -13.640 1.00 71.16 ? 45 LYS B CD 1 ATOM 2690 C CE . LYS B 2 45 ? -1.040 -107.554 -13.156 1.00 71.69 ? 45 LYS B CE 1 ATOM 2691 N NZ . LYS B 2 45 ? -2.137 -106.966 -13.999 1.00 71.93 ? 45 LYS B NZ 1 ATOM 2692 N N . ILE B 2 46 ? 5.149 -110.379 -14.995 1.00 67.31 ? 46 ILE B N 1 ATOM 2693 C CA . ILE B 2 46 ? 6.595 -110.466 -15.261 1.00 67.19 ? 46 ILE B CA 1 ATOM 2694 C C . ILE B 2 46 ? 7.116 -109.184 -15.906 1.00 67.25 ? 46 ILE B C 1 ATOM 2695 O O . ILE B 2 46 ? 6.719 -108.841 -17.018 1.00 67.19 ? 46 ILE B O 1 ATOM 2696 C CB . ILE B 2 46 ? 7.001 -111.723 -16.068 1.00 67.15 ? 46 ILE B CB 1 ATOM 2697 C CG1 . ILE B 2 46 ? 6.687 -112.983 -15.255 1.00 67.24 ? 46 ILE B CG1 1 ATOM 2698 C CG2 . ILE B 2 46 ? 8.494 -111.683 -16.421 1.00 66.77 ? 46 ILE B CG2 1 ATOM 2699 C CD1 . ILE B 2 46 ? 6.768 -114.285 -16.031 1.00 67.43 ? 46 ILE B CD1 1 ATOM 2700 N N . PRO B 2 47 ? 8.029 -108.485 -15.204 1.00 67.41 ? 47 PRO B N 1 ATOM 2701 C CA . PRO B 2 47 ? 8.370 -107.093 -15.511 1.00 67.37 ? 47 PRO B CA 1 ATOM 2702 C C . PRO B 2 47 ? 8.587 -106.824 -16.998 1.00 67.26 ? 47 PRO B C 1 ATOM 2703 O O . PRO B 2 47 ? 8.015 -105.879 -17.552 1.00 67.20 ? 47 PRO B O 1 ATOM 2704 C CB . PRO B 2 47 ? 9.679 -106.865 -14.724 1.00 67.51 ? 47 PRO B CB 1 ATOM 2705 C CG . PRO B 2 47 ? 10.176 -108.248 -14.342 1.00 67.48 ? 47 PRO B CG 1 ATOM 2706 C CD . PRO B 2 47 ? 8.921 -109.043 -14.167 1.00 67.57 ? 47 PRO B CD 1 ATOM 2707 N N . LYS B 2 48 ? 9.388 -107.676 -17.630 1.00 67.09 ? 48 LYS B N 1 ATOM 2708 C CA . LYS B 2 48 ? 9.930 -107.389 -18.946 1.00 66.91 ? 48 LYS B CA 1 ATOM 2709 C C . LYS B 2 48 ? 9.587 -108.475 -19.961 1.00 66.49 ? 48 LYS B C 1 ATOM 2710 O O . LYS B 2 48 ? 10.467 -109.222 -20.418 1.00 66.57 ? 48 LYS B O 1 ATOM 2711 C CB . LYS B 2 48 ? 11.450 -107.194 -18.852 1.00 67.19 ? 48 LYS B CB 1 ATOM 2712 C CG . LYS B 2 48 ? 11.889 -105.909 -18.163 1.00 67.47 ? 48 LYS B CG 1 ATOM 2713 C CD . LYS B 2 48 ? 13.399 -105.827 -18.136 1.00 68.92 ? 48 LYS B CD 1 ATOM 2714 C CE . LYS B 2 48 ? 13.867 -104.412 -17.873 1.00 69.95 ? 48 LYS B CE 1 ATOM 2715 N NZ . LYS B 2 48 ? 15.288 -104.233 -18.296 1.00 70.46 ? 48 LYS B NZ 1 ATOM 2716 N N . VAL B 2 49 ? 8.300 -108.562 -20.296 1.00 65.69 ? 49 VAL B N 1 ATOM 2717 C CA . VAL B 2 49 ? 7.836 -109.432 -21.373 1.00 64.70 ? 49 VAL B CA 1 ATOM 2718 C C . VAL B 2 49 ? 8.142 -108.729 -22.679 1.00 63.93 ? 49 VAL B C 1 ATOM 2719 O O . VAL B 2 49 ? 7.912 -107.527 -22.812 1.00 63.92 ? 49 VAL B O 1 ATOM 2720 C CB . VAL B 2 49 ? 6.317 -109.690 -21.304 1.00 64.78 ? 49 VAL B CB 1 ATOM 2721 C CG1 . VAL B 2 49 ? 5.917 -110.777 -22.291 1.00 64.77 ? 49 VAL B CG1 1 ATOM 2722 C CG2 . VAL B 2 49 ? 5.895 -110.078 -19.900 1.00 64.89 ? 49 VAL B CG2 1 ATOM 2723 N N . GLU B 2 50 ? 8.670 -109.478 -23.635 1.00 63.03 ? 50 GLU B N 1 ATOM 2724 C CA . GLU B 2 50 ? 8.961 -108.924 -24.948 1.00 62.41 ? 50 GLU B CA 1 ATOM 2725 C C . GLU B 2 50 ? 8.026 -109.510 -26.000 1.00 61.44 ? 50 GLU B C 1 ATOM 2726 O O . GLU B 2 50 ? 7.797 -110.718 -26.038 1.00 61.38 ? 50 GLU B O 1 ATOM 2727 C CB . GLU B 2 50 ? 10.438 -109.116 -25.302 1.00 62.68 ? 50 GLU B CB 1 ATOM 2728 C CG . GLU B 2 50 ? 11.376 -108.285 -24.407 1.00 64.13 ? 50 GLU B CG 1 ATOM 2729 C CD . GLU B 2 50 ? 12.861 -108.586 -24.608 1.00 65.73 ? 50 GLU B CD 1 ATOM 2730 O OE1 . GLU B 2 50 ? 13.209 -109.430 -25.470 1.00 66.17 ? 50 GLU B OE1 1 ATOM 2731 O OE2 . GLU B 2 50 ? 13.683 -107.969 -23.889 1.00 66.23 ? 50 GLU B OE2 1 ATOM 2732 N N . MET B 2 51 ? 7.474 -108.636 -26.837 1.00 60.27 ? 51 MET B N 1 ATOM 2733 C CA . MET B 2 51 ? 6.482 -109.027 -27.831 1.00 59.13 ? 51 MET B CA 1 ATOM 2734 C C . MET B 2 51 ? 7.074 -109.085 -29.234 1.00 58.21 ? 51 MET B C 1 ATOM 2735 O O . MET B 2 51 ? 7.899 -108.253 -29.606 1.00 58.17 ? 51 MET B O 1 ATOM 2736 C CB . MET B 2 51 ? 5.310 -108.046 -27.807 1.00 59.21 ? 51 MET B CB 1 ATOM 2737 C CG . MET B 2 51 ? 4.615 -107.947 -26.459 1.00 59.56 ? 51 MET B CG 1 ATOM 2738 S SD . MET B 2 51 ? 3.374 -109.237 -26.232 1.00 60.84 ? 51 MET B SD 1 ATOM 2739 C CE . MET B 2 51 ? 1.863 -108.329 -26.571 1.00 60.70 ? 51 MET B CE 1 ATOM 2740 N N . SER B 2 52 ? 6.658 -110.084 -30.005 1.00 57.03 ? 52 SER B N 1 ATOM 2741 C CA . SER B 2 52 ? 6.923 -110.105 -31.436 1.00 55.92 ? 52 SER B CA 1 ATOM 2742 C C . SER B 2 52 ? 5.996 -109.089 -32.090 1.00 55.15 ? 52 SER B C 1 ATOM 2743 O O . SER B 2 52 ? 5.104 -108.549 -31.440 1.00 55.19 ? 52 SER B O 1 ATOM 2744 C CB . SER B 2 52 ? 6.657 -111.499 -32.014 1.00 56.12 ? 52 SER B CB 1 ATOM 2745 O OG . SER B 2 52 ? 5.262 -111.748 -32.170 1.00 55.67 ? 52 SER B OG 1 ATOM 2746 N N . ASP B 2 53 ? 6.198 -108.820 -33.370 1.00 54.08 ? 53 ASP B N 1 ATOM 2747 C CA . ASP B 2 53 ? 5.286 -107.944 -34.076 1.00 53.02 ? 53 ASP B CA 1 ATOM 2748 C C . ASP B 2 53 ? 4.021 -108.713 -34.427 1.00 52.35 ? 53 ASP B C 1 ATOM 2749 O O . ASP B 2 53 ? 4.077 -109.899 -34.749 1.00 52.31 ? 53 ASP B O 1 ATOM 2750 C CB . ASP B 2 53 ? 5.954 -107.386 -35.324 1.00 53.01 ? 53 ASP B CB 1 ATOM 2751 C CG . ASP B 2 53 ? 7.166 -106.535 -35.002 1.00 53.20 ? 53 ASP B CG 1 ATOM 2752 O OD1 . ASP B 2 53 ? 7.028 -105.536 -34.257 1.00 52.79 ? 53 ASP B OD1 1 ATOM 2753 O OD2 . ASP B 2 53 ? 8.262 -106.867 -35.501 1.00 53.70 ? 53 ASP B OD2 1 ATOM 2754 N N . MET B 2 54 ? 2.879 -108.038 -34.338 1.00 51.51 ? 54 MET B N 1 ATOM 2755 C CA . MET B 2 54 ? 1.596 -108.628 -34.716 1.00 50.65 ? 54 MET B CA 1 ATOM 2756 C C . MET B 2 54 ? 1.623 -108.990 -36.185 1.00 49.99 ? 54 MET B C 1 ATOM 2757 O O . MET B 2 54 ? 2.213 -108.280 -36.992 1.00 49.92 ? 54 MET B O 1 ATOM 2758 C CB . MET B 2 54 ? 0.464 -107.638 -34.462 1.00 50.80 ? 54 MET B CB 1 ATOM 2759 C CG . MET B 2 54 ? -0.933 -108.158 -34.799 1.00 51.06 ? 54 MET B CG 1 ATOM 2760 S SD . MET B 2 54 ? -1.789 -108.895 -33.399 1.00 51.01 ? 54 MET B SD 1 ATOM 2761 C CE . MET B 2 54 ? -1.848 -107.491 -32.279 1.00 51.02 ? 54 MET B CE 1 ATOM 2762 N N . SER B 2 55 ? 0.972 -110.094 -36.526 1.00 49.32 ? 55 SER B N 1 ATOM 2763 C CA . SER B 2 55 ? 0.989 -110.606 -37.888 1.00 48.74 ? 55 SER B CA 1 ATOM 2764 C C . SER B 2 55 ? -0.227 -111.487 -38.135 1.00 48.25 ? 55 SER B C 1 ATOM 2765 O O . SER B 2 55 ? -0.987 -111.772 -37.222 1.00 48.10 ? 55 SER B O 1 ATOM 2766 C CB . SER B 2 55 ? 2.286 -111.388 -38.128 1.00 48.81 ? 55 SER B CB 1 ATOM 2767 O OG . SER B 2 55 ? 2.371 -111.880 -39.451 1.00 48.98 ? 55 SER B OG 1 ATOM 2768 N N . PHE B 2 56 ? -0.422 -111.899 -39.377 1.00 47.91 ? 56 PHE B N 1 ATOM 2769 C CA . PHE B 2 56 ? -1.486 -112.830 -39.687 1.00 47.78 ? 56 PHE B CA 1 ATOM 2770 C C . PHE B 2 56 ? -1.101 -113.851 -40.764 1.00 47.87 ? 56 PHE B C 1 ATOM 2771 O O . PHE B 2 56 ? -0.112 -113.682 -41.480 1.00 48.20 ? 56 PHE B O 1 ATOM 2772 C CB . PHE B 2 56 ? -2.778 -112.091 -40.029 1.00 47.68 ? 56 PHE B CB 1 ATOM 2773 C CG . PHE B 2 56 ? -2.674 -111.184 -41.221 1.00 47.71 ? 56 PHE B CG 1 ATOM 2774 C CD1 . PHE B 2 56 ? -2.737 -111.697 -42.517 1.00 47.61 ? 56 PHE B CD1 1 ATOM 2775 C CD2 . PHE B 2 56 ? -2.557 -109.810 -41.053 1.00 47.14 ? 56 PHE B CD2 1 ATOM 2776 C CE1 . PHE B 2 56 ? -2.656 -110.855 -43.619 1.00 46.85 ? 56 PHE B CE1 1 ATOM 2777 C CE2 . PHE B 2 56 ? -2.478 -108.963 -42.154 1.00 46.44 ? 56 PHE B CE2 1 ATOM 2778 C CZ . PHE B 2 56 ? -2.530 -109.487 -43.435 1.00 46.40 ? 56 PHE B CZ 1 ATOM 2779 N N . SER B 2 57 ? -1.897 -114.910 -40.856 1.00 47.78 ? 57 SER B N 1 ATOM 2780 C CA . SER B 2 57 ? -1.603 -116.069 -41.681 1.00 47.55 ? 57 SER B CA 1 ATOM 2781 C C . SER B 2 57 ? -2.488 -116.068 -42.918 1.00 47.47 ? 57 SER B C 1 ATOM 2782 O O . SER B 2 57 ? -3.402 -115.255 -43.010 1.00 47.49 ? 57 SER B O 1 ATOM 2783 C CB . SER B 2 57 ? -1.849 -117.331 -40.849 1.00 47.77 ? 57 SER B CB 1 ATOM 2784 O OG . SER B 2 57 ? -3.046 -117.219 -40.088 1.00 47.34 ? 57 SER B OG 1 ATOM 2785 N N . LYS B 2 58 ? -2.333 -117.059 -43.783 1.00 47.49 ? 58 LYS B N 1 ATOM 2786 C CA . LYS B 2 58 ? -3.037 -117.042 -45.054 1.00 47.54 ? 58 LYS B CA 1 ATOM 2787 C C . LYS B 2 58 ? -4.541 -116.966 -44.815 1.00 47.63 ? 58 LYS B C 1 ATOM 2788 O O . LYS B 2 58 ? -5.253 -116.277 -45.546 1.00 47.99 ? 58 LYS B O 1 ATOM 2789 C CB . LYS B 2 58 ? -2.695 -118.286 -45.875 1.00 47.58 ? 58 LYS B CB 1 ATOM 2790 C CG . LYS B 2 58 ? -1.231 -118.384 -46.273 1.00 47.53 ? 58 LYS B CG 1 ATOM 2791 C CD . LYS B 2 58 ? -0.590 -119.644 -45.714 0.00 63.66 ? 58 LYS B CD 1 ATOM 2792 C CE . LYS B 2 58 ? 0.482 -119.310 -44.689 1.00 75.33 ? 58 LYS B CE 1 ATOM 2793 N NZ . LYS B 2 58 ? 0.964 -120.524 -43.974 1.00 76.08 ? 58 LYS B NZ 1 ATOM 2794 N N . ASP B 2 59 ? -5.029 -117.665 -43.795 1.00 47.45 ? 59 ASP B N 1 ATOM 2795 C CA . ASP B 2 59 ? -6.462 -117.614 -43.471 1.00 47.23 ? 59 ASP B CA 1 ATOM 2796 C C . ASP B 2 59 ? -6.884 -116.338 -42.727 1.00 46.81 ? 59 ASP B C 1 ATOM 2797 O O . ASP B 2 59 ? -7.930 -116.314 -42.079 1.00 46.87 ? 59 ASP B O 1 ATOM 2798 C CB . ASP B 2 59 ? -6.893 -118.853 -42.677 1.00 47.46 ? 59 ASP B CB 1 ATOM 2799 C CG . ASP B 2 59 ? -6.279 -118.905 -41.283 1.00 48.45 ? 59 ASP B CG 1 ATOM 2800 O OD1 . ASP B 2 59 ? -5.333 -118.119 -41.012 1.00 49.24 ? 59 ASP B OD1 1 ATOM 2801 O OD2 . ASP B 2 59 ? -6.745 -119.737 -40.462 1.00 49.07 ? 59 ASP B OD2 1 ATOM 2802 N N . TRP B 2 60 ? -6.060 -115.295 -42.806 1.00 46.30 ? 60 TRP B N 1 ATOM 2803 C CA . TRP B 2 60 ? -6.420 -113.956 -42.321 1.00 45.71 ? 60 TRP B CA 1 ATOM 2804 C C . TRP B 2 60 ? -6.543 -113.844 -40.796 1.00 45.45 ? 60 TRP B C 1 ATOM 2805 O O . TRP B 2 60 ? -6.992 -112.826 -40.266 1.00 45.38 ? 60 TRP B O 1 ATOM 2806 C CB . TRP B 2 60 ? -7.705 -113.465 -43.015 1.00 45.67 ? 60 TRP B CB 1 ATOM 2807 C CG . TRP B 2 60 ? -7.581 -113.394 -44.512 1.00 45.25 ? 60 TRP B CG 1 ATOM 2808 C CD1 . TRP B 2 60 ? -8.069 -114.288 -45.426 1.00 45.05 ? 60 TRP B CD1 1 ATOM 2809 C CD2 . TRP B 2 60 ? -6.906 -112.383 -45.263 1.00 44.55 ? 60 TRP B CD2 1 ATOM 2810 N NE1 . TRP B 2 60 ? -7.743 -113.892 -46.699 1.00 44.39 ? 60 TRP B NE1 1 ATOM 2811 C CE2 . TRP B 2 60 ? -7.029 -112.725 -46.628 1.00 44.56 ? 60 TRP B CE2 1 ATOM 2812 C CE3 . TRP B 2 60 ? -6.205 -111.220 -44.914 1.00 44.26 ? 60 TRP B CE3 1 ATOM 2813 C CZ2 . TRP B 2 60 ? -6.479 -111.944 -47.645 1.00 44.62 ? 60 TRP B CZ2 1 ATOM 2814 C CZ3 . TRP B 2 60 ? -5.662 -110.440 -45.925 1.00 44.22 ? 60 TRP B CZ3 1 ATOM 2815 C CH2 . TRP B 2 60 ? -5.803 -110.807 -47.275 1.00 44.86 ? 60 TRP B CH2 1 ATOM 2816 N N . SER B 2 61 ? -6.130 -114.886 -40.087 1.00 45.18 ? 61 SER B N 1 ATOM 2817 C CA . SER B 2 61 ? -6.243 -114.888 -38.634 1.00 44.87 ? 61 SER B CA 1 ATOM 2818 C C . SER B 2 61 ? -4.947 -114.416 -37.983 1.00 44.17 ? 61 SER B C 1 ATOM 2819 O O . SER B 2 61 ? -3.862 -114.913 -38.301 1.00 43.78 ? 61 SER B O 1 ATOM 2820 C CB . SER B 2 61 ? -6.628 -116.280 -38.133 1.00 45.16 ? 61 SER B CB 1 ATOM 2821 O OG . SER B 2 61 ? -5.725 -117.253 -38.636 1.00 45.98 ? 61 SER B OG 1 ATOM 2822 N N . PHE B 2 62 ? -5.083 -113.457 -37.070 1.00 43.49 ? 62 PHE B N 1 ATOM 2823 C CA . PHE B 2 62 ? -3.949 -112.869 -36.363 1.00 42.93 ? 62 PHE B CA 1 ATOM 2824 C C . PHE B 2 62 ? -3.192 -113.841 -35.465 1.00 42.96 ? 62 PHE B C 1 ATOM 2825 O O . PHE B 2 62 ? -3.758 -114.803 -34.941 1.00 42.92 ? 62 PHE B O 1 ATOM 2826 C CB . PHE B 2 62 ? -4.407 -111.686 -35.522 1.00 42.57 ? 62 PHE B CB 1 ATOM 2827 C CG . PHE B 2 62 ? -4.871 -110.522 -36.328 1.00 42.25 ? 62 PHE B CG 1 ATOM 2828 C CD1 . PHE B 2 62 ? -6.215 -110.344 -36.602 1.00 42.35 ? 62 PHE B CD1 1 ATOM 2829 C CD2 . PHE B 2 62 ? -3.968 -109.596 -36.814 1.00 41.84 ? 62 PHE B CD2 1 ATOM 2830 C CE1 . PHE B 2 62 ? -6.649 -109.262 -37.357 1.00 41.63 ? 62 PHE B CE1 1 ATOM 2831 C CE2 . PHE B 2 62 ? -4.397 -108.520 -37.562 1.00 41.07 ? 62 PHE B CE2 1 ATOM 2832 C CZ . PHE B 2 62 ? -5.740 -108.355 -37.836 1.00 40.96 ? 62 PHE B CZ 1 ATOM 2833 N N . TYR B 2 63 ? -1.899 -113.577 -35.305 1.00 42.89 ? 63 TYR B N 1 ATOM 2834 C CA . TYR B 2 63 ? -1.083 -114.263 -34.324 1.00 42.76 ? 63 TYR B CA 1 ATOM 2835 C C . TYR B 2 63 ? 0.004 -113.359 -33.780 1.00 42.85 ? 63 TYR B C 1 ATOM 2836 O O . TYR B 2 63 ? 0.320 -112.323 -34.360 1.00 42.99 ? 63 TYR B O 1 ATOM 2837 C CB . TYR B 2 63 ? -0.476 -115.532 -34.899 1.00 42.68 ? 63 TYR B CB 1 ATOM 2838 C CG . TYR B 2 63 ? 0.430 -115.335 -36.084 1.00 43.17 ? 63 TYR B CG 1 ATOM 2839 C CD1 . TYR B 2 63 ? 1.734 -114.838 -35.932 1.00 43.85 ? 63 TYR B CD1 1 ATOM 2840 C CD2 . TYR B 2 63 ? 0.002 -115.685 -37.360 1.00 43.91 ? 63 TYR B CD2 1 ATOM 2841 C CE1 . TYR B 2 63 ? 2.578 -114.679 -37.035 1.00 43.99 ? 63 TYR B CE1 1 ATOM 2842 C CE2 . TYR B 2 63 ? 0.832 -115.536 -38.464 1.00 44.57 ? 63 TYR B CE2 1 ATOM 2843 C CZ . TYR B 2 63 ? 2.111 -115.032 -38.299 1.00 44.32 ? 63 TYR B CZ 1 ATOM 2844 O OH . TYR B 2 63 ? 2.899 -114.896 -39.414 1.00 44.85 ? 63 TYR B OH 1 ATOM 2845 N N . ILE B 2 64 ? 0.577 -113.765 -32.657 1.00 43.04 ? 64 ILE B N 1 ATOM 2846 C CA . ILE B 2 64 ? 1.585 -112.974 -31.965 1.00 43.13 ? 64 ILE B CA 1 ATOM 2847 C C . ILE B 2 64 ? 2.245 -113.858 -30.908 1.00 43.27 ? 64 ILE B C 1 ATOM 2848 O O . ILE B 2 64 ? 1.581 -114.686 -30.266 1.00 43.28 ? 64 ILE B O 1 ATOM 2849 C CB . ILE B 2 64 ? 0.966 -111.676 -31.362 1.00 42.99 ? 64 ILE B CB 1 ATOM 2850 C CG1 . ILE B 2 64 ? 2.042 -110.763 -30.768 1.00 42.79 ? 64 ILE B CG1 1 ATOM 2851 C CG2 . ILE B 2 64 ? -0.149 -112.009 -30.369 1.00 43.46 ? 64 ILE B CG2 1 ATOM 2852 C CD1 . ILE B 2 64 ? 1.548 -109.365 -30.399 1.00 41.82 ? 64 ILE B CD1 1 ATOM 2853 N N . LEU B 2 65 ? 3.559 -113.702 -30.768 1.00 43.38 ? 65 LEU B N 1 ATOM 2854 C CA . LEU B 2 65 ? 4.345 -114.488 -29.836 1.00 43.44 ? 65 LEU B CA 1 ATOM 2855 C C . LEU B 2 65 ? 4.854 -113.596 -28.723 1.00 43.90 ? 65 LEU B C 1 ATOM 2856 O O . LEU B 2 65 ? 5.548 -112.612 -28.975 1.00 43.90 ? 65 LEU B O 1 ATOM 2857 C CB . LEU B 2 65 ? 5.515 -115.148 -30.561 1.00 43.09 ? 65 LEU B CB 1 ATOM 2858 C CG . LEU B 2 65 ? 6.493 -115.969 -29.724 1.00 42.88 ? 65 LEU B CG 1 ATOM 2859 C CD1 . LEU B 2 65 ? 5.885 -117.272 -29.250 1.00 42.51 ? 65 LEU B CD1 1 ATOM 2860 C CD2 . LEU B 2 65 ? 7.721 -116.250 -30.540 1.00 43.27 ? 65 LEU B CD2 1 ATOM 2861 N N . ALA B 2 66 ? 4.484 -113.932 -27.493 1.00 44.61 ? 66 ALA B N 1 ATOM 2862 C CA . ALA B 2 66 ? 5.033 -113.271 -26.317 1.00 45.29 ? 66 ALA B CA 1 ATOM 2863 C C . ALA B 2 66 ? 6.086 -114.187 -25.731 1.00 45.91 ? 66 ALA B C 1 ATOM 2864 O O . ALA B 2 66 ? 5.909 -115.408 -25.717 1.00 45.87 ? 66 ALA B O 1 ATOM 2865 C CB . ALA B 2 66 ? 3.949 -112.986 -25.303 1.00 45.07 ? 66 ALA B CB 1 ATOM 2866 N N . HIS B 2 67 ? 7.188 -113.602 -25.269 1.00 46.91 ? 67 HIS B N 1 ATOM 2867 C CA . HIS B 2 67 ? 8.272 -114.383 -24.666 1.00 47.84 ? 67 HIS B CA 1 ATOM 2868 C C . HIS B 2 67 ? 9.035 -113.640 -23.579 1.00 48.28 ? 67 HIS B C 1 ATOM 2869 O O . HIS B 2 67 ? 9.097 -112.416 -23.578 1.00 48.40 ? 67 HIS B O 1 ATOM 2870 C CB . HIS B 2 67 ? 9.234 -114.917 -25.734 1.00 47.93 ? 67 HIS B CB 1 ATOM 2871 C CG . HIS B 2 67 ? 10.092 -113.865 -26.359 1.00 48.08 ? 67 HIS B CG 1 ATOM 2872 N ND1 . HIS B 2 67 ? 11.443 -113.763 -26.103 1.00 48.52 ? 67 HIS B ND1 1 ATOM 2873 C CD2 . HIS B 2 67 ? 9.794 -112.874 -27.230 1.00 47.94 ? 67 HIS B CD2 1 ATOM 2874 C CE1 . HIS B 2 67 ? 11.940 -112.751 -26.790 1.00 48.96 ? 67 HIS B CE1 1 ATOM 2875 N NE2 . HIS B 2 67 ? 10.960 -112.194 -27.480 1.00 48.80 ? 67 HIS B NE2 1 ATOM 2876 N N . THR B 2 68 ? 9.618 -114.403 -22.660 1.00 49.16 ? 68 THR B N 1 ATOM 2877 C CA . THR B 2 68 ? 10.311 -113.856 -21.503 1.00 49.72 ? 68 THR B CA 1 ATOM 2878 C C . THR B 2 68 ? 11.413 -114.791 -21.032 1.00 50.57 ? 68 THR B C 1 ATOM 2879 O O . THR B 2 68 ? 11.325 -116.008 -21.201 1.00 50.42 ? 68 THR B O 1 ATOM 2880 C CB . THR B 2 68 ? 9.328 -113.598 -20.333 1.00 49.50 ? 68 THR B CB 1 ATOM 2881 O OG1 . THR B 2 68 ? 10.016 -112.951 -19.261 1.00 49.44 ? 68 THR B OG1 1 ATOM 2882 C CG2 . THR B 2 68 ? 8.702 -114.898 -19.826 1.00 48.68 ? 68 THR B CG2 1 ATOM 2883 N N . GLU B 2 69 ? 12.454 -114.212 -20.443 1.00 51.86 ? 69 GLU B N 1 ATOM 2884 C CA . GLU B 2 69 ? 13.450 -115.006 -19.726 1.00 53.15 ? 69 GLU B CA 1 ATOM 2885 C C . GLU B 2 69 ? 12.853 -115.428 -18.389 1.00 53.12 ? 69 GLU B C 1 ATOM 2886 O O . GLU B 2 69 ? 12.290 -114.609 -17.653 1.00 52.93 ? 69 GLU B O 1 ATOM 2887 C CB . GLU B 2 69 ? 14.760 -114.234 -19.503 1.00 53.64 ? 69 GLU B CB 1 ATOM 2888 C CG . GLU B 2 69 ? 15.321 -113.531 -20.746 1.00 56.62 ? 69 GLU B CG 1 ATOM 2889 C CD . GLU B 2 69 ? 16.848 -113.405 -20.745 1.00 60.01 ? 69 GLU B CD 1 ATOM 2890 O OE1 . GLU B 2 69 ? 17.457 -113.180 -19.666 1.00 61.14 ? 69 GLU B OE1 1 ATOM 2891 O OE2 . GLU B 2 69 ? 17.436 -113.524 -21.844 1.00 61.06 ? 69 GLU B OE2 1 ATOM 2892 N N . PHE B 2 70 ? 12.965 -116.717 -18.100 1.00 53.40 ? 70 PHE B N 1 ATOM 2893 C CA . PHE B 2 70 ? 12.485 -117.271 -16.847 1.00 53.78 ? 70 PHE B CA 1 ATOM 2894 C C . PHE B 2 70 ? 13.420 -118.376 -16.376 1.00 54.26 ? 70 PHE B C 1 ATOM 2895 O O . PHE B 2 70 ? 14.276 -118.849 -17.131 1.00 54.31 ? 70 PHE B O 1 ATOM 2896 C CB . PHE B 2 70 ? 11.041 -117.783 -16.994 1.00 53.63 ? 70 PHE B CB 1 ATOM 2897 C CG . PHE B 2 70 ? 10.918 -119.163 -17.602 1.00 52.69 ? 70 PHE B CG 1 ATOM 2898 C CD1 . PHE B 2 70 ? 10.161 -120.139 -16.969 1.00 51.90 ? 70 PHE B CD1 1 ATOM 2899 C CD2 . PHE B 2 70 ? 11.533 -119.482 -18.811 1.00 52.29 ? 70 PHE B CD2 1 ATOM 2900 C CE1 . PHE B 2 70 ? 10.025 -121.413 -17.525 1.00 51.41 ? 70 PHE B CE1 1 ATOM 2901 C CE2 . PHE B 2 70 ? 11.405 -120.758 -19.367 1.00 52.00 ? 70 PHE B CE2 1 ATOM 2902 C CZ . PHE B 2 70 ? 10.653 -121.721 -18.724 1.00 51.30 ? 70 PHE B CZ 1 ATOM 2903 N N . THR B 2 71 ? 13.264 -118.779 -15.124 1.00 54.62 ? 71 THR B N 1 ATOM 2904 C CA . THR B 2 71 ? 14.044 -119.887 -14.613 1.00 54.99 ? 71 THR B CA 1 ATOM 2905 C C . THR B 2 71 ? 13.098 -120.879 -13.889 1.00 55.03 ? 71 THR B C 1 ATOM 2906 O O . THR B 2 71 ? 12.574 -120.585 -12.804 1.00 55.16 ? 71 THR B O 1 ATOM 2907 C CB . THR B 2 71 ? 15.329 -119.379 -13.835 1.00 55.04 ? 71 THR B CB 1 ATOM 2908 O OG1 . THR B 2 71 ? 16.347 -120.392 -13.814 1.00 55.23 ? 71 THR B OG1 1 ATOM 2909 C CG2 . THR B 2 71 ? 15.016 -118.871 -12.415 1.00 55.35 ? 71 THR B CG2 1 ATOM 2910 N N . PRO B 2 72 ? 12.837 -122.038 -14.530 1.00 54.95 ? 72 PRO B N 1 ATOM 2911 C CA . PRO B 2 72 ? 11.853 -123.012 -14.066 1.00 55.15 ? 72 PRO B CA 1 ATOM 2912 C C . PRO B 2 72 ? 12.308 -123.731 -12.813 1.00 55.59 ? 72 PRO B C 1 ATOM 2913 O O . PRO B 2 72 ? 13.469 -124.118 -12.712 1.00 55.68 ? 72 PRO B O 1 ATOM 2914 C CB . PRO B 2 72 ? 11.774 -124.008 -15.227 1.00 54.99 ? 72 PRO B CB 1 ATOM 2915 C CG . PRO B 2 72 ? 13.092 -123.929 -15.879 1.00 54.91 ? 72 PRO B CG 1 ATOM 2916 C CD . PRO B 2 72 ? 13.521 -122.496 -15.753 1.00 54.94 ? 72 PRO B CD 1 ATOM 2917 N N . THR B 2 73 ? 11.403 -123.904 -11.859 1.00 56.05 ? 73 THR B N 1 ATOM 2918 C CA . THR B 2 73 ? 11.733 -124.634 -10.642 1.00 56.45 ? 73 THR B CA 1 ATOM 2919 C C . THR B 2 73 ? 10.620 -125.598 -10.280 1.00 56.76 ? 73 THR B C 1 ATOM 2920 O O . THR B 2 73 ? 9.672 -125.784 -11.042 1.00 56.74 ? 73 THR B O 1 ATOM 2921 C CB . THR B 2 73 ? 11.999 -123.699 -9.444 1.00 56.48 ? 73 THR B CB 1 ATOM 2922 O OG1 . THR B 2 73 ? 10.774 -123.065 -9.054 1.00 56.86 ? 73 THR B OG1 1 ATOM 2923 C CG2 . THR B 2 73 ? 13.060 -122.646 -9.781 1.00 56.42 ? 73 THR B CG2 1 ATOM 2924 N N . GLU B 2 74 ? 10.749 -126.209 -9.107 1.00 57.35 ? 74 GLU B N 1 ATOM 2925 C CA . GLU B 2 74 ? 9.780 -127.189 -8.632 1.00 57.85 ? 74 GLU B CA 1 ATOM 2926 C C . GLU B 2 74 ? 8.446 -126.544 -8.282 1.00 57.88 ? 74 GLU B C 1 ATOM 2927 O O . GLU B 2 74 ? 7.391 -127.136 -8.512 1.00 57.85 ? 74 GLU B O 1 ATOM 2928 C CB . GLU B 2 74 ? 10.316 -127.924 -7.403 1.00 57.94 ? 74 GLU B CB 1 ATOM 2929 C CG . GLU B 2 74 ? 11.587 -128.720 -7.631 1.00 58.69 ? 74 GLU B CG 1 ATOM 2930 C CD . GLU B 2 74 ? 11.878 -129.664 -6.480 1.00 60.10 ? 74 GLU B CD 1 ATOM 2931 O OE1 . GLU B 2 74 ? 12.915 -129.460 -5.804 1.00 60.54 ? 74 GLU B OE1 1 ATOM 2932 O OE2 . GLU B 2 74 ? 11.063 -130.593 -6.244 1.00 59.84 ? 74 GLU B OE2 1 ATOM 2933 N N . THR B 2 75 ? 8.504 -125.331 -7.735 1.00 57.95 ? 75 THR B N 1 ATOM 2934 C CA . THR B 2 75 ? 7.341 -124.714 -7.104 1.00 58.09 ? 75 THR B CA 1 ATOM 2935 C C . THR B 2 75 ? 6.897 -123.395 -7.730 1.00 58.15 ? 75 THR B C 1 ATOM 2936 O O . THR B 2 75 ? 5.759 -122.971 -7.513 1.00 58.28 ? 75 THR B O 1 ATOM 2937 C CB . THR B 2 75 ? 7.584 -124.468 -5.604 1.00 58.13 ? 75 THR B CB 1 ATOM 2938 O OG1 . THR B 2 75 ? 8.652 -123.527 -5.444 1.00 58.50 ? 75 THR B OG1 1 ATOM 2939 C CG2 . THR B 2 75 ? 7.946 -125.763 -4.891 1.00 58.35 ? 75 THR B CG2 1 ATOM 2940 N N . ASP B 2 76 ? 7.787 -122.736 -8.476 1.00 58.03 ? 76 ASP B N 1 ATOM 2941 C CA . ASP B 2 76 ? 7.426 -121.505 -9.180 1.00 57.93 ? 76 ASP B CA 1 ATOM 2942 C C . ASP B 2 76 ? 6.419 -121.815 -10.279 1.00 57.91 ? 76 ASP B C 1 ATOM 2943 O O . ASP B 2 76 ? 6.592 -122.785 -11.023 1.00 58.02 ? 76 ASP B O 1 ATOM 2944 C CB . ASP B 2 76 ? 8.658 -120.833 -9.780 1.00 57.94 ? 76 ASP B CB 1 ATOM 2945 C CG . ASP B 2 76 ? 9.530 -120.165 -8.734 1.00 58.34 ? 76 ASP B CG 1 ATOM 2946 O OD1 . ASP B 2 76 ? 10.758 -120.389 -8.746 1.00 58.86 ? 76 ASP B OD1 1 ATOM 2947 O OD2 . ASP B 2 76 ? 8.995 -119.407 -7.900 1.00 58.76 ? 76 ASP B OD2 1 ATOM 2948 N N . THR B 2 77 ? 5.362 -121.004 -10.361 1.00 57.84 ? 77 THR B N 1 ATOM 2949 C CA . THR B 2 77 ? 4.320 -121.169 -11.391 1.00 57.71 ? 77 THR B CA 1 ATOM 2950 C C . THR B 2 77 ? 4.372 -120.064 -12.430 1.00 57.48 ? 77 THR B C 1 ATOM 2951 O O . THR B 2 77 ? 4.519 -118.884 -12.089 1.00 57.51 ? 77 THR B O 1 ATOM 2952 C CB . THR B 2 77 ? 2.887 -121.177 -10.806 1.00 57.79 ? 77 THR B CB 1 ATOM 2953 O OG1 . THR B 2 77 ? 2.685 -120.004 -10.002 1.00 57.58 ? 77 THR B OG1 1 ATOM 2954 C CG2 . THR B 2 77 ? 2.629 -122.446 -9.988 1.00 57.81 ? 77 THR B CG2 1 ATOM 2955 N N . TYR B 2 78 ? 4.225 -120.452 -13.693 1.00 57.10 ? 78 TYR B N 1 ATOM 2956 C CA . TYR B 2 78 ? 4.272 -119.500 -14.792 1.00 56.83 ? 78 TYR B CA 1 ATOM 2957 C C . TYR B 2 78 ? 3.039 -119.625 -15.683 1.00 56.43 ? 78 TYR B C 1 ATOM 2958 O O . TYR B 2 78 ? 2.703 -120.718 -16.141 1.00 56.46 ? 78 TYR B O 1 ATOM 2959 C CB . TYR B 2 78 ? 5.553 -119.685 -15.606 1.00 57.05 ? 78 TYR B CB 1 ATOM 2960 C CG . TYR B 2 78 ? 6.844 -119.464 -14.832 1.00 57.80 ? 78 TYR B CG 1 ATOM 2961 C CD1 . TYR B 2 78 ? 7.538 -120.541 -14.266 1.00 58.82 ? 78 TYR B CD1 1 ATOM 2962 C CD2 . TYR B 2 78 ? 7.384 -118.184 -14.684 1.00 58.25 ? 78 TYR B CD2 1 ATOM 2963 C CE1 . TYR B 2 78 ? 8.731 -120.344 -13.564 1.00 59.35 ? 78 TYR B CE1 1 ATOM 2964 C CE2 . TYR B 2 78 ? 8.576 -117.977 -13.986 1.00 58.92 ? 78 TYR B CE2 1 ATOM 2965 C CZ . TYR B 2 78 ? 9.242 -119.060 -13.430 1.00 59.59 ? 78 TYR B CZ 1 ATOM 2966 O OH . TYR B 2 78 ? 10.415 -118.862 -12.736 1.00 60.77 ? 78 TYR B OH 1 ATOM 2967 N N . ALA B 2 79 ? 2.366 -118.501 -15.919 1.00 55.95 ? 79 ALA B N 1 ATOM 2968 C CA . ALA B 2 79 ? 1.143 -118.480 -16.723 1.00 55.48 ? 79 ALA B CA 1 ATOM 2969 C C . ALA B 2 79 ? 1.130 -117.367 -17.775 1.00 55.21 ? 79 ALA B C 1 ATOM 2970 O O . ALA B 2 79 ? 1.916 -116.420 -17.711 1.00 55.04 ? 79 ALA B O 1 ATOM 2971 C CB . ALA B 2 79 ? -0.080 -118.374 -15.820 1.00 55.40 ? 79 ALA B CB 1 ATOM 2972 N N . CYS B 2 80 ? 0.233 -117.501 -18.747 1.00 54.97 ? 80 CYS B N 1 ATOM 2973 C CA . CYS B 2 80 ? 0.018 -116.477 -19.757 1.00 54.76 ? 80 CYS B CA 1 ATOM 2974 C C . CYS B 2 80 ? -1.451 -116.089 -19.755 1.00 55.39 ? 80 CYS B C 1 ATOM 2975 O O . CYS B 2 80 ? -2.324 -116.917 -20.027 1.00 55.55 ? 80 CYS B O 1 ATOM 2976 C CB . CYS B 2 80 ? 0.431 -116.990 -21.136 1.00 54.34 ? 80 CYS B CB 1 ATOM 2977 S SG . CYS B 2 80 ? 0.487 -115.736 -22.435 1.00 51.79 ? 80 CYS B SG 1 ATOM 2978 N N . ARG B 2 81 ? -1.716 -114.828 -19.429 1.00 56.02 ? 81 ARG B N 1 ATOM 2979 C CA . ARG B 2 81 ? -3.075 -114.311 -19.341 1.00 56.65 ? 81 ARG B CA 1 ATOM 2980 C C . ARG B 2 81 ? -3.394 -113.391 -20.517 1.00 56.81 ? 81 ARG B C 1 ATOM 2981 O O . ARG B 2 81 ? -2.650 -112.460 -20.818 1.00 56.96 ? 81 ARG B O 1 ATOM 2982 C CB . ARG B 2 81 ? -3.265 -113.571 -18.019 1.00 56.77 ? 81 ARG B CB 1 ATOM 2983 C CG . ARG B 2 81 ? -4.662 -113.046 -17.803 1.00 58.02 ? 81 ARG B CG 1 ATOM 2984 C CD . ARG B 2 81 ? -4.981 -112.975 -16.330 1.00 60.68 ? 81 ARG B CD 1 ATOM 2985 N NE . ARG B 2 81 ? -4.114 -112.036 -15.628 1.00 62.88 ? 81 ARG B NE 1 ATOM 2986 C CZ . ARG B 2 81 ? -4.421 -110.763 -15.385 1.00 64.23 ? 81 ARG B CZ 1 ATOM 2987 N NH1 . ARG B 2 81 ? -5.588 -110.260 -15.791 1.00 64.55 ? 81 ARG B NH1 1 ATOM 2988 N NH2 . ARG B 2 81 ? -3.557 -109.989 -14.728 1.00 64.72 ? 81 ARG B NH2 1 ATOM 2989 N N . VAL B 2 82 ? -4.511 -113.658 -21.175 1.00 57.06 ? 82 VAL B N 1 ATOM 2990 C CA . VAL B 2 82 ? -4.917 -112.876 -22.333 1.00 57.35 ? 82 VAL B CA 1 ATOM 2991 C C . VAL B 2 82 ? -6.217 -112.120 -22.044 1.00 57.57 ? 82 VAL B C 1 ATOM 2992 O O . VAL B 2 82 ? -7.131 -112.662 -21.420 1.00 57.56 ? 82 VAL B O 1 ATOM 2993 C CB . VAL B 2 82 ? -5.053 -113.790 -23.581 1.00 57.30 ? 82 VAL B CB 1 ATOM 2994 C CG1 . VAL B 2 82 ? -5.737 -113.077 -24.727 1.00 57.30 ? 82 VAL B CG1 1 ATOM 2995 C CG2 . VAL B 2 82 ? -3.685 -114.289 -24.018 1.00 57.35 ? 82 VAL B CG2 1 ATOM 2996 N N . LYS B 2 83 ? -6.277 -110.860 -22.471 1.00 57.88 ? 83 LYS B N 1 ATOM 2997 C CA . LYS B 2 83 ? -7.530 -110.100 -22.484 1.00 58.34 ? 83 LYS B CA 1 ATOM 2998 C C . LYS B 2 83 ? -7.924 -109.780 -23.915 1.00 58.44 ? 83 LYS B C 1 ATOM 2999 O O . LYS B 2 83 ? -7.179 -109.125 -24.641 1.00 58.72 ? 83 LYS B O 1 ATOM 3000 C CB . LYS B 2 83 ? -7.421 -108.808 -21.674 1.00 58.39 ? 83 LYS B CB 1 ATOM 3001 C CG . LYS B 2 83 ? -7.683 -108.984 -20.196 1.00 59.08 ? 83 LYS B CG 1 ATOM 3002 C CD . LYS B 2 83 ? -7.228 -107.768 -19.390 1.00 60.35 ? 83 LYS B CD 1 ATOM 3003 C CE . LYS B 2 83 ? -7.215 -108.083 -17.894 0.81 60.97 ? 83 LYS B CE 1 ATOM 3004 N NZ . LYS B 2 83 ? -7.117 -106.869 -17.038 1.00 61.14 ? 83 LYS B NZ 1 ATOM 3005 N N . HIS B 2 84 ? -9.100 -110.255 -24.309 1.00 58.44 ? 84 HIS B N 1 ATOM 3006 C CA . HIS B 2 84 ? -9.624 -110.044 -25.648 1.00 58.51 ? 84 HIS B CA 1 ATOM 3007 C C . HIS B 2 84 ? -11.132 -109.810 -25.558 1.00 58.64 ? 84 HIS B C 1 ATOM 3008 O O . HIS B 2 84 ? -11.776 -110.251 -24.604 1.00 58.91 ? 84 HIS B O 1 ATOM 3009 C CB . HIS B 2 84 ? -9.300 -111.255 -26.524 1.00 58.39 ? 84 HIS B CB 1 ATOM 3010 C CG . HIS B 2 84 ? -9.690 -111.094 -27.960 1.00 58.41 ? 84 HIS B CG 1 ATOM 3011 N ND1 . HIS B 2 84 ? -9.104 -110.164 -28.792 1.00 57.92 ? 84 HIS B ND1 1 ATOM 3012 C CD2 . HIS B 2 84 ? -10.598 -111.757 -28.716 1.00 58.15 ? 84 HIS B CD2 1 ATOM 3013 C CE1 . HIS B 2 84 ? -9.639 -110.258 -29.996 1.00 57.96 ? 84 HIS B CE1 1 ATOM 3014 N NE2 . HIS B 2 84 ? -10.545 -111.219 -29.978 1.00 57.98 ? 84 HIS B NE2 1 ATOM 3015 N N . ALA B 2 85 ? -11.691 -109.109 -26.541 1.00 58.61 ? 85 ALA B N 1 ATOM 3016 C CA . ALA B 2 85 ? -13.108 -108.749 -26.526 1.00 58.54 ? 85 ALA B CA 1 ATOM 3017 C C . ALA B 2 85 ? -14.057 -109.943 -26.646 1.00 58.51 ? 85 ALA B C 1 ATOM 3018 O O . ALA B 2 85 ? -15.141 -109.929 -26.066 1.00 58.31 ? 85 ALA B O 1 ATOM 3019 C CB . ALA B 2 85 ? -13.395 -107.736 -27.606 1.00 58.67 ? 85 ALA B CB 1 ATOM 3020 N N . SER B 2 86 ? -13.642 -110.972 -27.386 1.00 58.65 ? 86 SER B N 1 ATOM 3021 C CA . SER B 2 86 ? -14.439 -112.193 -27.556 1.00 58.76 ? 86 SER B CA 1 ATOM 3022 C C . SER B 2 86 ? -14.464 -113.025 -26.275 1.00 58.93 ? 86 SER B C 1 ATOM 3023 O O . SER B 2 86 ? -14.925 -114.172 -26.270 1.00 59.01 ? 86 SER B O 1 ATOM 3024 C CB . SER B 2 86 ? -13.894 -113.041 -28.708 1.00 58.77 ? 86 SER B CB 1 ATOM 3025 O OG . SER B 2 86 ? -12.824 -113.869 -28.281 1.00 58.58 ? 86 SER B OG 1 ATOM 3026 N N . MET B 2 87 ? -13.942 -112.441 -25.201 1.00 58.99 ? 87 MET B N 1 ATOM 3027 C CA . MET B 2 87 ? -13.941 -113.063 -23.890 1.00 59.12 ? 87 MET B CA 1 ATOM 3028 C C . MET B 2 87 ? -14.392 -112.041 -22.854 1.00 59.09 ? 87 MET B C 1 ATOM 3029 O O . MET B 2 87 ? -13.788 -110.971 -22.715 1.00 59.02 ? 87 MET B O 1 ATOM 3030 C CB . MET B 2 87 ? -12.546 -113.576 -23.546 1.00 59.20 ? 87 MET B CB 1 ATOM 3031 C CG . MET B 2 87 ? -12.117 -114.828 -24.294 1.00 59.92 ? 87 MET B CG 1 ATOM 3032 S SD . MET B 2 87 ? -10.326 -115.065 -24.161 1.00 61.43 ? 87 MET B SD 1 ATOM 3033 C CE . MET B 2 87 ? -10.186 -116.796 -24.622 1.00 62.04 ? 87 MET B CE 1 ATOM 3034 N N . ALA B 2 88 ? -15.464 -112.374 -22.137 1.00 59.09 ? 88 ALA B N 1 ATOM 3035 C CA . ALA B 2 88 ? -15.984 -111.521 -21.070 1.00 58.99 ? 88 ALA B CA 1 ATOM 3036 C C . ALA B 2 88 ? -14.968 -111.432 -19.942 1.00 58.87 ? 88 ALA B C 1 ATOM 3037 O O . ALA B 2 88 ? -14.770 -110.374 -19.349 1.00 59.05 ? 88 ALA B O 1 ATOM 3038 C CB . ALA B 2 88 ? -17.307 -112.065 -20.553 1.00 59.08 ? 88 ALA B CB 1 ATOM 3039 N N . GLU B 2 89 ? -14.314 -112.555 -19.674 1.00 58.61 ? 89 GLU B N 1 ATOM 3040 C CA . GLU B 2 89 ? -13.309 -112.656 -18.628 1.00 58.45 ? 89 GLU B CA 1 ATOM 3041 C C . GLU B 2 89 ? -11.939 -112.977 -19.235 1.00 57.94 ? 89 GLU B C 1 ATOM 3042 O O . GLU B 2 89 ? -11.867 -113.677 -20.245 1.00 58.23 ? 89 GLU B O 1 ATOM 3043 C CB . GLU B 2 89 ? -13.723 -113.751 -17.638 1.00 58.66 ? 89 GLU B CB 1 ATOM 3044 C CG . GLU B 2 89 ? -14.995 -113.429 -16.857 1.00 59.48 ? 89 GLU B CG 1 ATOM 3045 C CD . GLU B 2 89 ? -14.762 -112.400 -15.751 1.00 60.68 ? 89 GLU B CD 1 ATOM 3046 O OE1 . GLU B 2 89 ? -13.890 -112.645 -14.885 1.00 61.42 ? 89 GLU B OE1 1 ATOM 3047 O OE2 . GLU B 2 89 ? -15.449 -111.352 -15.743 1.00 60.63 ? 89 GLU B OE2 1 ATOM 3048 N N . PRO B 2 90 ? -10.846 -112.475 -18.631 1.00 57.29 ? 90 PRO B N 1 ATOM 3049 C CA . PRO B 2 90 ? -9.525 -112.851 -19.132 1.00 56.87 ? 90 PRO B CA 1 ATOM 3050 C C . PRO B 2 90 ? -9.321 -114.355 -19.037 1.00 56.60 ? 90 PRO B C 1 ATOM 3051 O O . PRO B 2 90 ? -9.881 -114.990 -18.145 1.00 56.89 ? 90 PRO B O 1 ATOM 3052 C CB . PRO B 2 90 ? -8.573 -112.130 -18.181 1.00 56.89 ? 90 PRO B CB 1 ATOM 3053 C CG . PRO B 2 90 ? -9.357 -110.990 -17.648 1.00 56.92 ? 90 PRO B CG 1 ATOM 3054 C CD . PRO B 2 90 ? -10.757 -111.496 -17.535 1.00 57.29 ? 90 PRO B CD 1 ATOM 3055 N N . LYS B 2 91 ? -8.553 -114.923 -19.962 1.00 56.19 ? 91 LYS B N 1 ATOM 3056 C CA . LYS B 2 91 ? -8.267 -116.360 -19.954 1.00 55.72 ? 91 LYS B CA 1 ATOM 3057 C C . LYS B 2 91 ? -6.809 -116.596 -19.599 1.00 55.44 ? 91 LYS B C 1 ATOM 3058 O O . LYS B 2 91 ? -5.907 -116.179 -20.329 1.00 55.61 ? 91 LYS B O 1 ATOM 3059 C CB . LYS B 2 91 ? -8.594 -116.997 -21.309 1.00 55.65 ? 91 LYS B CB 1 ATOM 3060 C CG . LYS B 2 91 ? -8.050 -118.410 -21.506 1.00 55.86 ? 91 LYS B CG 1 ATOM 3061 C CD . LYS B 2 91 ? -8.918 -119.465 -20.821 1.00 56.82 ? 91 LYS B CD 1 ATOM 3062 C CE . LYS B 2 91 ? -8.314 -120.853 -20.982 1.00 57.06 ? 91 LYS B CE 1 ATOM 3063 N NZ . LYS B 2 91 ? -9.319 -121.945 -20.879 1.00 57.35 ? 91 LYS B NZ 1 ATOM 3064 N N . THR B 2 92 ? -6.580 -117.257 -18.471 1.00 54.89 ? 92 THR B N 1 ATOM 3065 C CA . THR B 2 92 ? -5.227 -117.541 -18.037 1.00 54.37 ? 92 THR B CA 1 ATOM 3066 C C . THR B 2 92 ? -4.907 -118.992 -18.335 1.00 54.18 ? 92 THR B C 1 ATOM 3067 O O . THR B 2 92 ? -5.700 -119.881 -18.022 1.00 54.47 ? 92 THR B O 1 ATOM 3068 C CB . THR B 2 92 ? -5.054 -117.250 -16.548 1.00 54.34 ? 92 THR B CB 1 ATOM 3069 O OG1 . THR B 2 92 ? -5.416 -115.892 -16.287 1.00 54.23 ? 92 THR B OG1 1 ATOM 3070 C CG2 . THR B 2 92 ? -3.619 -117.454 -16.122 1.00 54.51 ? 92 THR B CG2 1 ATOM 3071 N N . VAL B 2 93 ? -3.757 -119.221 -18.963 1.00 53.75 ? 93 VAL B N 1 ATOM 3072 C CA . VAL B 2 93 ? -3.281 -120.569 -19.264 1.00 53.26 ? 93 VAL B CA 1 ATOM 3073 C C . VAL B 2 93 ? -1.948 -120.780 -18.565 1.00 53.02 ? 93 VAL B C 1 ATOM 3074 O O . VAL B 2 93 ? -1.061 -119.935 -18.654 1.00 52.83 ? 93 VAL B O 1 ATOM 3075 C CB . VAL B 2 93 ? -3.112 -120.786 -20.774 1.00 53.21 ? 93 VAL B CB 1 ATOM 3076 C CG1 . VAL B 2 93 ? -2.645 -122.197 -21.057 1.00 53.18 ? 93 VAL B CG1 1 ATOM 3077 C CG2 . VAL B 2 93 ? -4.412 -120.498 -21.503 1.00 53.05 ? 93 VAL B CG2 1 ATOM 3078 N N . TYR B 2 94 ? -1.816 -121.904 -17.865 1.00 52.82 ? 94 TYR B N 1 ATOM 3079 C CA . TYR B 2 94 ? -0.615 -122.187 -17.088 1.00 52.58 ? 94 TYR B CA 1 ATOM 3080 C C . TYR B 2 94 ? 0.370 -123.041 -17.861 1.00 52.60 ? 94 TYR B C 1 ATOM 3081 O O . TYR B 2 94 ? -0.028 -123.944 -18.608 1.00 52.69 ? 94 TYR B O 1 ATOM 3082 C CB . TYR B 2 94 ? -0.982 -122.857 -15.765 1.00 52.43 ? 94 TYR B CB 1 ATOM 3083 C CG . TYR B 2 94 ? -1.573 -121.887 -14.775 1.00 52.42 ? 94 TYR B CG 1 ATOM 3084 C CD1 . TYR B 2 94 ? -2.941 -121.604 -14.774 1.00 52.38 ? 94 TYR B CD1 1 ATOM 3085 C CD2 . TYR B 2 94 ? -0.764 -121.229 -13.850 1.00 52.20 ? 94 TYR B CD2 1 ATOM 3086 C CE1 . TYR B 2 94 ? -3.488 -120.691 -13.869 1.00 51.60 ? 94 TYR B CE1 1 ATOM 3087 C CE2 . TYR B 2 94 ? -1.303 -120.316 -12.943 1.00 51.62 ? 94 TYR B CE2 1 ATOM 3088 C CZ . TYR B 2 94 ? -2.660 -120.055 -12.961 1.00 51.18 ? 94 TYR B CZ 1 ATOM 3089 O OH . TYR B 2 94 ? -3.184 -119.155 -12.070 1.00 50.81 ? 94 TYR B OH 1 ATOM 3090 N N . TRP B 2 95 ? 1.657 -122.737 -17.694 1.00 52.50 ? 95 TRP B N 1 ATOM 3091 C CA . TRP B 2 95 ? 2.720 -123.553 -18.279 1.00 52.34 ? 95 TRP B CA 1 ATOM 3092 C C . TRP B 2 95 ? 2.679 -124.916 -17.622 1.00 52.49 ? 95 TRP B C 1 ATOM 3093 O O . TRP B 2 95 ? 2.544 -125.020 -16.403 1.00 52.61 ? 95 TRP B O 1 ATOM 3094 C CB . TRP B 2 95 ? 4.104 -122.910 -18.095 1.00 52.11 ? 95 TRP B CB 1 ATOM 3095 C CG . TRP B 2 95 ? 5.207 -123.688 -18.740 1.00 50.99 ? 95 TRP B CG 1 ATOM 3096 C CD1 . TRP B 2 95 ? 5.232 -124.156 -20.016 1.00 51.12 ? 95 TRP B CD1 1 ATOM 3097 C CD2 . TRP B 2 95 ? 6.443 -124.088 -18.143 1.00 50.70 ? 95 TRP B CD2 1 ATOM 3098 N NE1 . TRP B 2 95 ? 6.405 -124.829 -20.260 1.00 51.05 ? 95 TRP B NE1 1 ATOM 3099 C CE2 . TRP B 2 95 ? 7.169 -124.803 -19.125 1.00 51.04 ? 95 TRP B CE2 1 ATOM 3100 C CE3 . TRP B 2 95 ? 7.011 -123.915 -16.876 1.00 50.79 ? 95 TRP B CE3 1 ATOM 3101 C CZ2 . TRP B 2 95 ? 8.439 -125.347 -18.878 1.00 50.72 ? 95 TRP B CZ2 1 ATOM 3102 C CZ3 . TRP B 2 95 ? 8.271 -124.457 -16.631 1.00 50.68 ? 95 TRP B CZ3 1 ATOM 3103 C CH2 . TRP B 2 95 ? 8.969 -125.166 -17.629 1.00 50.39 ? 95 TRP B CH2 1 ATOM 3104 N N . ASP B 2 96 ? 2.766 -125.955 -18.436 1.00 52.60 ? 96 ASP B N 1 ATOM 3105 C CA . ASP B 2 96 ? 2.778 -127.312 -17.935 1.00 52.87 ? 96 ASP B CA 1 ATOM 3106 C C . ASP B 2 96 ? 3.817 -128.042 -18.751 1.00 52.90 ? 96 ASP B C 1 ATOM 3107 O O . ASP B 2 96 ? 3.562 -128.431 -19.888 1.00 52.99 ? 96 ASP B O 1 ATOM 3108 C CB . ASP B 2 96 ? 1.392 -127.934 -18.094 1.00 53.10 ? 96 ASP B CB 1 ATOM 3109 C CG . ASP B 2 96 ? 1.334 -129.390 -17.659 1.00 53.97 ? 96 ASP B CG 1 ATOM 3110 O OD1 . ASP B 2 96 ? 2.352 -130.113 -17.767 1.00 54.70 ? 96 ASP B OD1 1 ATOM 3111 O OD2 . ASP B 2 96 ? 0.240 -129.815 -17.222 1.00 54.91 ? 96 ASP B OD2 1 ATOM 3112 N N . ARG B 2 97 ? 4.993 -128.217 -18.161 1.00 53.14 ? 97 ARG B N 1 ATOM 3113 C CA . ARG B 2 97 ? 6.165 -128.720 -18.880 1.00 53.37 ? 97 ARG B CA 1 ATOM 3114 C C . ARG B 2 97 ? 6.006 -130.136 -19.415 1.00 53.59 ? 97 ARG B C 1 ATOM 3115 O O . ARG B 2 97 ? 6.797 -130.574 -20.252 1.00 53.77 ? 97 ARG B O 1 ATOM 3116 C CB . ARG B 2 97 ? 7.414 -128.627 -17.998 1.00 53.39 ? 97 ARG B CB 1 ATOM 3117 C CG . ARG B 2 97 ? 7.289 -129.315 -16.653 1.00 53.57 ? 97 ARG B CG 1 ATOM 3118 C CD . ARG B 2 97 ? 8.372 -128.858 -15.696 1.00 53.84 ? 97 ARG B CD 1 ATOM 3119 N NE . ARG B 2 97 ? 8.058 -127.560 -15.100 1.00 54.06 ? 97 ARG B NE 1 ATOM 3120 C CZ . ARG B 2 97 ? 8.726 -127.014 -14.085 1.00 54.20 ? 97 ARG B CZ 1 ATOM 3121 N NH1 . ARG B 2 97 ? 9.751 -127.652 -13.537 1.00 54.27 ? 97 ARG B NH1 1 ATOM 3122 N NH2 . ARG B 2 97 ? 8.366 -125.827 -13.611 1.00 54.47 ? 97 ARG B NH2 1 ATOM 3123 N N . ASP B 2 98 ? 4.975 -130.835 -18.944 1.00 53.83 ? 98 ASP B N 1 ATOM 3124 C CA . ASP B 2 98 ? 4.775 -132.246 -19.268 1.00 54.02 ? 98 ASP B CA 1 ATOM 3125 C C . ASP B 2 98 ? 3.877 -132.509 -20.486 1.00 54.08 ? 98 ASP B C 1 ATOM 3126 O O . ASP B 2 98 ? 3.896 -133.610 -21.040 1.00 53.93 ? 98 ASP B O 1 ATOM 3127 C CB . ASP B 2 98 ? 4.269 -133.006 -18.036 1.00 54.13 ? 98 ASP B CB 1 ATOM 3128 C CG . ASP B 2 98 ? 5.319 -133.115 -16.942 1.00 54.27 ? 98 ASP B CG 1 ATOM 3129 O OD1 . ASP B 2 98 ? 6.400 -133.694 -17.192 1.00 53.93 ? 98 ASP B OD1 1 ATOM 3130 O OD2 . ASP B 2 98 ? 5.053 -132.627 -15.824 1.00 55.25 ? 98 ASP B OD2 1 ATOM 3131 N N . MET B 2 99 ? 3.101 -131.510 -20.900 1.00 54.41 ? 99 MET B N 1 ATOM 3132 C CA . MET B 2 99 ? 2.250 -131.645 -22.091 1.00 54.79 ? 99 MET B CA 1 ATOM 3133 C C . MET B 2 99 ? 2.571 -130.624 -23.177 1.00 54.76 ? 99 MET B C 1 ATOM 3134 O O . MET B 2 99 ? 3.739 -130.353 -23.447 1.00 54.76 ? 99 MET B O 1 ATOM 3135 C CB . MET B 2 99 ? 0.758 -131.615 -21.726 1.00 54.96 ? 99 MET B CB 1 ATOM 3136 C CG . MET B 2 99 ? 0.215 -130.281 -21.220 1.00 55.13 ? 99 MET B CG 1 ATOM 3137 S SD . MET B 2 99 ? -1.390 -130.511 -20.425 1.00 57.00 ? 99 MET B SD 1 ATOM 3138 C CE . MET B 2 99 ? -2.362 -131.302 -21.723 1.00 55.60 ? 99 MET B CE 1 ATOM 3139 N N . THR C 3 1 ? -1.750 -70.741 -47.687 1.00 69.87 ? 1 THR C N 1 ATOM 3140 C CA . THR C 3 1 ? -2.285 -72.133 -47.720 1.00 69.91 ? 1 THR C CA 1 ATOM 3141 C C . THR C 3 1 ? -1.268 -73.082 -48.360 1.00 69.67 ? 1 THR C C 1 ATOM 3142 O O . THR C 3 1 ? -0.065 -72.924 -48.158 1.00 69.73 ? 1 THR C O 1 ATOM 3143 C CB . THR C 3 1 ? -3.676 -72.195 -48.427 1.00 70.10 ? 1 THR C CB 1 ATOM 3144 O OG1 . THR C 3 1 ? -4.118 -73.556 -48.544 1.00 70.22 ? 1 THR C OG1 1 ATOM 3145 C CG2 . THR C 3 1 ? -3.627 -71.547 -49.815 1.00 70.49 ? 1 THR C CG2 1 ATOM 3146 N N . GLN C 3 2 ? -1.754 -74.060 -49.120 1.00 69.40 ? 2 GLN C N 1 ATOM 3147 C CA . GLN C 3 2 ? -0.895 -75.029 -49.788 1.00 69.19 ? 2 GLN C CA 1 ATOM 3148 C C . GLN C 3 2 ? -0.873 -74.811 -51.296 1.00 69.09 ? 2 GLN C C 1 ATOM 3149 O O . GLN C 3 2 ? -0.260 -75.588 -52.035 1.00 68.91 ? 2 GLN C O 1 ATOM 3150 C CB . GLN C 3 2 ? -1.338 -76.447 -49.450 1.00 69.23 ? 2 GLN C CB 1 ATOM 3151 C CG . GLN C 3 2 ? -1.251 -76.771 -47.972 1.00 69.31 ? 2 GLN C CG 1 ATOM 3152 C CD . GLN C 3 2 ? -1.093 -78.248 -47.725 1.00 69.62 ? 2 GLN C CD 1 ATOM 3153 O OE1 . GLN C 3 2 ? -2.052 -79.020 -47.841 1.00 69.70 ? 2 GLN C OE1 1 ATOM 3154 N NE2 . GLN C 3 2 ? 0.127 -78.658 -47.385 1.00 69.44 ? 2 GLN C NE2 1 ATOM 3155 N N . VAL C 3 3 ? -1.554 -73.748 -51.729 1.00 69.01 ? 3 VAL C N 1 ATOM 3156 C CA . VAL C 3 3 ? -1.555 -73.289 -53.117 1.00 68.87 ? 3 VAL C CA 1 ATOM 3157 C C . VAL C 3 3 ? -1.305 -71.782 -53.121 1.00 69.00 ? 3 VAL C C 1 ATOM 3158 O O . VAL C 3 3 ? -2.136 -71.010 -52.634 1.00 68.99 ? 3 VAL C O 1 ATOM 3159 C CB . VAL C 3 3 ? -2.899 -73.573 -53.827 1.00 68.77 ? 3 VAL C CB 1 ATOM 3160 C CG1 . VAL C 3 3 ? -2.778 -73.325 -55.319 1.00 68.37 ? 3 VAL C CG1 1 ATOM 3161 C CG2 . VAL C 3 3 ? -3.366 -75.000 -53.570 1.00 68.86 ? 3 VAL C CG2 1 ATOM 3162 N N . GLU C 3 4 ? -0.155 -71.375 -53.661 1.00 69.16 ? 4 GLU C N 1 ATOM 3163 C CA . GLU C 3 4 ? 0.221 -69.960 -53.768 1.00 69.21 ? 4 GLU C CA 1 ATOM 3164 C C . GLU C 3 4 ? 0.159 -69.517 -55.226 1.00 68.90 ? 4 GLU C C 1 ATOM 3165 O O . GLU C 3 4 ? 0.809 -70.102 -56.090 1.00 68.84 ? 4 GLU C O 1 ATOM 3166 C CB . GLU C 3 4 ? 1.633 -69.701 -53.203 1.00 69.40 ? 4 GLU C CB 1 ATOM 3167 C CG . GLU C 3 4 ? 1.906 -70.201 -51.764 1.00 70.57 ? 4 GLU C CG 1 ATOM 3168 C CD . GLU C 3 4 ? 2.663 -71.555 -51.682 1.00 72.26 ? 4 GLU C CD 1 ATOM 3169 O OE1 . GLU C 3 4 ? 2.990 -72.165 -52.734 1.00 72.73 ? 4 GLU C OE1 1 ATOM 3170 O OE2 . GLU C 3 4 ? 2.936 -72.011 -50.543 1.00 72.41 ? 4 GLU C OE2 1 ATOM 3171 N N . GLN C 3 5 ? -0.636 -68.492 -55.499 1.00 68.77 ? 5 GLN C N 1 ATOM 3172 C CA . GLN C 3 5 ? -0.704 -67.928 -56.840 1.00 68.79 ? 5 GLN C CA 1 ATOM 3173 C C . GLN C 3 5 ? 0.027 -66.589 -56.903 1.00 68.74 ? 5 GLN C C 1 ATOM 3174 O O . GLN C 3 5 ? -0.088 -65.774 -55.990 1.00 68.70 ? 5 GLN C O 1 ATOM 3175 C CB . GLN C 3 5 ? -2.156 -67.762 -57.280 1.00 68.83 ? 5 GLN C CB 1 ATOM 3176 C CG . GLN C 3 5 ? -2.875 -69.068 -57.576 1.00 69.14 ? 5 GLN C CG 1 ATOM 3177 C CD . GLN C 3 5 ? -4.179 -68.872 -58.337 1.00 69.72 ? 5 GLN C CD 1 ATOM 3178 O OE1 . GLN C 3 5 ? -5.244 -69.295 -57.883 1.00 69.55 ? 5 GLN C OE1 1 ATOM 3179 N NE2 . GLN C 3 5 ? -4.100 -68.235 -59.504 1.00 70.16 ? 5 GLN C NE2 1 ATOM 3180 N N . SER C 3 6 ? 0.776 -66.369 -57.981 1.00 68.83 ? 6 SER C N 1 ATOM 3181 C CA . SER C 3 6 ? 1.513 -65.113 -58.183 1.00 68.84 ? 6 SER C CA 1 ATOM 3182 C C . SER C 3 6 ? 1.372 -64.566 -59.616 1.00 68.83 ? 6 SER C C 1 ATOM 3183 O O . SER C 3 6 ? 1.282 -65.347 -60.576 1.00 69.05 ? 6 SER C O 1 ATOM 3184 C CB . SER C 3 6 ? 2.992 -65.300 -57.838 1.00 68.91 ? 6 SER C CB 1 ATOM 3185 O OG . SER C 3 6 ? 3.609 -66.230 -58.717 1.00 69.04 ? 6 SER C OG 1 ATOM 3186 N N . PRO C 3 7 ? 1.316 -63.225 -59.767 1.00 68.56 ? 7 PRO C N 1 ATOM 3187 C CA . PRO C 3 7 ? 1.214 -62.251 -58.685 1.00 68.28 ? 7 PRO C CA 1 ATOM 3188 C C . PRO C 3 7 ? -0.246 -62.076 -58.282 1.00 68.01 ? 7 PRO C C 1 ATOM 3189 O O . PRO C 3 7 ? -1.114 -62.750 -58.831 1.00 67.88 ? 7 PRO C O 1 ATOM 3190 C CB . PRO C 3 7 ? 1.761 -60.977 -59.320 1.00 68.39 ? 7 PRO C CB 1 ATOM 3191 C CG . PRO C 3 7 ? 1.419 -61.106 -60.768 1.00 68.51 ? 7 PRO C CG 1 ATOM 3192 C CD . PRO C 3 7 ? 1.352 -62.574 -61.091 1.00 68.52 ? 7 PRO C CD 1 ATOM 3193 N N . GLN C 3 8 ? -0.516 -61.181 -57.338 1.00 67.81 ? 8 GLN C N 1 ATOM 3194 C CA . GLN C 3 8 ? -1.863 -61.034 -56.784 1.00 67.72 ? 8 GLN C CA 1 ATOM 3195 C C . GLN C 3 8 ? -2.761 -60.306 -57.779 1.00 67.47 ? 8 GLN C C 1 ATOM 3196 O O . GLN C 3 8 ? -3.986 -60.480 -57.779 1.00 67.51 ? 8 GLN C O 1 ATOM 3197 C CB . GLN C 3 8 ? -1.838 -60.288 -55.439 1.00 67.82 ? 8 GLN C CB 1 ATOM 3198 C CG . GLN C 3 8 ? -0.467 -60.231 -54.730 1.00 68.82 ? 8 GLN C CG 1 ATOM 3199 C CD . GLN C 3 8 ? 0.211 -61.598 -54.568 1.00 69.76 ? 8 GLN C CD 1 ATOM 3200 O OE1 . GLN C 3 8 ? -0.402 -62.559 -54.102 1.00 70.28 ? 8 GLN C OE1 1 ATOM 3201 N NE2 . GLN C 3 8 ? 1.485 -61.681 -54.954 1.00 69.47 ? 8 GLN C NE2 1 ATOM 3202 N N . SER C 3 9 ? -2.134 -59.501 -58.631 1.00 67.01 ? 9 SER C N 1 ATOM 3203 C CA . SER C 3 9 ? -2.841 -58.702 -59.609 1.00 66.59 ? 9 SER C CA 1 ATOM 3204 C C . SER C 3 9 ? -1.971 -58.539 -60.850 1.00 66.35 ? 9 SER C C 1 ATOM 3205 O O . SER C 3 9 ? -0.790 -58.200 -60.747 1.00 66.45 ? 9 SER C O 1 ATOM 3206 C CB . SER C 3 9 ? -3.169 -57.335 -59.007 1.00 66.66 ? 9 SER C CB 1 ATOM 3207 O OG . SER C 3 9 ? -4.273 -56.734 -59.659 1.00 66.81 ? 9 SER C OG 1 ATOM 3208 N N . LEU C 3 10 ? -2.542 -58.799 -62.022 1.00 65.91 ? 10 LEU C N 1 ATOM 3209 C CA . LEU C 3 10 ? -1.814 -58.586 -63.265 1.00 65.44 ? 10 LEU C CA 1 ATOM 3210 C C . LEU C 3 10 ? -2.487 -57.518 -64.097 1.00 65.19 ? 10 LEU C C 1 ATOM 3211 O O . LEU C 3 10 ? -3.710 -57.384 -64.080 1.00 64.88 ? 10 LEU C O 1 ATOM 3212 C CB . LEU C 3 10 ? -1.672 -59.879 -64.073 1.00 65.39 ? 10 LEU C CB 1 ATOM 3213 C CG . LEU C 3 10 ? -0.607 -59.874 -65.180 1.00 65.26 ? 10 LEU C CG 1 ATOM 3214 C CD1 . LEU C 3 10 ? 0.803 -59.677 -64.623 1.00 65.20 ? 10 LEU C CD1 1 ATOM 3215 C CD2 . LEU C 3 10 ? -0.665 -61.147 -65.990 1.00 65.68 ? 10 LEU C CD2 1 ATOM 3216 N N . VAL C 3 11 ? -1.662 -56.755 -64.809 1.00 65.13 ? 11 VAL C N 1 ATOM 3217 C CA . VAL C 3 11 ? -2.118 -55.730 -65.741 1.00 64.95 ? 11 VAL C CA 1 ATOM 3218 C C . VAL C 3 11 ? -1.461 -55.955 -67.104 1.00 64.75 ? 11 VAL C C 1 ATOM 3219 O O . VAL C 3 11 ? -0.237 -56.041 -67.212 1.00 64.55 ? 11 VAL C O 1 ATOM 3220 C CB . VAL C 3 11 ? -1.798 -54.309 -65.227 1.00 64.90 ? 11 VAL C CB 1 ATOM 3221 C CG1 . VAL C 3 11 ? -2.282 -53.272 -66.212 1.00 65.24 ? 11 VAL C CG1 1 ATOM 3222 C CG2 . VAL C 3 11 ? -2.435 -54.066 -63.865 1.00 64.95 ? 11 VAL C CG2 1 ATOM 3223 N N . VAL C 3 12 ? -2.280 -56.067 -68.142 1.00 64.66 ? 12 VAL C N 1 ATOM 3224 C CA . VAL C 3 12 ? -1.752 -56.286 -69.479 1.00 64.77 ? 12 VAL C CA 1 ATOM 3225 C C . VAL C 3 12 ? -2.568 -55.478 -70.501 1.00 64.69 ? 12 VAL C C 1 ATOM 3226 O O . VAL C 3 12 ? -3.740 -55.168 -70.252 1.00 64.59 ? 12 VAL C O 1 ATOM 3227 C CB . VAL C 3 12 ? -1.656 -57.819 -69.804 1.00 64.85 ? 12 VAL C CB 1 ATOM 3228 C CG1 . VAL C 3 12 ? -2.930 -58.357 -70.481 1.00 64.85 ? 12 VAL C CG1 1 ATOM 3229 C CG2 . VAL C 3 12 ? -0.411 -58.124 -70.637 1.00 65.02 ? 12 VAL C CG2 1 ATOM 3230 N N . ARG C 3 13 ? -1.921 -55.091 -71.595 1.00 64.51 ? 13 ARG C N 1 ATOM 3231 C CA . ARG C 3 13 ? -2.594 -54.417 -72.694 1.00 64.42 ? 13 ARG C CA 1 ATOM 3232 C C . ARG C 3 13 ? -3.449 -55.404 -73.478 1.00 64.12 ? 13 ARG C C 1 ATOM 3233 O O . ARG C 3 13 ? -3.078 -56.567 -73.637 1.00 63.78 ? 13 ARG C O 1 ATOM 3234 C CB . ARG C 3 13 ? -1.574 -53.752 -73.620 1.00 64.69 ? 13 ARG C CB 1 ATOM 3235 C CG . ARG C 3 13 ? -1.315 -52.287 -73.307 1.00 65.14 ? 13 ARG C CG 1 ATOM 3236 C CD . ARG C 3 13 ? -0.116 -51.761 -74.080 1.00 65.34 ? 13 ARG C CD 1 ATOM 3237 N NE . ARG C 3 13 ? 0.874 -51.147 -73.201 0.00 70.79 ? 13 ARG C NE 1 ATOM 3238 C CZ . ARG C 3 13 ? 2.177 -51.100 -73.460 0.00 72.53 ? 13 ARG C CZ 1 ATOM 3239 N NH1 . ARG C 3 13 ? 2.652 -51.633 -74.577 1.00 65.67 ? 13 ARG C NH1 1 ATOM 3240 N NH2 . ARG C 3 13 ? 3.005 -50.520 -72.603 1.00 71.66 ? 13 ARG C NH2 1 ATOM 3241 N N . GLN C 3 14 ? -4.588 -54.937 -73.976 1.00 63.94 ? 14 GLN C N 1 ATOM 3242 C CA . GLN C 3 14 ? -5.420 -55.754 -74.847 1.00 64.11 ? 14 GLN C CA 1 ATOM 3243 C C . GLN C 3 14 ? -4.625 -56.233 -76.058 1.00 63.93 ? 14 GLN C C 1 ATOM 3244 O O . GLN C 3 14 ? -3.938 -55.447 -76.703 1.00 64.26 ? 14 GLN C O 1 ATOM 3245 C CB . GLN C 3 14 ? -6.645 -54.979 -75.313 1.00 64.13 ? 14 GLN C CB 1 ATOM 3246 C CG . GLN C 3 14 ? -7.689 -55.871 -75.958 1.00 65.31 ? 14 GLN C CG 1 ATOM 3247 C CD . GLN C 3 14 ? -8.308 -55.260 -77.193 1.00 67.08 ? 14 GLN C CD 1 ATOM 3248 O OE1 . GLN C 3 14 ? -8.064 -54.092 -77.511 1.00 68.77 ? 14 GLN C OE1 1 ATOM 3249 N NE2 . GLN C 3 14 ? -9.118 -56.047 -77.902 1.00 66.93 ? 14 GLN C NE2 1 ATOM 3250 N N . GLY C 3 15 ? -4.713 -57.525 -76.354 1.00 63.65 ? 15 GLY C N 1 ATOM 3251 C CA . GLY C 3 15 ? -3.989 -58.110 -77.478 1.00 63.21 ? 15 GLY C CA 1 ATOM 3252 C C . GLY C 3 15 ? -2.637 -58.673 -77.086 1.00 62.91 ? 15 GLY C C 1 ATOM 3253 O O . GLY C 3 15 ? -2.047 -59.463 -77.822 1.00 62.89 ? 15 GLY C O 1 ATOM 3254 N N . GLU C 3 16 ? -2.139 -58.264 -75.926 1.00 62.69 ? 16 GLU C N 1 ATOM 3255 C CA . GLU C 3 16 ? -0.897 -58.820 -75.404 1.00 62.72 ? 16 GLU C CA 1 ATOM 3256 C C . GLU C 3 16 ? -1.099 -60.200 -74.775 1.00 62.25 ? 16 GLU C C 1 ATOM 3257 O O . GLU C 3 16 ? -2.227 -60.634 -74.526 1.00 62.27 ? 16 GLU C O 1 ATOM 3258 C CB . GLU C 3 16 ? -0.258 -57.881 -74.382 1.00 62.97 ? 16 GLU C CB 1 ATOM 3259 C CG . GLU C 3 16 ? 0.525 -56.728 -74.984 1.00 64.47 ? 16 GLU C CG 1 ATOM 3260 C CD . GLU C 3 16 ? 1.566 -56.168 -74.026 1.00 66.67 ? 16 GLU C CD 1 ATOM 3261 O OE1 . GLU C 3 16 ? 2.599 -55.658 -74.514 1.00 67.62 ? 16 GLU C OE1 1 ATOM 3262 O OE2 . GLU C 3 16 ? 1.366 -56.248 -72.789 1.00 67.59 ? 16 GLU C OE2 1 ATOM 3263 N N . ASN C 3 17 ? 0.015 -60.882 -74.529 1.00 61.58 ? 17 ASN C N 1 ATOM 3264 C CA . ASN C 3 17 ? 0.010 -62.176 -73.875 1.00 60.73 ? 17 ASN C CA 1 ATOM 3265 C C . ASN C 3 17 ? 0.301 -61.996 -72.402 1.00 60.13 ? 17 ASN C C 1 ATOM 3266 O O . ASN C 3 17 ? 1.239 -61.297 -72.030 1.00 60.06 ? 17 ASN C O 1 ATOM 3267 C CB . ASN C 3 17 ? 1.036 -63.105 -74.526 1.00 60.73 ? 17 ASN C CB 1 ATOM 3268 C CG . ASN C 3 17 ? 0.688 -63.434 -75.966 1.00 60.82 ? 17 ASN C CG 1 ATOM 3269 O OD1 . ASN C 3 17 ? -0.480 -63.425 -76.349 1.00 60.97 ? 17 ASN C OD1 1 ATOM 3270 N ND2 . ASN C 3 17 ? 1.701 -63.726 -76.772 1.00 61.50 ? 17 ASN C ND2 1 ATOM 3271 N N . SER C 3 18 ? -0.520 -62.618 -71.565 1.00 59.53 ? 18 SER C N 1 ATOM 3272 C CA . SER C 3 18 ? -0.355 -62.516 -70.121 1.00 59.00 ? 18 SER C CA 1 ATOM 3273 C C . SER C 3 18 ? -0.111 -63.877 -69.502 1.00 58.48 ? 18 SER C C 1 ATOM 3274 O O . SER C 3 18 ? -0.719 -64.872 -69.899 1.00 58.37 ? 18 SER C O 1 ATOM 3275 C CB . SER C 3 18 ? -1.574 -61.855 -69.487 1.00 58.99 ? 18 SER C CB 1 ATOM 3276 O OG . SER C 3 18 ? -2.750 -62.571 -69.799 1.00 59.22 ? 18 SER C OG 1 ATOM 3277 N N . VAL C 3 19 ? 0.781 -63.905 -68.522 1.00 57.98 ? 19 VAL C N 1 ATOM 3278 C CA . VAL C 3 19 ? 1.212 -65.150 -67.907 1.00 57.67 ? 19 VAL C CA 1 ATOM 3279 C C . VAL C 3 19 ? 0.842 -65.204 -66.406 1.00 57.55 ? 19 VAL C C 1 ATOM 3280 O O . VAL C 3 19 ? 1.182 -64.293 -65.635 1.00 57.59 ? 19 VAL C O 1 ATOM 3281 C CB . VAL C 3 19 ? 2.725 -65.388 -68.176 1.00 57.53 ? 19 VAL C CB 1 ATOM 3282 C CG1 . VAL C 3 19 ? 3.606 -64.522 -67.278 1.00 57.73 ? 19 VAL C CG1 1 ATOM 3283 C CG2 . VAL C 3 19 ? 3.077 -66.840 -68.027 1.00 57.45 ? 19 VAL C CG2 1 ATOM 3284 N N . LEU C 3 20 ? 0.123 -66.256 -66.009 1.00 57.16 ? 20 LEU C N 1 ATOM 3285 C CA . LEU C 3 20 ? -0.341 -66.408 -64.622 1.00 56.78 ? 20 LEU C CA 1 ATOM 3286 C C . LEU C 3 20 ? 0.294 -67.617 -63.935 1.00 56.89 ? 20 LEU C C 1 ATOM 3287 O O . LEU C 3 20 ? 0.336 -68.715 -64.504 1.00 56.91 ? 20 LEU C O 1 ATOM 3288 C CB . LEU C 3 20 ? -1.868 -66.513 -64.562 1.00 56.59 ? 20 LEU C CB 1 ATOM 3289 C CG . LEU C 3 20 ? -2.746 -65.396 -65.130 1.00 55.79 ? 20 LEU C CG 1 ATOM 3290 C CD1 . LEU C 3 20 ? -4.197 -65.689 -64.862 1.00 55.30 ? 20 LEU C CD1 1 ATOM 3291 C CD2 . LEU C 3 20 ? -2.388 -64.077 -64.522 1.00 55.59 ? 20 LEU C CD2 1 ATOM 3292 N N . GLN C 3 21 ? 0.772 -67.415 -62.708 1.00 56.81 ? 21 GLN C N 1 ATOM 3293 C CA . GLN C 3 21 ? 1.581 -68.431 -62.029 1.00 56.74 ? 21 GLN C CA 1 ATOM 3294 C C . GLN C 3 21 ? 0.906 -69.072 -60.813 1.00 56.58 ? 21 GLN C C 1 ATOM 3295 O O . GLN C 3 21 ? 0.121 -68.435 -60.109 1.00 56.36 ? 21 GLN C O 1 ATOM 3296 C CB . GLN C 3 21 ? 2.949 -67.855 -61.636 1.00 56.87 ? 21 GLN C CB 1 ATOM 3297 C CG . GLN C 3 21 ? 3.725 -67.165 -62.769 1.00 56.98 ? 21 GLN C CG 1 ATOM 3298 C CD . GLN C 3 21 ? 4.225 -68.128 -63.834 1.00 57.35 ? 21 GLN C CD 1 ATOM 3299 O OE1 . GLN C 3 21 ? 4.270 -69.339 -63.630 1.00 57.80 ? 21 GLN C OE1 1 ATOM 3300 N NE2 . GLN C 3 21 ? 4.606 -67.585 -64.979 1.00 57.90 ? 21 GLN C NE2 1 ATOM 3301 N N . CYS C 3 22 ? 1.231 -70.340 -60.578 1.00 56.50 ? 22 CYS C N 1 ATOM 3302 C CA . CYS C 3 22 ? 0.702 -71.083 -59.447 1.00 56.48 ? 22 CYS C CA 1 ATOM 3303 C C . CYS C 3 22 ? 1.714 -72.094 -58.960 1.00 56.56 ? 22 CYS C C 1 ATOM 3304 O O . CYS C 3 22 ? 2.155 -72.953 -59.716 1.00 56.54 ? 22 CYS C O 1 ATOM 3305 C CB . CYS C 3 22 ? -0.583 -71.804 -59.847 1.00 56.54 ? 22 CYS C CB 1 ATOM 3306 S SG . CYS C 3 22 ? -1.228 -72.988 -58.627 1.00 56.54 ? 22 CYS C SG 1 ATOM 3307 N N . ASN C 3 23 ? 2.080 -71.982 -57.691 1.00 56.90 ? 23 ASN C N 1 ATOM 3308 C CA . ASN C 3 23 ? 2.924 -72.980 -57.032 1.00 57.25 ? 23 ASN C CA 1 ATOM 3309 C C . ASN C 3 23 ? 2.168 -73.696 -55.916 1.00 57.07 ? 23 ASN C C 1 ATOM 3310 O O . ASN C 3 23 ? 1.289 -73.111 -55.282 1.00 56.95 ? 23 ASN C O 1 ATOM 3311 C CB . ASN C 3 23 ? 4.199 -72.335 -56.481 1.00 57.50 ? 23 ASN C CB 1 ATOM 3312 C CG . ASN C 3 23 ? 5.168 -71.932 -57.576 1.00 58.13 ? 23 ASN C CG 1 ATOM 3313 O OD1 . ASN C 3 23 ? 5.743 -72.782 -58.262 1.00 58.63 ? 23 ASN C OD1 1 ATOM 3314 N ND2 . ASN C 3 23 ? 5.369 -70.628 -57.732 1.00 58.79 ? 23 ASN C ND2 1 ATOM 3315 N N . TYR C 3 24 ? 2.503 -74.961 -55.688 1.00 57.02 ? 24 TYR C N 1 ATOM 3316 C CA . TYR C 3 24 ? 1.794 -75.760 -54.691 1.00 57.09 ? 24 TYR C CA 1 ATOM 3317 C C . TYR C 3 24 ? 2.699 -76.677 -53.858 1.00 57.12 ? 24 TYR C C 1 ATOM 3318 O O . TYR C 3 24 ? 3.909 -76.763 -54.091 1.00 57.37 ? 24 TYR C O 1 ATOM 3319 C CB . TYR C 3 24 ? 0.645 -76.546 -55.341 1.00 56.98 ? 24 TYR C CB 1 ATOM 3320 C CG . TYR C 3 24 ? 1.070 -77.630 -56.303 1.00 56.94 ? 24 TYR C CG 1 ATOM 3321 C CD1 . TYR C 3 24 ? 1.446 -78.889 -55.837 1.00 57.37 ? 24 TYR C CD1 1 ATOM 3322 C CD2 . TYR C 3 24 ? 1.078 -77.405 -57.677 1.00 56.60 ? 24 TYR C CD2 1 ATOM 3323 C CE1 . TYR C 3 24 ? 1.830 -79.892 -56.712 1.00 57.77 ? 24 TYR C CE1 1 ATOM 3324 C CE2 . TYR C 3 24 ? 1.460 -78.403 -58.562 1.00 56.86 ? 24 TYR C CE2 1 ATOM 3325 C CZ . TYR C 3 24 ? 1.832 -79.645 -58.070 1.00 57.66 ? 24 TYR C CZ 1 ATOM 3326 O OH . TYR C 3 24 ? 2.216 -80.648 -58.927 1.00 58.86 ? 24 TYR C OH 1 ATOM 3327 N N . SER C 3 25 ? 2.088 -77.354 -52.886 1.00 56.91 ? 25 SER C N 1 ATOM 3328 C CA . SER C 3 25 ? 2.787 -78.243 -51.952 1.00 56.49 ? 25 SER C CA 1 ATOM 3329 C C . SER C 3 25 ? 1.908 -79.445 -51.615 1.00 56.05 ? 25 SER C C 1 ATOM 3330 O O . SER C 3 25 ? 2.340 -80.383 -50.936 1.00 55.93 ? 25 SER C O 1 ATOM 3331 C CB . SER C 3 25 ? 3.140 -77.473 -50.681 1.00 56.55 ? 25 SER C CB 1 ATOM 3332 O OG . SER C 3 25 ? 2.105 -76.558 -50.358 1.00 56.60 ? 25 SER C OG 1 ATOM 3333 N N . VAL C 3 26 ? 0.674 -79.387 -52.115 1.00 55.48 ? 26 VAL C N 1 ATOM 3334 C CA . VAL C 3 26 ? -0.353 -80.406 -51.938 1.00 55.01 ? 26 VAL C CA 1 ATOM 3335 C C . VAL C 3 26 ? 0.097 -81.789 -52.420 1.00 54.89 ? 26 VAL C C 1 ATOM 3336 O O . VAL C 3 26 ? 0.737 -81.922 -53.465 1.00 55.03 ? 26 VAL C O 1 ATOM 3337 C CB . VAL C 3 26 ? -1.639 -79.989 -52.673 1.00 54.88 ? 26 VAL C CB 1 ATOM 3338 C CG1 . VAL C 3 26 ? -2.757 -80.984 -52.425 1.00 55.29 ? 26 VAL C CG1 1 ATOM 3339 C CG2 . VAL C 3 26 ? -2.069 -78.606 -52.228 1.00 54.56 ? 26 VAL C CG2 1 ATOM 3340 N N . THR C 3 27 ? -0.248 -82.816 -51.647 1.00 54.60 ? 27 THR C N 1 ATOM 3341 C CA . THR C 3 27 ? 0.255 -84.165 -51.889 1.00 54.12 ? 27 THR C CA 1 ATOM 3342 C C . THR C 3 27 ? -0.751 -85.253 -51.489 1.00 53.60 ? 27 THR C C 1 ATOM 3343 O O . THR C 3 27 ? -1.369 -85.165 -50.433 1.00 53.50 ? 27 THR C O 1 ATOM 3344 C CB . THR C 3 27 ? 1.645 -84.390 -51.216 1.00 54.16 ? 27 THR C CB 1 ATOM 3345 O OG1 . THR C 3 27 ? 1.992 -85.777 -51.273 1.00 54.44 ? 27 THR C OG1 1 ATOM 3346 C CG2 . THR C 3 27 ? 1.657 -83.908 -49.759 1.00 54.15 ? 27 THR C CG2 1 ATOM 3347 N N . PRO C 3 28 ? -0.949 -86.258 -52.363 1.00 53.35 ? 28 PRO C N 1 ATOM 3348 C CA . PRO C 3 28 ? -0.368 -86.304 -53.714 1.00 53.23 ? 28 PRO C CA 1 ATOM 3349 C C . PRO C 3 28 ? -0.967 -85.222 -54.615 1.00 52.90 ? 28 PRO C C 1 ATOM 3350 O O . PRO C 3 28 ? -1.942 -84.563 -54.239 1.00 53.00 ? 28 PRO C O 1 ATOM 3351 C CB . PRO C 3 28 ? -0.748 -87.702 -54.223 1.00 53.23 ? 28 PRO C CB 1 ATOM 3352 C CG . PRO C 3 28 ? -1.943 -88.087 -53.423 1.00 53.25 ? 28 PRO C CG 1 ATOM 3353 C CD . PRO C 3 28 ? -1.774 -87.445 -52.075 1.00 53.30 ? 28 PRO C CD 1 ATOM 3354 N N . ASP C 3 29 ? -0.376 -85.035 -55.788 1.00 52.24 ? 29 ASP C N 1 ATOM 3355 C CA . ASP C 3 29 ? -0.844 -84.028 -56.725 1.00 51.53 ? 29 ASP C CA 1 ATOM 3356 C C . ASP C 3 29 ? -1.448 -84.717 -57.932 1.00 50.67 ? 29 ASP C C 1 ATOM 3357 O O . ASP C 3 29 ? -0.820 -84.810 -58.983 1.00 50.63 ? 29 ASP C O 1 ATOM 3358 C CB . ASP C 3 29 ? 0.308 -83.104 -57.132 1.00 51.68 ? 29 ASP C CB 1 ATOM 3359 C CG . ASP C 3 29 ? 1.621 -83.854 -57.352 1.00 52.71 ? 29 ASP C CG 1 ATOM 3360 O OD1 . ASP C 3 29 ? 1.854 -84.900 -56.695 1.00 53.07 ? 29 ASP C OD1 1 ATOM 3361 O OD2 . ASP C 3 29 ? 2.431 -83.383 -58.180 1.00 54.16 ? 29 ASP C OD2 1 ATOM 3362 N N . ASN C 3 30 ? -2.664 -85.225 -57.769 1.00 49.65 ? 30 ASN C N 1 ATOM 3363 C CA . ASN C 3 30 ? -3.313 -85.967 -58.843 1.00 48.69 ? 30 ASN C CA 1 ATOM 3364 C C . ASN C 3 30 ? -3.539 -85.100 -60.073 1.00 48.05 ? 30 ASN C C 1 ATOM 3365 O O . ASN C 3 30 ? -3.253 -85.518 -61.209 1.00 48.30 ? 30 ASN C O 1 ATOM 3366 C CB . ASN C 3 30 ? -4.643 -86.566 -58.396 1.00 48.57 ? 30 ASN C CB 1 ATOM 3367 C CG . ASN C 3 30 ? -5.296 -87.377 -59.489 1.00 48.55 ? 30 ASN C CG 1 ATOM 3368 O OD1 . ASN C 3 30 ? -6.213 -86.905 -60.157 1.00 49.18 ? 30 ASN C OD1 1 ATOM 3369 N ND2 . ASN C 3 30 ? -4.802 -88.592 -59.707 1.00 48.56 ? 30 ASN C ND2 1 ATOM 3370 N N . HIS C 3 31 ? -4.053 -83.895 -59.841 1.00 46.76 ? 31 HIS C N 1 ATOM 3371 C CA . HIS C 3 31 ? -4.363 -82.992 -60.928 1.00 45.46 ? 31 HIS C CA 1 ATOM 3372 C C . HIS C 3 31 ? -4.424 -81.541 -60.497 1.00 44.53 ? 31 HIS C C 1 ATOM 3373 O O . HIS C 3 31 ? -4.727 -81.233 -59.346 1.00 44.17 ? 31 HIS C O 1 ATOM 3374 C CB . HIS C 3 31 ? -5.664 -83.411 -61.620 1.00 45.67 ? 31 HIS C CB 1 ATOM 3375 C CG . HIS C 3 31 ? -6.883 -83.285 -60.763 1.00 46.00 ? 31 HIS C CG 1 ATOM 3376 N ND1 . HIS C 3 31 ? -7.322 -84.298 -59.940 1.00 46.63 ? 31 HIS C ND1 1 ATOM 3377 C CD2 . HIS C 3 31 ? -7.771 -82.273 -60.619 1.00 46.36 ? 31 HIS C CD2 1 ATOM 3378 C CE1 . HIS C 3 31 ? -8.423 -83.912 -59.319 1.00 46.56 ? 31 HIS C CE1 1 ATOM 3379 N NE2 . HIS C 3 31 ? -8.717 -82.687 -59.714 1.00 46.08 ? 31 HIS C NE2 1 ATOM 3380 N N . LEU C 3 32 ? -4.102 -80.662 -61.442 1.00 43.56 ? 32 LEU C N 1 ATOM 3381 C CA . LEU C 3 32 ? -4.273 -79.232 -61.279 1.00 42.66 ? 32 LEU C CA 1 ATOM 3382 C C . LEU C 3 32 ? -5.197 -78.725 -62.379 1.00 42.10 ? 32 LEU C C 1 ATOM 3383 O O . LEU C 3 32 ? -5.124 -79.187 -63.519 1.00 41.90 ? 32 LEU C O 1 ATOM 3384 C CB . LEU C 3 32 ? -2.926 -78.523 -61.339 1.00 42.53 ? 32 LEU C CB 1 ATOM 3385 C CG . LEU C 3 32 ? -2.904 -77.082 -60.823 1.00 42.58 ? 32 LEU C CG 1 ATOM 3386 C CD1 . LEU C 3 32 ? -1.551 -76.739 -60.237 1.00 42.51 ? 32 LEU C CD1 1 ATOM 3387 C CD2 . LEU C 3 32 ? -3.282 -76.084 -61.906 1.00 42.42 ? 32 LEU C CD2 1 ATOM 3388 N N . ARG C 3 33 ? -6.069 -77.785 -62.025 1.00 41.46 ? 33 ARG C N 1 ATOM 3389 C CA . ARG C 3 33 ? -7.012 -77.206 -62.973 1.00 41.12 ? 33 ARG C CA 1 ATOM 3390 C C . ARG C 3 33 ? -7.219 -75.718 -62.742 1.00 41.01 ? 33 ARG C C 1 ATOM 3391 O O . ARG C 3 33 ? -7.061 -75.231 -61.626 1.00 41.11 ? 33 ARG C O 1 ATOM 3392 C CB . ARG C 3 33 ? -8.351 -77.940 -62.931 1.00 41.12 ? 33 ARG C CB 1 ATOM 3393 C CG . ARG C 3 33 ? -9.162 -77.713 -61.664 1.00 41.10 ? 33 ARG C CG 1 ATOM 3394 C CD . ARG C 3 33 ? -10.382 -78.631 -61.590 1.00 40.41 ? 33 ARG C CD 1 ATOM 3395 N NE . ARG C 3 33 ? -11.301 -78.460 -62.716 1.00 39.46 ? 33 ARG C NE 1 ATOM 3396 C CZ . ARG C 3 33 ? -12.405 -79.177 -62.883 1.00 38.75 ? 33 ARG C CZ 1 ATOM 3397 N NH1 . ARG C 3 33 ? -12.730 -80.105 -62.000 1.00 39.19 ? 33 ARG C NH1 1 ATOM 3398 N NH2 . ARG C 3 33 ? -13.191 -78.968 -63.927 1.00 38.39 ? 33 ARG C NH2 1 ATOM 3399 N N . TRP C 3 34 ? -7.576 -75.004 -63.809 1.00 41.03 ? 34 TRP C N 1 ATOM 3400 C CA . TRP C 3 34 ? -7.733 -73.542 -63.767 1.00 40.74 ? 34 TRP C CA 1 ATOM 3401 C C . TRP C 3 34 ? -9.193 -73.109 -63.904 1.00 41.05 ? 34 TRP C C 1 ATOM 3402 O O . TRP C 3 34 ? -9.987 -73.737 -64.619 1.00 41.15 ? 34 TRP C O 1 ATOM 3403 C CB . TRP C 3 34 ? -6.852 -72.855 -64.827 1.00 40.36 ? 34 TRP C CB 1 ATOM 3404 C CG . TRP C 3 34 ? -5.378 -72.820 -64.462 1.00 38.86 ? 34 TRP C CG 1 ATOM 3405 C CD1 . TRP C 3 34 ? -4.436 -73.764 -64.767 1.00 38.42 ? 34 TRP C CD1 1 ATOM 3406 C CD2 . TRP C 3 34 ? -4.691 -71.798 -63.721 1.00 36.98 ? 34 TRP C CD2 1 ATOM 3407 N NE1 . TRP C 3 34 ? -3.209 -73.396 -64.263 1.00 37.46 ? 34 TRP C NE1 1 ATOM 3408 C CE2 . TRP C 3 34 ? -3.338 -72.197 -63.614 1.00 36.80 ? 34 TRP C CE2 1 ATOM 3409 C CE3 . TRP C 3 34 ? -5.085 -70.584 -63.141 1.00 35.82 ? 34 TRP C CE3 1 ATOM 3410 C CZ2 . TRP C 3 34 ? -2.380 -71.426 -62.951 1.00 36.41 ? 34 TRP C CZ2 1 ATOM 3411 C CZ3 . TRP C 3 34 ? -4.132 -69.817 -62.480 1.00 35.52 ? 34 TRP C CZ3 1 ATOM 3412 C CH2 . TRP C 3 34 ? -2.795 -70.241 -62.391 1.00 35.99 ? 34 TRP C CH2 1 ATOM 3413 N N . PHE C 3 35 ? -9.541 -72.041 -63.197 1.00 41.39 ? 35 PHE C N 1 ATOM 3414 C CA . PHE C 3 35 ? -10.909 -71.543 -63.189 1.00 41.72 ? 35 PHE C CA 1 ATOM 3415 C C . PHE C 3 35 ? -10.938 -70.064 -63.447 1.00 42.20 ? 35 PHE C C 1 ATOM 3416 O O . PHE C 3 35 ? -10.125 -69.324 -62.898 1.00 42.06 ? 35 PHE C O 1 ATOM 3417 C CB . PHE C 3 35 ? -11.583 -71.820 -61.841 1.00 41.62 ? 35 PHE C CB 1 ATOM 3418 C CG . PHE C 3 35 ? -12.126 -73.200 -61.714 1.00 40.34 ? 35 PHE C CG 1 ATOM 3419 C CD1 . PHE C 3 35 ? -13.238 -73.588 -62.438 1.00 39.45 ? 35 PHE C CD1 1 ATOM 3420 C CD2 . PHE C 3 35 ? -11.525 -74.115 -60.871 1.00 39.47 ? 35 PHE C CD2 1 ATOM 3421 C CE1 . PHE C 3 35 ? -13.744 -74.873 -62.328 1.00 39.76 ? 35 PHE C CE1 1 ATOM 3422 C CE2 . PHE C 3 35 ? -12.025 -75.410 -60.759 1.00 39.41 ? 35 PHE C CE2 1 ATOM 3423 C CZ . PHE C 3 35 ? -13.133 -75.788 -61.485 1.00 38.71 ? 35 PHE C CZ 1 ATOM 3424 N N . LYS C 3 36 ? -11.880 -69.640 -64.281 1.00 43.07 ? 36 LYS C N 1 ATOM 3425 C CA . LYS C 3 36 ? -12.134 -68.220 -64.481 1.00 44.21 ? 36 LYS C CA 1 ATOM 3426 C C . LYS C 3 36 ? -13.404 -67.841 -63.741 1.00 45.05 ? 36 LYS C C 1 ATOM 3427 O O . LYS C 3 36 ? -14.437 -68.512 -63.864 1.00 44.98 ? 36 LYS C O 1 ATOM 3428 C CB . LYS C 3 36 ? -12.250 -67.866 -65.969 1.00 44.21 ? 36 LYS C CB 1 ATOM 3429 C CG . LYS C 3 36 ? -12.472 -66.376 -66.249 1.00 43.94 ? 36 LYS C CG 1 ATOM 3430 C CD . LYS C 3 36 ? -13.039 -66.136 -67.636 1.00 43.43 ? 36 LYS C CD 1 ATOM 3431 C CE . LYS C 3 36 ? -13.163 -64.653 -67.917 1.00 43.33 ? 36 LYS C CE 1 ATOM 3432 N NZ . LYS C 3 36 ? -14.249 -64.359 -68.895 1.00 43.37 ? 36 LYS C NZ 1 ATOM 3433 N N . GLN C 3 37 ? -13.309 -66.770 -62.962 1.00 46.27 ? 37 GLN C N 1 ATOM 3434 C CA . GLN C 3 37 ? -14.451 -66.247 -62.235 1.00 47.74 ? 37 GLN C CA 1 ATOM 3435 C C . GLN C 3 37 ? -14.698 -64.780 -62.572 1.00 48.95 ? 37 GLN C C 1 ATOM 3436 O O . GLN C 3 37 ? -13.948 -63.898 -62.127 1.00 48.94 ? 37 GLN C O 1 ATOM 3437 C CB . GLN C 3 37 ? -14.261 -66.408 -60.726 1.00 47.56 ? 37 GLN C CB 1 ATOM 3438 C CG . GLN C 3 37 ? -15.470 -65.942 -59.916 1.00 47.54 ? 37 GLN C CG 1 ATOM 3439 C CD . GLN C 3 37 ? -15.249 -65.964 -58.414 1.00 47.52 ? 37 GLN C CD 1 ATOM 3440 O OE1 . GLN C 3 37 ? -14.113 -65.965 -57.935 1.00 47.36 ? 37 GLN C OE1 1 ATOM 3441 N NE2 . GLN C 3 37 ? -16.345 -65.976 -57.660 1.00 47.30 ? 37 GLN C NE2 1 ATOM 3442 N N . ASP C 3 38 ? -15.749 -64.528 -63.360 1.00 50.41 ? 38 ASP C N 1 ATOM 3443 C CA . ASP C 3 38 ? -16.227 -63.163 -63.627 1.00 51.69 ? 38 ASP C CA 1 ATOM 3444 C C . ASP C 3 38 ? -16.818 -62.560 -62.351 1.00 52.10 ? 38 ASP C C 1 ATOM 3445 O O . ASP C 3 38 ? -17.331 -63.284 -61.488 1.00 52.37 ? 38 ASP C O 1 ATOM 3446 C CB . ASP C 3 38 ? -17.272 -63.145 -64.752 1.00 52.03 ? 38 ASP C CB 1 ATOM 3447 C CG . ASP C 3 38 ? -16.728 -63.676 -66.079 1.00 53.66 ? 38 ASP C CG 1 ATOM 3448 O OD1 . ASP C 3 38 ? -15.991 -62.934 -66.775 1.00 55.11 ? 38 ASP C OD1 1 ATOM 3449 O OD2 . ASP C 3 38 ? -17.055 -64.837 -66.430 1.00 55.33 ? 38 ASP C OD2 1 ATOM 3450 N N . THR C 3 39 ? -16.741 -61.237 -62.239 1.00 52.42 ? 39 THR C N 1 ATOM 3451 C CA . THR C 3 39 ? -17.231 -60.510 -61.067 1.00 52.70 ? 39 THR C CA 1 ATOM 3452 C C . THR C 3 39 ? -18.706 -60.792 -60.800 1.00 52.68 ? 39 THR C C 1 ATOM 3453 O O . THR C 3 39 ? -19.551 -60.578 -61.672 1.00 52.75 ? 39 THR C O 1 ATOM 3454 C CB . THR C 3 39 ? -17.051 -58.999 -61.265 1.00 52.92 ? 39 THR C CB 1 ATOM 3455 O OG1 . THR C 3 39 ? -15.722 -58.741 -61.741 1.00 53.77 ? 39 THR C OG1 1 ATOM 3456 C CG2 . THR C 3 39 ? -17.301 -58.226 -59.963 1.00 52.86 ? 39 THR C CG2 1 ATOM 3457 N N . GLY C 3 40 ? -19.000 -61.272 -59.590 1.00 52.66 ? 40 GLY C N 1 ATOM 3458 C CA . GLY C 3 40 ? -20.367 -61.608 -59.177 1.00 52.31 ? 40 GLY C CA 1 ATOM 3459 C C . GLY C 3 40 ? -20.926 -62.875 -59.803 1.00 52.18 ? 40 GLY C C 1 ATOM 3460 O O . GLY C 3 40 ? -22.136 -62.971 -60.021 1.00 52.07 ? 40 GLY C O 1 ATOM 3461 N N . LYS C 3 41 ? -20.054 -63.848 -60.084 1.00 52.05 ? 41 LYS C N 1 ATOM 3462 C CA . LYS C 3 41 ? -20.458 -65.089 -60.764 1.00 51.99 ? 41 LYS C CA 1 ATOM 3463 C C . LYS C 3 41 ? -19.730 -66.363 -60.309 1.00 51.49 ? 41 LYS C C 1 ATOM 3464 O O . LYS C 3 41 ? -18.972 -66.348 -59.333 1.00 51.31 ? 41 LYS C O 1 ATOM 3465 C CB . LYS C 3 41 ? -20.386 -64.925 -62.289 1.00 52.31 ? 41 LYS C CB 1 ATOM 3466 C CG . LYS C 3 41 ? -21.672 -64.368 -62.895 1.00 53.58 ? 41 LYS C CG 1 ATOM 3467 C CD . LYS C 3 41 ? -21.584 -64.230 -64.403 1.00 55.29 ? 41 LYS C CD 1 ATOM 3468 C CE . LYS C 3 41 ? -22.902 -63.717 -64.964 1.00 56.24 ? 41 LYS C CE 1 ATOM 3469 N NZ . LYS C 3 41 ? -22.854 -63.628 -66.455 1.00 57.16 ? 41 LYS C NZ 1 ATOM 3470 N N . GLY C 3 42 ? -19.987 -67.462 -61.023 1.00 51.05 ? 42 GLY C N 1 ATOM 3471 C CA . GLY C 3 42 ? -19.469 -68.775 -60.655 1.00 50.54 ? 42 GLY C CA 1 ATOM 3472 C C . GLY C 3 42 ? -18.040 -69.002 -61.097 1.00 50.20 ? 42 GLY C C 1 ATOM 3473 O O . GLY C 3 42 ? -17.393 -68.087 -61.612 1.00 50.48 ? 42 GLY C O 1 ATOM 3474 N N . LEU C 3 43 ? -17.538 -70.217 -60.881 1.00 49.52 ? 43 LEU C N 1 ATOM 3475 C CA . LEU C 3 43 ? -16.227 -70.603 -61.391 1.00 48.60 ? 43 LEU C CA 1 ATOM 3476 C C . LEU C 3 43 ? -16.415 -71.367 -62.682 1.00 48.40 ? 43 LEU C C 1 ATOM 3477 O O . LEU C 3 43 ? -17.145 -72.368 -62.718 1.00 48.41 ? 43 LEU C O 1 ATOM 3478 C CB . LEU C 3 43 ? -15.460 -71.443 -60.373 1.00 48.30 ? 43 LEU C CB 1 ATOM 3479 C CG . LEU C 3 43 ? -14.544 -70.662 -59.433 1.00 47.86 ? 43 LEU C CG 1 ATOM 3480 C CD1 . LEU C 3 43 ? -15.294 -69.562 -58.722 1.00 47.62 ? 43 LEU C CD1 1 ATOM 3481 C CD2 . LEU C 3 43 ? -13.888 -71.575 -58.416 1.00 47.52 ? 43 LEU C CD2 1 ATOM 3482 N N . VAL C 3 44 ? -15.776 -70.874 -63.742 1.00 47.98 ? 44 VAL C N 1 ATOM 3483 C CA . VAL C 3 44 ? -15.808 -71.537 -65.044 1.00 47.67 ? 44 VAL C CA 1 ATOM 3484 C C . VAL C 3 44 ? -14.511 -72.303 -65.287 1.00 47.36 ? 44 VAL C C 1 ATOM 3485 O O . VAL C 3 44 ? -13.422 -71.763 -65.078 1.00 47.44 ? 44 VAL C O 1 ATOM 3486 C CB . VAL C 3 44 ? -16.039 -70.537 -66.174 1.00 47.58 ? 44 VAL C CB 1 ATOM 3487 C CG1 . VAL C 3 44 ? -16.429 -71.269 -67.448 1.00 47.84 ? 44 VAL C CG1 1 ATOM 3488 C CG2 . VAL C 3 44 ? -17.133 -69.565 -65.785 1.00 47.68 ? 44 VAL C CG2 1 ATOM 3489 N N . SER C 3 45 ? -14.632 -73.560 -65.710 1.00 46.88 ? 45 SER C N 1 ATOM 3490 C CA . SER C 3 45 ? -13.457 -74.386 -65.971 1.00 46.60 ? 45 SER C CA 1 ATOM 3491 C C . SER C 3 45 ? -12.741 -73.983 -67.256 1.00 46.18 ? 45 SER C C 1 ATOM 3492 O O . SER C 3 45 ? -13.352 -73.886 -68.324 1.00 46.17 ? 45 SER C O 1 ATOM 3493 C CB . SER C 3 45 ? -13.818 -75.869 -66.019 1.00 46.71 ? 45 SER C CB 1 ATOM 3494 O OG . SER C 3 45 ? -12.637 -76.657 -66.052 1.00 47.08 ? 45 SER C OG 1 ATOM 3495 N N . LEU C 3 46 ? -11.439 -73.752 -67.130 1.00 45.57 ? 46 LEU C N 1 ATOM 3496 C CA . LEU C 3 46 ? -10.614 -73.371 -68.249 1.00 45.05 ? 46 LEU C CA 1 ATOM 3497 C C . LEU C 3 46 ? -9.884 -74.583 -68.781 1.00 45.20 ? 46 LEU C C 1 ATOM 3498 O O . LEU C 3 46 ? -10.091 -74.978 -69.927 1.00 45.26 ? 46 LEU C O 1 ATOM 3499 C CB . LEU C 3 46 ? -9.625 -72.296 -67.829 1.00 44.83 ? 46 LEU C CB 1 ATOM 3500 C CG . LEU C 3 46 ? -10.247 -71.015 -67.283 1.00 44.42 ? 46 LEU C CG 1 ATOM 3501 C CD1 . LEU C 3 46 ? -9.171 -70.053 -66.810 1.00 44.04 ? 46 LEU C CD1 1 ATOM 3502 C CD2 . LEU C 3 46 ? -11.133 -70.358 -68.327 1.00 44.26 ? 46 LEU C CD2 1 ATOM 3503 N N . THR C 3 47 ? -9.037 -75.184 -67.952 1.00 45.38 ? 47 THR C N 1 ATOM 3504 C CA . THR C 3 47 ? -8.274 -76.336 -68.393 1.00 45.86 ? 47 THR C CA 1 ATOM 3505 C C . THR C 3 47 ? -7.872 -77.252 -67.240 1.00 46.07 ? 47 THR C C 1 ATOM 3506 O O . THR C 3 47 ? -7.647 -76.787 -66.127 1.00 45.91 ? 47 THR C O 1 ATOM 3507 C CB . THR C 3 47 ? -7.044 -75.901 -69.237 1.00 45.99 ? 47 THR C CB 1 ATOM 3508 O OG1 . THR C 3 47 ? -6.697 -76.946 -70.155 1.00 46.23 ? 47 THR C OG1 1 ATOM 3509 C CG2 . THR C 3 47 ? -5.845 -75.533 -68.346 1.00 45.81 ? 47 THR C CG2 1 ATOM 3510 N N . VAL C 3 48 ? -7.791 -78.551 -67.533 1.00 46.48 ? 48 VAL C N 1 ATOM 3511 C CA . VAL C 3 48 ? -7.477 -79.574 -66.540 1.00 47.00 ? 48 VAL C CA 1 ATOM 3512 C C . VAL C 3 48 ? -6.221 -80.353 -66.936 1.00 47.44 ? 48 VAL C C 1 ATOM 3513 O O . VAL C 3 48 ? -6.170 -80.960 -68.008 1.00 47.59 ? 48 VAL C O 1 ATOM 3514 C CB . VAL C 3 48 ? -8.671 -80.552 -66.346 1.00 47.01 ? 48 VAL C CB 1 ATOM 3515 C CG1 . VAL C 3 48 ? -8.305 -81.709 -65.412 1.00 46.76 ? 48 VAL C CG1 1 ATOM 3516 C CG2 . VAL C 3 48 ? -9.895 -79.808 -65.821 1.00 47.17 ? 48 VAL C CG2 1 ATOM 3517 N N . LEU C 3 49 ? -5.222 -80.333 -66.055 1.00 47.88 ? 49 LEU C N 1 ATOM 3518 C CA . LEU C 3 49 ? -3.942 -81.003 -66.286 1.00 48.40 ? 49 LEU C CA 1 ATOM 3519 C C . LEU C 3 49 ? -3.786 -82.198 -65.362 1.00 48.87 ? 49 LEU C C 1 ATOM 3520 O O . LEU C 3 49 ? -4.166 -82.129 -64.203 1.00 49.00 ? 49 LEU C O 1 ATOM 3521 C CB . LEU C 3 49 ? -2.791 -80.031 -66.031 1.00 48.27 ? 49 LEU C CB 1 ATOM 3522 C CG . LEU C 3 49 ? -2.776 -78.761 -66.869 1.00 47.86 ? 49 LEU C CG 1 ATOM 3523 C CD1 . LEU C 3 49 ? -2.152 -77.625 -66.088 1.00 47.30 ? 49 LEU C CD1 1 ATOM 3524 C CD2 . LEU C 3 49 ? -2.055 -79.013 -68.178 1.00 47.69 ? 49 LEU C CD2 1 ATOM 3525 N N . VAL C 3 50 ? -3.203 -83.281 -65.862 1.00 49.56 ? 50 VAL C N 1 ATOM 3526 C CA . VAL C 3 50 ? -3.083 -84.498 -65.069 1.00 50.26 ? 50 VAL C CA 1 ATOM 3527 C C . VAL C 3 50 ? -1.671 -85.061 -65.013 1.00 50.86 ? 50 VAL C C 1 ATOM 3528 O O . VAL C 3 50 ? -1.193 -85.418 -63.938 1.00 51.05 ? 50 VAL C O 1 ATOM 3529 C CB . VAL C 3 50 ? -4.014 -85.609 -65.579 1.00 50.26 ? 50 VAL C CB 1 ATOM 3530 C CG1 . VAL C 3 50 ? -3.985 -86.806 -64.613 1.00 50.45 ? 50 VAL C CG1 1 ATOM 3531 C CG2 . VAL C 3 50 ? -5.431 -85.077 -65.769 1.00 49.92 ? 50 VAL C CG2 1 ATOM 3532 N N . ASP C 3 51 ? -1.018 -85.154 -66.166 1.00 51.52 ? 51 ASP C N 1 ATOM 3533 C CA . ASP C 3 51 ? 0.254 -85.862 -66.265 1.00 52.36 ? 51 ASP C CA 1 ATOM 3534 C C . ASP C 3 51 ? 1.426 -85.149 -65.588 1.00 53.06 ? 51 ASP C C 1 ATOM 3535 O O . ASP C 3 51 ? 1.343 -83.964 -65.244 1.00 52.93 ? 51 ASP C O 1 ATOM 3536 C CB . ASP C 3 51 ? 0.581 -86.176 -67.725 1.00 52.39 ? 51 ASP C CB 1 ATOM 3537 C CG . ASP C 3 51 ? -0.397 -87.162 -68.343 1.00 52.53 ? 51 ASP C CG 1 ATOM 3538 O OD1 . ASP C 3 51 ? -0.597 -88.255 -67.765 1.00 52.44 ? 51 ASP C OD1 1 ATOM 3539 O OD2 . ASP C 3 51 ? -0.966 -86.840 -69.410 1.00 52.59 ? 51 ASP C OD2 1 ATOM 3540 N N . GLN C 3 52 ? 2.508 -85.903 -65.389 1.00 54.07 ? 52 GLN C N 1 ATOM 3541 C CA . GLN C 3 52 ? 3.714 -85.425 -64.712 1.00 54.83 ? 52 GLN C CA 1 ATOM 3542 C C . GLN C 3 52 ? 4.210 -84.128 -65.351 1.00 54.88 ? 52 GLN C C 1 ATOM 3543 O O . GLN C 3 52 ? 4.493 -83.150 -64.649 1.00 54.87 ? 52 GLN C O 1 ATOM 3544 C CB . GLN C 3 52 ? 4.796 -86.514 -64.731 1.00 55.14 ? 52 GLN C CB 1 ATOM 3545 C CG . GLN C 3 52 ? 6.121 -86.137 -64.052 1.00 57.14 ? 52 GLN C CG 1 ATOM 3546 C CD . GLN C 3 52 ? 6.155 -86.394 -62.540 1.00 59.65 ? 52 GLN C CD 1 ATOM 3547 O OE1 . GLN C 3 52 ? 5.133 -86.696 -61.904 1.00 60.72 ? 52 GLN C OE1 1 ATOM 3548 N NE2 . GLN C 3 52 ? 7.348 -86.275 -61.960 1.00 59.80 ? 52 GLN C NE2 1 ATOM 3549 N N . LYS C 3 53 ? 4.309 -84.132 -66.682 1.00 54.89 ? 53 LYS C N 1 ATOM 3550 C CA . LYS C 3 53 ? 4.556 -82.916 -67.449 1.00 54.87 ? 53 LYS C CA 1 ATOM 3551 C C . LYS C 3 53 ? 3.465 -82.830 -68.498 1.00 54.78 ? 53 LYS C C 1 ATOM 3552 O O . LYS C 3 53 ? 3.480 -83.569 -69.481 1.00 54.80 ? 53 LYS C O 1 ATOM 3553 C CB . LYS C 3 53 ? 5.926 -82.952 -68.116 1.00 54.90 ? 53 LYS C CB 1 ATOM 3554 C CG . LYS C 3 53 ? 7.034 -83.552 -67.267 1.00 55.55 ? 53 LYS C CG 1 ATOM 3555 C CD . LYS C 3 53 ? 7.867 -82.492 -66.561 1.00 56.37 ? 53 LYS C CD 1 ATOM 3556 C CE . LYS C 3 53 ? 9.176 -83.102 -66.068 1.00 56.47 ? 53 LYS C CE 1 ATOM 3557 N NZ . LYS C 3 53 ? 10.123 -82.076 -65.572 1.00 56.36 ? 53 LYS C NZ 1 ATOM 3558 N N . ASP C 3 54 ? 2.502 -81.943 -68.271 1.00 54.79 ? 54 ASP C N 1 ATOM 3559 C CA . ASP C 3 54 ? 1.329 -81.856 -69.131 1.00 54.79 ? 54 ASP C CA 1 ATOM 3560 C C . ASP C 3 54 ? 1.176 -80.461 -69.705 1.00 54.54 ? 54 ASP C C 1 ATOM 3561 O O . ASP C 3 54 ? 1.608 -79.471 -69.119 1.00 54.52 ? 54 ASP C O 1 ATOM 3562 C CB . ASP C 3 54 ? 0.056 -82.271 -68.374 1.00 55.01 ? 54 ASP C CB 1 ATOM 3563 C CG . ASP C 3 54 ? -1.064 -82.757 -69.303 1.00 56.13 ? 54 ASP C CG 1 ATOM 3564 O OD1 . ASP C 3 54 ? -0.940 -82.629 -70.540 1.00 57.76 ? 54 ASP C OD1 1 ATOM 3565 O OD2 . ASP C 3 54 ? -2.082 -83.276 -68.792 1.00 57.21 ? 54 ASP C OD2 1 ATOM 3566 N N . LYS C 3 55 ? 0.562 -80.415 -70.873 1.00 54.29 ? 55 LYS C N 1 ATOM 3567 C CA . LYS C 3 55 ? 0.276 -79.200 -71.582 1.00 54.31 ? 55 LYS C CA 1 ATOM 3568 C C . LYS C 3 55 ? -1.172 -79.395 -71.965 1.00 53.78 ? 55 LYS C C 1 ATOM 3569 O O . LYS C 3 55 ? -1.533 -80.463 -72.459 1.00 53.86 ? 55 LYS C O 1 ATOM 3570 C CB . LYS C 3 55 ? 1.150 -79.156 -72.840 1.00 54.81 ? 55 LYS C CB 1 ATOM 3571 C CG . LYS C 3 55 ? 1.180 -77.844 -73.631 1.00 56.64 ? 55 LYS C CG 1 ATOM 3572 C CD . LYS C 3 55 ? 2.139 -77.969 -74.840 1.00 59.35 ? 55 LYS C CD 1 ATOM 3573 C CE . LYS C 3 55 ? 2.466 -76.604 -75.479 1.00 60.77 ? 55 LYS C CE 1 ATOM 3574 N NZ . LYS C 3 55 ? 3.456 -76.687 -76.609 1.00 60.59 ? 55 LYS C NZ 1 ATOM 3575 N N . THR C 3 56 ? -2.018 -78.405 -71.700 1.00 53.13 ? 56 THR C N 1 ATOM 3576 C CA . THR C 3 56 ? -3.371 -78.410 -72.270 1.00 52.59 ? 56 THR C CA 1 ATOM 3577 C C . THR C 3 56 ? -3.750 -77.039 -72.767 1.00 51.74 ? 56 THR C C 1 ATOM 3578 O O . THR C 3 56 ? -3.209 -76.033 -72.318 1.00 51.59 ? 56 THR C O 1 ATOM 3579 C CB . THR C 3 56 ? -4.469 -78.951 -71.313 1.00 52.86 ? 56 THR C CB 1 ATOM 3580 O OG1 . THR C 3 56 ? -4.317 -78.372 -70.010 1.00 53.09 ? 56 THR C OG1 1 ATOM 3581 C CG2 . THR C 3 56 ? -4.433 -80.493 -71.230 1.00 53.45 ? 56 THR C CG2 1 ATOM 3582 N N . SER C 3 57 ? -4.673 -77.011 -73.714 1.00 50.96 ? 57 SER C N 1 ATOM 3583 C CA . SER C 3 57 ? -5.061 -75.774 -74.338 1.00 50.47 ? 57 SER C CA 1 ATOM 3584 C C . SER C 3 57 ? -6.530 -75.840 -74.668 1.00 50.29 ? 57 SER C C 1 ATOM 3585 O O . SER C 3 57 ? -6.997 -76.785 -75.302 1.00 50.32 ? 57 SER C O 1 ATOM 3586 C CB . SER C 3 57 ? -4.238 -75.522 -75.601 1.00 50.36 ? 57 SER C CB 1 ATOM 3587 O OG . SER C 3 57 ? -4.435 -76.559 -76.546 1.00 50.23 ? 57 SER C OG 1 ATOM 3588 N N . ASN C 3 58 ? -7.276 -74.861 -74.169 1.00 50.00 ? 58 ASN C N 1 ATOM 3589 C CA . ASN C 3 58 ? -8.667 -74.675 -74.552 1.00 49.85 ? 58 ASN C CA 1 ATOM 3590 C C . ASN C 3 58 ? -8.858 -73.248 -75.039 1.00 49.69 ? 58 ASN C C 1 ATOM 3591 O O . ASN C 3 58 ? -8.537 -72.296 -74.327 1.00 49.77 ? 58 ASN C O 1 ATOM 3592 C CB . ASN C 3 58 ? -9.595 -74.963 -73.372 1.00 49.98 ? 58 ASN C CB 1 ATOM 3593 C CG . ASN C 3 58 ? -11.014 -74.489 -73.618 1.00 50.17 ? 58 ASN C CG 1 ATOM 3594 O OD1 . ASN C 3 58 ? -11.543 -74.623 -74.721 1.00 51.18 ? 58 ASN C OD1 1 ATOM 3595 N ND2 . ASN C 3 58 ? -11.638 -73.931 -72.587 1.00 49.57 ? 58 ASN C ND2 1 ATOM 3596 N N . GLY C 3 59 ? -9.377 -73.094 -76.251 1.00 49.31 ? 59 GLY C N 1 ATOM 3597 C CA . GLY C 3 59 ? -9.571 -71.770 -76.809 1.00 48.93 ? 59 GLY C CA 1 ATOM 3598 C C . GLY C 3 59 ? -8.259 -71.012 -76.786 1.00 48.62 ? 59 GLY C C 1 ATOM 3599 O O . GLY C 3 59 ? -7.219 -71.536 -77.185 1.00 48.66 ? 59 GLY C O 1 ATOM 3600 N N . ARG C 3 60 ? -8.309 -69.773 -76.308 1.00 48.46 ? 60 ARG C N 1 ATOM 3601 C CA . ARG C 3 60 ? -7.110 -68.964 -76.117 1.00 48.74 ? 60 ARG C CA 1 ATOM 3602 C C . ARG C 3 60 ? -6.173 -69.554 -75.061 1.00 49.04 ? 60 ARG C C 1 ATOM 3603 O O . ARG C 3 60 ? -4.953 -69.540 -75.222 1.00 49.54 ? 60 ARG C O 1 ATOM 3604 C CB . ARG C 3 60 ? -7.488 -67.530 -75.739 1.00 48.66 ? 60 ARG C CB 1 ATOM 3605 C CG . ARG C 3 60 ? -7.229 -66.510 -76.836 1.00 48.52 ? 60 ARG C CG 1 ATOM 3606 C CD . ARG C 3 60 ? -8.401 -65.555 -76.990 1.00 48.26 ? 60 ARG C CD 1 ATOM 3607 N NE . ARG C 3 60 ? -8.358 -64.474 -76.010 1.00 48.27 ? 60 ARG C NE 1 ATOM 3608 C CZ . ARG C 3 60 ? -9.381 -64.125 -75.237 1.00 47.76 ? 60 ARG C CZ 1 ATOM 3609 N NH1 . ARG C 3 60 ? -10.534 -64.774 -75.326 1.00 47.98 ? 60 ARG C NH1 1 ATOM 3610 N NH2 . ARG C 3 60 ? -9.252 -63.128 -74.373 1.00 47.00 ? 60 ARG C NH2 1 ATOM 3611 N N . TYR C 3 61 ? -6.757 -70.062 -73.979 1.00 46.97 ? 62 TYR C N 1 ATOM 3612 C CA . TYR C 3 61 ? -5.998 -70.533 -72.836 1.00 47.00 ? 62 TYR C CA 1 ATOM 3613 C C . TYR C 3 61 ? -5.087 -71.699 -73.191 1.00 47.37 ? 62 TYR C C 1 ATOM 3614 O O . TYR C 3 61 ? -5.475 -72.625 -73.903 1.00 47.65 ? 62 TYR C O 1 ATOM 3615 C CB . TYR C 3 61 ? -6.940 -70.933 -71.698 1.00 46.88 ? 62 TYR C CB 1 ATOM 3616 C CG . TYR C 3 61 ? -7.984 -69.888 -71.372 1.00 45.98 ? 62 TYR C CG 1 ATOM 3617 C CD1 . TYR C 3 61 ? -9.327 -70.113 -71.643 1.00 44.97 ? 62 TYR C CD1 1 ATOM 3618 C CD2 . TYR C 3 61 ? -7.626 -68.677 -70.795 1.00 45.74 ? 62 TYR C CD2 1 ATOM 3619 C CE1 . TYR C 3 61 ? -10.285 -69.161 -71.347 1.00 45.32 ? 62 TYR C CE1 1 ATOM 3620 C CE2 . TYR C 3 61 ? -8.576 -67.720 -70.495 1.00 45.77 ? 62 TYR C CE2 1 ATOM 3621 C CZ . TYR C 3 61 ? -9.903 -67.967 -70.773 1.00 45.65 ? 62 TYR C CZ 1 ATOM 3622 O OH . TYR C 3 61 ? -10.853 -67.016 -70.476 1.00 45.73 ? 62 TYR C OH 1 ATOM 3623 N N . SER C 3 62 ? -3.872 -71.633 -72.666 1.00 47.64 ? 63 SER C N 1 ATOM 3624 C CA . SER C 3 62 ? -2.911 -72.725 -72.721 1.00 48.06 ? 63 SER C CA 1 ATOM 3625 C C . SER C 3 62 ? -2.208 -72.825 -71.377 1.00 48.17 ? 63 SER C C 1 ATOM 3626 O O . SER C 3 62 ? -1.746 -71.820 -70.837 1.00 48.19 ? 63 SER C O 1 ATOM 3627 C CB . SER C 3 62 ? -1.891 -72.490 -73.837 1.00 48.16 ? 63 SER C CB 1 ATOM 3628 O OG . SER C 3 62 ? -1.596 -71.111 -73.974 1.00 48.90 ? 63 SER C OG 1 ATOM 3629 N N . ALA C 3 63 ? -2.131 -74.033 -70.831 1.00 48.34 ? 64 ALA C N 1 ATOM 3630 C CA . ALA C 3 63 ? -1.558 -74.209 -69.513 1.00 48.46 ? 64 ALA C CA 1 ATOM 3631 C C . ALA C 3 63 ? -0.589 -75.369 -69.502 1.00 48.67 ? 64 ALA C C 1 ATOM 3632 O O . ALA C 3 63 ? -0.794 -76.376 -70.188 1.00 48.66 ? 64 ALA C O 1 ATOM 3633 C CB . ALA C 3 63 ? -2.647 -74.410 -68.478 1.00 48.41 ? 64 ALA C CB 1 ATOM 3634 N N . THR C 3 64 ? 0.471 -75.203 -68.720 1.00 48.88 ? 65 THR C N 1 ATOM 3635 C CA . THR C 3 64 ? 1.492 -76.221 -68.550 1.00 49.15 ? 65 THR C CA 1 ATOM 3636 C C . THR C 3 64 ? 1.622 -76.535 -67.074 1.00 49.25 ? 65 THR C C 1 ATOM 3637 O O . THR C 3 64 ? 1.392 -75.668 -66.232 1.00 49.21 ? 65 THR C O 1 ATOM 3638 C CB . THR C 3 64 ? 2.854 -75.728 -69.051 1.00 49.15 ? 65 THR C CB 1 ATOM 3639 O OG1 . THR C 3 64 ? 3.167 -74.486 -68.408 1.00 49.35 ? 65 THR C OG1 1 ATOM 3640 C CG2 . THR C 3 64 ? 2.830 -75.523 -70.560 1.00 49.59 ? 65 THR C CG2 1 ATOM 3641 N N . LEU C 3 65 ? 1.999 -77.772 -66.766 1.00 49.53 ? 66 LEU C N 1 ATOM 3642 C CA . LEU C 3 65 ? 2.202 -78.200 -65.390 1.00 49.84 ? 66 LEU C CA 1 ATOM 3643 C C . LEU C 3 65 ? 3.475 -79.039 -65.340 1.00 50.29 ? 66 LEU C C 1 ATOM 3644 O O . LEU C 3 65 ? 3.715 -79.879 -66.215 1.00 50.28 ? 66 LEU C O 1 ATOM 3645 C CB . LEU C 3 65 ? 0.997 -79.022 -64.907 1.00 49.71 ? 66 LEU C CB 1 ATOM 3646 C CG . LEU C 3 65 ? 1.048 -79.891 -63.643 1.00 49.41 ? 66 LEU C CG 1 ATOM 3647 C CD1 . LEU C 3 65 ? 1.412 -79.110 -62.388 1.00 48.57 ? 66 LEU C CD1 1 ATOM 3648 C CD2 . LEU C 3 65 ? -0.279 -80.591 -63.463 1.00 49.46 ? 66 LEU C CD2 1 ATOM 3649 N N . ASP C 3 66 ? 4.305 -78.735 -64.354 1.00 50.82 ? 67 ASP C N 1 ATOM 3650 C CA . ASP C 3 66 ? 5.422 -79.585 -64.022 1.00 51.52 ? 67 ASP C CA 1 ATOM 3651 C C . ASP C 3 66 ? 5.104 -80.032 -62.614 1.00 52.10 ? 67 ASP C C 1 ATOM 3652 O O . ASP C 3 66 ? 4.936 -79.214 -61.709 1.00 52.02 ? 67 ASP C O 1 ATOM 3653 C CB . ASP C 3 66 ? 6.740 -78.816 -64.087 1.00 51.46 ? 67 ASP C CB 1 ATOM 3654 C CG . ASP C 3 66 ? 7.943 -79.698 -63.815 0.00 56.66 ? 67 ASP C CG 1 ATOM 3655 O OD1 . ASP C 3 66 ? 7.754 -80.912 -63.595 0.79 66.35 ? 67 ASP C OD1 1 ATOM 3656 O OD2 . ASP C 3 66 ? 9.078 -79.176 -63.822 1.00 56.93 ? 67 ASP C OD2 1 ATOM 3657 N N . LYS C 3 67 ? 5.009 -81.339 -62.441 1.00 52.89 ? 68 LYS C N 1 ATOM 3658 C CA . LYS C 3 67 ? 4.796 -81.935 -61.116 1.00 53.47 ? 68 LYS C CA 1 ATOM 3659 C C . LYS C 3 67 ? 6.057 -81.930 -60.275 1.00 54.07 ? 68 LYS C C 1 ATOM 3660 O O . LYS C 3 67 ? 6.019 -81.497 -59.124 1.00 54.20 ? 68 LYS C O 1 ATOM 3661 C CB . LYS C 3 67 ? 4.309 -83.368 -61.325 1.00 53.24 ? 68 LYS C CB 1 ATOM 3662 C CG . LYS C 3 67 ? 2.920 -83.444 -61.890 1.00 52.96 ? 68 LYS C CG 1 ATOM 3663 C CD . LYS C 3 67 ? 1.957 -84.111 -60.959 1.00 51.12 ? 68 LYS C CD 1 ATOM 3664 C CE . LYS C 3 67 ? 0.620 -84.216 -61.638 1.00 50.45 ? 68 LYS C CE 1 ATOM 3665 N NZ . LYS C 3 67 ? 0.111 -85.599 -61.552 1.00 49.61 ? 68 LYS C NZ 1 ATOM 3666 N N . ASP C 3 68 ? 7.167 -82.396 -60.854 1.00 54.72 ? 69 ASP C N 1 ATOM 3667 C CA . ASP C 3 68 ? 8.457 -82.401 -60.167 1.00 55.26 ? 69 ASP C CA 1 ATOM 3668 C C . ASP C 3 68 ? 8.658 -81.052 -59.503 1.00 55.53 ? 69 ASP C C 1 ATOM 3669 O O . ASP C 3 68 ? 8.977 -80.973 -58.316 1.00 55.72 ? 69 ASP C O 1 ATOM 3670 C CB . ASP C 3 68 ? 9.607 -82.657 -61.145 1.00 55.32 ? 69 ASP C CB 1 ATOM 3671 C CG . ASP C 3 68 ? 9.637 -84.078 -61.662 1.00 55.88 ? 69 ASP C CG 1 ATOM 3672 O OD1 . ASP C 3 68 ? 9.778 -84.256 -62.892 1.00 56.74 ? 69 ASP C OD1 1 ATOM 3673 O OD2 . ASP C 3 68 ? 9.526 -85.017 -60.844 1.00 56.78 ? 69 ASP C OD2 1 ATOM 3674 N N . ALA C 3 69 ? 8.431 -79.995 -60.278 1.00 55.71 ? 70 ALA C N 1 ATOM 3675 C CA . ALA C 3 69 ? 8.654 -78.630 -59.821 1.00 55.93 ? 70 ALA C CA 1 ATOM 3676 C C . ALA C 3 69 ? 7.516 -78.080 -58.945 1.00 55.94 ? 70 ALA C C 1 ATOM 3677 O O . ALA C 3 69 ? 7.684 -77.052 -58.277 1.00 55.89 ? 70 ALA C O 1 ATOM 3678 C CB . ALA C 3 69 ? 8.907 -77.721 -61.020 1.00 56.01 ? 70 ALA C CB 1 ATOM 3679 N N . LYS C 3 70 ? 6.377 -78.775 -58.944 1.00 55.92 ? 71 LYS C N 1 ATOM 3680 C CA . LYS C 3 70 ? 5.159 -78.336 -58.245 1.00 55.92 ? 71 LYS C CA 1 ATOM 3681 C C . LYS C 3 70 ? 4.777 -76.923 -58.654 1.00 55.62 ? 71 LYS C C 1 ATOM 3682 O O . LYS C 3 70 ? 4.691 -76.023 -57.825 1.00 55.55 ? 71 LYS C O 1 ATOM 3683 C CB . LYS C 3 70 ? 5.306 -78.441 -56.722 1.00 56.13 ? 71 LYS C CB 1 ATOM 3684 C CG . LYS C 3 70 ? 5.374 -79.863 -56.198 1.00 57.09 ? 71 LYS C CG 1 ATOM 3685 C CD . LYS C 3 70 ? 4.932 -79.934 -54.753 1.00 58.32 ? 71 LYS C CD 1 ATOM 3686 C CE . LYS C 3 70 ? 4.803 -81.376 -54.305 1.00 59.06 ? 71 LYS C CE 1 ATOM 3687 N NZ . LYS C 3 70 ? 3.784 -81.502 -53.229 1.00 59.86 ? 71 LYS C NZ 1 ATOM 3688 N N . HIS C 3 71 ? 4.539 -76.751 -59.948 1.00 55.50 ? 72 HIS C N 1 ATOM 3689 C CA . HIS C 3 71 ? 4.382 -75.432 -60.551 1.00 55.40 ? 72 HIS C CA 1 ATOM 3690 C C . HIS C 3 71 ? 3.478 -75.496 -61.780 1.00 54.83 ? 72 HIS C C 1 ATOM 3691 O O . HIS C 3 71 ? 3.517 -76.465 -62.541 1.00 54.91 ? 72 HIS C O 1 ATOM 3692 C CB . HIS C 3 71 ? 5.770 -74.900 -60.926 1.00 55.79 ? 72 HIS C CB 1 ATOM 3693 C CG . HIS C 3 71 ? 5.756 -73.594 -61.658 1.00 57.03 ? 72 HIS C CG 1 ATOM 3694 N ND1 . HIS C 3 71 ? 5.900 -73.506 -63.027 1.00 57.85 ? 72 HIS C ND1 1 ATOM 3695 C CD2 . HIS C 3 71 ? 5.646 -72.321 -61.208 1.00 58.14 ? 72 HIS C CD2 1 ATOM 3696 C CE1 . HIS C 3 71 ? 5.867 -72.236 -63.389 1.00 58.49 ? 72 HIS C CE1 1 ATOM 3697 N NE2 . HIS C 3 71 ? 5.711 -71.496 -62.305 1.00 58.93 ? 72 HIS C NE2 1 ATOM 3698 N N . SER C 3 72 ? 2.654 -74.471 -61.964 1.00 54.23 ? 73 SER C N 1 ATOM 3699 C CA . SER C 3 72 ? 1.818 -74.383 -63.154 1.00 53.76 ? 73 SER C CA 1 ATOM 3700 C C . SER C 3 72 ? 1.644 -72.961 -63.644 1.00 53.52 ? 73 SER C C 1 ATOM 3701 O O . SER C 3 72 ? 1.546 -72.017 -62.850 1.00 53.57 ? 73 SER C O 1 ATOM 3702 C CB . SER C 3 72 ? 0.446 -75.015 -62.935 1.00 53.73 ? 73 SER C CB 1 ATOM 3703 O OG . SER C 3 72 ? -0.331 -74.936 -64.121 1.00 53.35 ? 73 SER C OG 1 ATOM 3704 N N . THR C 3 73 ? 1.588 -72.828 -64.965 1.00 53.03 ? 74 THR C N 1 ATOM 3705 C CA . THR C 3 73 ? 1.420 -71.539 -65.598 1.00 52.46 ? 74 THR C CA 1 ATOM 3706 C C . THR C 3 73 ? 0.247 -71.559 -66.558 1.00 52.13 ? 74 THR C C 1 ATOM 3707 O O . THR C 3 73 ? 0.033 -72.536 -67.285 1.00 52.08 ? 74 THR C O 1 ATOM 3708 C CB . THR C 3 73 ? 2.689 -71.126 -66.338 1.00 52.54 ? 74 THR C CB 1 ATOM 3709 O OG1 . THR C 3 73 ? 3.782 -71.102 -65.416 1.00 52.49 ? 74 THR C OG1 1 ATOM 3710 C CG2 . THR C 3 73 ? 2.532 -69.753 -66.929 1.00 52.64 ? 74 THR C CG2 1 ATOM 3711 N N . LEU C 3 74 ? -0.511 -70.469 -66.534 1.00 51.71 ? 75 LEU C N 1 ATOM 3712 C CA . LEU C 3 74 ? -1.623 -70.266 -67.445 1.00 51.32 ? 75 LEU C CA 1 ATOM 3713 C C . LEU C 3 74 ? -1.320 -69.092 -68.364 1.00 51.32 ? 75 LEU C C 1 ATOM 3714 O O . LEU C 3 74 ? -1.034 -67.981 -67.907 1.00 51.17 ? 75 LEU C O 1 ATOM 3715 C CB . LEU C 3 74 ? -2.914 -70.005 -66.668 1.00 51.10 ? 75 LEU C CB 1 ATOM 3716 C CG . LEU C 3 74 ? -4.191 -69.851 -67.489 1.00 50.37 ? 75 LEU C CG 1 ATOM 3717 C CD1 . LEU C 3 74 ? -4.717 -71.204 -67.924 1.00 50.31 ? 75 LEU C CD1 1 ATOM 3718 C CD2 . LEU C 3 74 ? -5.228 -69.120 -66.688 1.00 49.83 ? 75 LEU C CD2 1 ATOM 3719 N N . HIS C 3 75 ? -1.385 -69.355 -69.664 1.00 51.33 ? 76 HIS C N 1 ATOM 3720 C CA . HIS C 3 75 ? -1.155 -68.338 -70.669 1.00 51.45 ? 76 HIS C CA 1 ATOM 3721 C C . HIS C 3 75 ? -2.480 -67.975 -71.311 1.00 51.51 ? 76 HIS C C 1 ATOM 3722 O O . HIS C 3 75 ? -3.263 -68.858 -71.673 1.00 51.64 ? 76 HIS C O 1 ATOM 3723 C CB . HIS C 3 75 ? -0.180 -68.847 -71.740 1.00 51.48 ? 76 HIS C CB 1 ATOM 3724 C CG . HIS C 3 75 ? 1.058 -69.486 -71.187 1.00 51.69 ? 76 HIS C CG 1 ATOM 3725 N ND1 . HIS C 3 75 ? 2.196 -68.770 -70.886 1.00 51.72 ? 76 HIS C ND1 1 ATOM 3726 C CD2 . HIS C 3 75 ? 1.338 -70.778 -70.886 1.00 52.22 ? 76 HIS C CD2 1 ATOM 3727 C CE1 . HIS C 3 75 ? 3.121 -69.591 -70.420 1.00 52.16 ? 76 HIS C CE1 1 ATOM 3728 N NE2 . HIS C 3 75 ? 2.624 -70.815 -70.407 1.00 51.87 ? 76 HIS C NE2 1 ATOM 3729 N N . ILE C 3 76 ? -2.735 -66.675 -71.438 1.00 51.65 ? 77 ILE C N 1 ATOM 3730 C CA . ILE C 3 76 ? -3.851 -66.184 -72.248 1.00 51.87 ? 77 ILE C CA 1 ATOM 3731 C C . ILE C 3 76 ? -3.289 -65.461 -73.467 1.00 51.94 ? 77 ILE C C 1 ATOM 3732 O O . ILE C 3 76 ? -2.622 -64.438 -73.321 1.00 52.13 ? 77 ILE C O 1 ATOM 3733 C CB . ILE C 3 76 ? -4.760 -65.212 -71.462 1.00 51.88 ? 77 ILE C CB 1 ATOM 3734 C CG1 . ILE C 3 76 ? -5.143 -65.808 -70.106 1.00 51.91 ? 77 ILE C CG1 1 ATOM 3735 C CG2 . ILE C 3 76 ? -6.009 -64.871 -72.276 1.00 51.88 ? 77 ILE C CG2 1 ATOM 3736 C CD1 . ILE C 3 76 ? -5.605 -64.786 -69.086 1.00 51.64 ? 77 ILE C CD1 1 ATOM 3737 N N . THR C 3 77 ? -3.547 -66.001 -74.657 1.00 51.98 ? 78 THR C N 1 ATOM 3738 C CA . THR C 3 77 ? -3.057 -65.409 -75.903 1.00 52.08 ? 78 THR C CA 1 ATOM 3739 C C . THR C 3 77 ? -4.052 -64.392 -76.440 1.00 52.30 ? 78 THR C C 1 ATOM 3740 O O . THR C 3 77 ? -5.263 -64.617 -76.402 1.00 52.30 ? 78 THR C O 1 ATOM 3741 C CB . THR C 3 77 ? -2.801 -66.482 -76.966 1.00 51.91 ? 78 THR C CB 1 ATOM 3742 O OG1 . THR C 3 77 ? -2.061 -67.549 -76.372 1.00 52.16 ? 78 THR C OG1 1 ATOM 3743 C CG2 . THR C 3 77 ? -2.011 -65.921 -78.135 1.00 51.83 ? 78 THR C CG2 1 ATOM 3744 N N . ALA C 3 78 ? -3.528 -63.273 -76.933 1.00 52.61 ? 79 ALA C N 1 ATOM 3745 C CA . ALA C 3 78 ? -4.341 -62.212 -77.521 1.00 52.94 ? 79 ALA C CA 1 ATOM 3746 C C . ALA C 3 78 ? -5.434 -61.760 -76.565 1.00 53.18 ? 79 ALA C C 1 ATOM 3747 O O . ALA C 3 78 ? -6.594 -61.668 -76.961 1.00 53.24 ? 79 ALA C O 1 ATOM 3748 C CB . ALA C 3 78 ? -4.947 -62.670 -78.859 1.00 52.83 ? 79 ALA C CB 1 ATOM 3749 N N . THR C 3 79 ? -5.059 -61.478 -75.313 1.00 53.53 ? 80 THR C N 1 ATOM 3750 C CA . THR C 3 79 ? -6.025 -61.107 -74.265 1.00 54.01 ? 80 THR C CA 1 ATOM 3751 C C . THR C 3 79 ? -7.081 -60.137 -74.772 1.00 54.34 ? 80 THR C C 1 ATOM 3752 O O . THR C 3 79 ? -6.767 -59.202 -75.513 1.00 54.53 ? 80 THR C O 1 ATOM 3753 C CB . THR C 3 79 ? -5.371 -60.474 -73.004 1.00 53.89 ? 80 THR C CB 1 ATOM 3754 O OG1 . THR C 3 79 ? -4.605 -59.325 -73.371 1.00 54.09 ? 80 THR C OG1 1 ATOM 3755 C CG2 . THR C 3 79 ? -4.479 -61.456 -72.289 1.00 54.28 ? 80 THR C CG2 1 ATOM 3756 N N . LEU C 3 80 ? -8.331 -60.373 -74.379 1.00 54.69 ? 81 LEU C N 1 ATOM 3757 C CA . LEU C 3 80 ? -9.430 -59.474 -74.718 1.00 54.90 ? 81 LEU C CA 1 ATOM 3758 C C . LEU C 3 80 ? -9.919 -58.751 -73.476 1.00 55.12 ? 81 LEU C C 1 ATOM 3759 O O . LEU C 3 80 ? -9.406 -58.979 -72.380 1.00 55.21 ? 81 LEU C O 1 ATOM 3760 C CB . LEU C 3 80 ? -10.569 -60.245 -75.384 1.00 54.76 ? 81 LEU C CB 1 ATOM 3761 C CG . LEU C 3 80 ? -10.218 -60.928 -76.705 1.00 54.66 ? 81 LEU C CG 1 ATOM 3762 C CD1 . LEU C 3 80 ? -11.385 -61.767 -77.188 1.00 54.40 ? 81 LEU C CD1 1 ATOM 3763 C CD2 . LEU C 3 80 ? -9.801 -59.908 -77.766 1.00 54.81 ? 81 LEU C CD2 1 ATOM 3764 N N . LEU C 3 81 ? -10.903 -57.877 -73.646 1.00 55.51 ? 82 LEU C N 1 ATOM 3765 C CA . LEU C 3 81 ? -11.499 -57.179 -72.509 1.00 55.87 ? 82 LEU C CA 1 ATOM 3766 C C . LEU C 3 81 ? -12.301 -58.117 -71.603 1.00 56.28 ? 82 LEU C C 1 ATOM 3767 O O . LEU C 3 81 ? -12.385 -57.882 -70.399 1.00 56.09 ? 82 LEU C O 1 ATOM 3768 C CB . LEU C 3 81 ? -12.362 -55.999 -72.971 1.00 55.82 ? 82 LEU C CB 1 ATOM 3769 C CG . LEU C 3 81 ? -11.672 -54.751 -73.537 1.00 55.12 ? 82 LEU C CG 1 ATOM 3770 C CD1 . LEU C 3 81 ? -12.697 -53.915 -74.259 1.00 55.00 ? 82 LEU C CD1 1 ATOM 3771 C CD2 . LEU C 3 81 ? -10.976 -53.926 -72.470 1.00 53.66 ? 82 LEU C CD2 1 ATOM 3772 N N . ASP C 3 82 ? -12.871 -59.175 -72.190 1.00 56.94 ? 83 ASP C N 1 ATOM 3773 C CA . ASP C 3 82 ? -13.579 -60.239 -71.445 1.00 57.73 ? 83 ASP C CA 1 ATOM 3774 C C . ASP C 3 82 ? -12.742 -60.855 -70.326 1.00 57.62 ? 83 ASP C C 1 ATOM 3775 O O . ASP C 3 82 ? -13.253 -61.168 -69.242 1.00 57.81 ? 83 ASP C O 1 ATOM 3776 C CB . ASP C 3 82 ? -14.007 -61.380 -72.379 1.00 57.97 ? 83 ASP C CB 1 ATOM 3777 C CG . ASP C 3 82 ? -15.051 -60.958 -73.391 1.00 59.92 ? 83 ASP C CG 1 ATOM 3778 O OD1 . ASP C 3 82 ? -15.116 -61.608 -74.465 1.00 61.88 ? 83 ASP C OD1 1 ATOM 3779 O OD2 . ASP C 3 82 ? -15.806 -59.989 -73.121 1.00 61.70 ? 83 ASP C OD2 1 ATOM 3780 N N . ASP C 3 83 ? -11.455 -61.030 -70.608 1.00 57.26 ? 84 ASP C N 1 ATOM 3781 C CA . ASP C 3 83 ? -10.552 -61.738 -69.730 1.00 57.00 ? 84 ASP C CA 1 ATOM 3782 C C . ASP C 3 83 ? -10.409 -61.072 -68.357 1.00 56.94 ? 84 ASP C C 1 ATOM 3783 O O . ASP C 3 83 ? -9.655 -61.547 -67.506 1.00 57.15 ? 84 ASP C O 1 ATOM 3784 C CB . ASP C 3 83 ? -9.191 -61.869 -70.416 1.00 57.03 ? 84 ASP C CB 1 ATOM 3785 C CG . ASP C 3 83 ? -9.265 -62.653 -71.715 1.00 57.14 ? 84 ASP C CG 1 ATOM 3786 O OD1 . ASP C 3 83 ? -8.370 -62.485 -72.564 1.00 57.14 ? 84 ASP C OD1 1 ATOM 3787 O OD2 . ASP C 3 83 ? -10.216 -63.441 -71.891 1.00 57.75 ? 84 ASP C OD2 1 ATOM 3788 N N . THR C 3 84 ? -11.256 -60.093 -68.072 1.00 56.48 ? 85 THR C N 1 ATOM 3789 C CA . THR C 3 84 ? -11.152 -59.312 -66.838 1.00 56.10 ? 85 THR C CA 1 ATOM 3790 C C . THR C 3 84 ? -11.264 -60.138 -65.545 1.00 55.64 ? 85 THR C C 1 ATOM 3791 O O . THR C 3 84 ? -10.595 -59.836 -64.557 1.00 56.02 ? 85 THR C O 1 ATOM 3792 C CB . THR C 3 84 ? -12.203 -58.185 -66.798 1.00 56.29 ? 85 THR C CB 1 ATOM 3793 O OG1 . THR C 3 84 ? -11.869 -57.182 -67.766 1.00 57.22 ? 85 THR C OG1 1 ATOM 3794 C CG2 . THR C 3 84 ? -12.254 -57.553 -65.416 1.00 56.05 ? 85 THR C CG2 1 ATOM 3795 N N . ALA C 3 85 ? -12.112 -61.163 -65.547 1.00 54.92 ? 86 ALA C N 1 ATOM 3796 C CA . ALA C 3 85 ? -12.429 -61.927 -64.335 1.00 54.34 ? 86 ALA C CA 1 ATOM 3797 C C . ALA C 3 85 ? -11.247 -62.680 -63.701 1.00 53.84 ? 86 ALA C C 1 ATOM 3798 O O . ALA C 3 85 ? -10.321 -63.108 -64.389 1.00 53.79 ? 86 ALA C O 1 ATOM 3799 C CB . ALA C 3 85 ? -13.583 -62.887 -64.605 1.00 54.48 ? 86 ALA C CB 1 ATOM 3800 N N . THR C 3 86 ? -11.303 -62.821 -62.376 1.00 53.30 ? 87 THR C N 1 ATOM 3801 C CA . THR C 3 86 ? -10.231 -63.410 -61.563 1.00 52.88 ? 87 THR C CA 1 ATOM 3802 C C . THR C 3 86 ? -9.989 -64.896 -61.838 1.00 52.55 ? 87 THR C C 1 ATOM 3803 O O . THR C 3 86 ? -10.897 -65.617 -62.251 1.00 52.56 ? 87 THR C O 1 ATOM 3804 C CB . THR C 3 86 ? -10.500 -63.221 -60.057 1.00 52.94 ? 87 THR C CB 1 ATOM 3805 O OG1 . THR C 3 86 ? -10.846 -61.854 -59.799 1.00 53.64 ? 87 THR C OG1 1 ATOM 3806 C CG2 . THR C 3 86 ? -9.268 -63.590 -59.245 1.00 52.64 ? 87 THR C CG2 1 ATOM 3807 N N . TYR C 3 87 ? -8.750 -65.338 -61.625 1.00 52.13 ? 88 TYR C N 1 ATOM 3808 C CA . TYR C 3 87 ? -8.300 -66.651 -62.098 1.00 51.77 ? 88 TYR C CA 1 ATOM 3809 C C . TYR C 3 87 ? -7.804 -67.548 -60.971 1.00 51.74 ? 88 TYR C C 1 ATOM 3810 O O . TYR C 3 87 ? -6.933 -67.145 -60.201 1.00 51.72 ? 88 TYR C O 1 ATOM 3811 C CB . TYR C 3 87 ? -7.223 -66.483 -63.183 1.00 51.72 ? 88 TYR C CB 1 ATOM 3812 C CG . TYR C 3 87 ? -7.790 -65.920 -64.461 1.00 50.98 ? 88 TYR C CG 1 ATOM 3813 C CD1 . TYR C 3 87 ? -7.728 -64.560 -64.734 1.00 50.13 ? 88 TYR C CD1 1 ATOM 3814 C CD2 . TYR C 3 87 ? -8.432 -66.745 -65.374 1.00 50.86 ? 88 TYR C CD2 1 ATOM 3815 C CE1 . TYR C 3 87 ? -8.277 -64.038 -65.893 1.00 50.60 ? 88 TYR C CE1 1 ATOM 3816 C CE2 . TYR C 3 87 ? -8.975 -66.237 -66.538 1.00 51.39 ? 88 TYR C CE2 1 ATOM 3817 C CZ . TYR C 3 87 ? -8.900 -64.882 -66.796 1.00 51.13 ? 88 TYR C CZ 1 ATOM 3818 O OH . TYR C 3 87 ? -9.454 -64.385 -67.960 1.00 51.52 ? 88 TYR C OH 1 ATOM 3819 N N . ILE C 3 88 ? -8.348 -68.767 -60.898 1.00 51.63 ? 89 ILE C N 1 ATOM 3820 C CA . ILE C 3 88 ? -8.162 -69.645 -59.731 1.00 51.52 ? 89 ILE C CA 1 ATOM 3821 C C . ILE C 3 88 ? -7.509 -71.004 -60.025 1.00 51.56 ? 89 ILE C C 1 ATOM 3822 O O . ILE C 3 88 ? -8.066 -71.848 -60.744 1.00 51.37 ? 89 ILE C O 1 ATOM 3823 C CB . ILE C 3 88 ? -9.496 -69.832 -58.938 1.00 51.50 ? 89 ILE C CB 1 ATOM 3824 C CG1 . ILE C 3 88 ? -10.046 -68.472 -58.495 1.00 51.38 ? 89 ILE C CG1 1 ATOM 3825 C CG2 . ILE C 3 88 ? -9.288 -70.714 -57.712 1.00 51.41 ? 89 ILE C CG2 1 ATOM 3826 C CD1 . ILE C 3 88 ? -11.484 -68.492 -58.024 1.00 51.98 ? 89 ILE C CD1 1 ATOM 3827 N N . CYS C 3 89 ? -6.328 -71.191 -59.434 1.00 51.71 ? 90 CYS C N 1 ATOM 3828 C CA . CYS C 3 89 ? -5.570 -72.442 -59.490 1.00 52.06 ? 90 CYS C CA 1 ATOM 3829 C C . CYS C 3 89 ? -6.032 -73.404 -58.393 1.00 51.88 ? 90 CYS C C 1 ATOM 3830 O O . CYS C 3 89 ? -6.016 -73.053 -57.210 1.00 52.01 ? 90 CYS C O 1 ATOM 3831 C CB . CYS C 3 89 ? -4.072 -72.154 -59.325 1.00 52.18 ? 90 CYS C CB 1 ATOM 3832 S SG . CYS C 3 89 ? -2.999 -73.615 -59.421 1.00 53.73 ? 90 CYS C SG 1 ATOM 3833 N N . VAL C 3 90 ? -6.426 -74.616 -58.788 1.00 51.49 ? 91 VAL C N 1 ATOM 3834 C CA . VAL C 3 90 ? -6.977 -75.604 -57.860 1.00 51.09 ? 91 VAL C CA 1 ATOM 3835 C C . VAL C 3 90 ? -6.310 -76.977 -58.013 1.00 51.09 ? 91 VAL C C 1 ATOM 3836 O O . VAL C 3 90 ? -6.332 -77.557 -59.103 1.00 51.13 ? 91 VAL C O 1 ATOM 3837 C CB . VAL C 3 90 ? -8.494 -75.767 -58.076 1.00 51.00 ? 91 VAL C CB 1 ATOM 3838 C CG1 . VAL C 3 90 ? -9.074 -76.735 -57.065 1.00 51.41 ? 91 VAL C CG1 1 ATOM 3839 C CG2 . VAL C 3 90 ? -9.199 -74.431 -57.987 1.00 50.54 ? 91 VAL C CG2 1 ATOM 3840 N N . VAL C 3 91 ? -5.732 -77.494 -56.921 1.00 51.06 ? 92 VAL C N 1 ATOM 3841 C CA . VAL C 3 91 ? -5.090 -78.829 -56.915 1.00 51.04 ? 92 VAL C CA 1 ATOM 3842 C C . VAL C 3 91 ? -5.971 -79.883 -56.247 1.00 50.99 ? 92 VAL C C 1 ATOM 3843 O O . VAL C 3 91 ? -6.480 -79.660 -55.152 1.00 50.88 ? 92 VAL C O 1 ATOM 3844 C CB . VAL C 3 91 ? -3.706 -78.842 -56.207 1.00 50.96 ? 92 VAL C CB 1 ATOM 3845 C CG1 . VAL C 3 91 ? -2.986 -80.170 -56.457 1.00 50.30 ? 92 VAL C CG1 1 ATOM 3846 C CG2 . VAL C 3 91 ? -2.844 -77.675 -56.666 1.00 51.09 ? 92 VAL C CG2 1 ATOM 3847 N N . GLY C 3 92 ? -6.132 -81.024 -56.920 1.00 51.03 ? 93 GLY C N 1 ATOM 3848 C CA . GLY C 3 92 ? -6.889 -82.166 -56.401 1.00 50.88 ? 93 GLY C CA 1 ATOM 3849 C C . GLY C 3 92 ? -5.943 -83.260 -55.952 1.00 50.81 ? 93 GLY C C 1 ATOM 3850 O O . GLY C 3 92 ? -4.944 -83.540 -56.627 1.00 50.97 ? 93 GLY C O 1 ATOM 3851 N N . ASP C 3 93 ? -6.246 -83.883 -54.817 1.00 50.49 ? 94 ASP C N 1 ATOM 3852 C CA . ASP C 3 93 ? -5.296 -84.824 -54.234 1.00 50.23 ? 94 ASP C CA 1 ATOM 3853 C C . ASP C 3 93 ? -5.625 -86.318 -54.381 1.00 50.05 ? 94 ASP C C 1 ATOM 3854 O O . ASP C 3 93 ? -4.903 -87.158 -53.849 1.00 50.25 ? 94 ASP C O 1 ATOM 3855 C CB . ASP C 3 93 ? -4.974 -84.452 -52.783 1.00 50.27 ? 94 ASP C CB 1 ATOM 3856 C CG . ASP C 3 93 ? -6.156 -84.605 -51.855 1.00 50.43 ? 94 ASP C CG 1 ATOM 3857 O OD1 . ASP C 3 93 ? -6.325 -83.736 -50.981 1.00 50.44 ? 94 ASP C OD1 1 ATOM 3858 O OD2 . ASP C 3 93 ? -6.912 -85.588 -51.983 1.00 51.26 ? 94 ASP C OD2 1 ATOM 3859 N N . ARG C 3 94 ? -6.695 -86.654 -55.096 1.00 49.60 ? 95 ARG C N 1 ATOM 3860 C CA . ARG C 3 94 ? -6.948 -88.052 -55.453 1.00 49.30 ? 95 ARG C CA 1 ATOM 3861 C C . ARG C 3 94 ? -7.498 -88.158 -56.867 1.00 49.24 ? 95 ARG C C 1 ATOM 3862 O O . ARG C 3 94 ? -8.196 -87.263 -57.330 1.00 49.30 ? 95 ARG C O 1 ATOM 3863 C CB . ARG C 3 94 ? -7.943 -88.719 -54.493 1.00 49.25 ? 95 ARG C CB 1 ATOM 3864 C CG . ARG C 3 94 ? -7.593 -88.688 -53.017 1.00 48.57 ? 95 ARG C CG 1 ATOM 3865 C CD . ARG C 3 94 ? -6.556 -89.718 -52.640 1.00 47.41 ? 95 ARG C CD 1 ATOM 3866 N NE . ARG C 3 94 ? -6.369 -89.790 -51.194 1.00 46.87 ? 95 ARG C NE 1 ATOM 3867 C CZ . ARG C 3 94 ? -5.711 -88.889 -50.467 1.00 47.42 ? 95 ARG C CZ 1 ATOM 3868 N NH1 . ARG C 3 94 ? -5.181 -87.813 -51.031 1.00 47.80 ? 95 ARG C NH1 1 ATOM 3869 N NH2 . ARG C 3 94 ? -5.596 -89.054 -49.159 1.00 47.98 ? 95 ARG C NH2 1 ATOM 3870 N N . GLY C 3 95 ? -7.196 -89.265 -57.537 1.00 49.05 ? 96 GLY C N 1 ATOM 3871 C CA . GLY C 3 95 ? -7.803 -89.577 -58.822 1.00 48.94 ? 96 GLY C CA 1 ATOM 3872 C C . GLY C 3 95 ? -9.176 -90.189 -58.655 1.00 49.00 ? 96 GLY C C 1 ATOM 3873 O O . GLY C 3 95 ? -9.831 -90.535 -59.635 1.00 49.16 ? 96 GLY C O 1 ATOM 3874 N N . SER C 3 96 ? -9.608 -90.324 -57.407 1.00 49.08 ? 97 SER C N 1 ATOM 3875 C CA . SER C 3 96 ? -10.937 -90.838 -57.085 1.00 49.21 ? 97 SER C CA 1 ATOM 3876 C C . SER C 3 96 ? -11.793 -89.716 -56.539 1.00 49.04 ? 97 SER C C 1 ATOM 3877 O O . SER C 3 96 ? -11.267 -88.707 -56.074 1.00 48.93 ? 97 SER C O 1 ATOM 3878 C CB . SER C 3 96 ? -10.841 -91.959 -56.046 1.00 49.30 ? 97 SER C CB 1 ATOM 3879 O OG . SER C 3 96 ? -10.163 -91.517 -54.876 1.00 49.78 ? 97 SER C OG 1 ATOM 3880 N N . ALA C 3 97 ? -13.110 -89.902 -56.580 1.00 49.12 ? 98 ALA C N 1 ATOM 3881 C CA . ALA C 3 97 ? -14.055 -88.946 -55.983 1.00 49.23 ? 98 ALA C CA 1 ATOM 3882 C C . ALA C 3 97 ? -13.920 -88.833 -54.460 1.00 49.36 ? 98 ALA C C 1 ATOM 3883 O O . ALA C 3 97 ? -14.545 -87.972 -53.840 1.00 49.40 ? 98 ALA C O 1 ATOM 3884 C CB . ALA C 3 97 ? -15.473 -89.301 -56.356 1.00 49.03 ? 98 ALA C CB 1 ATOM 3885 N N . LEU C 3 98 ? -13.107 -89.705 -53.873 1.00 49.49 ? 99 LEU C N 1 ATOM 3886 C CA . LEU C 3 98 ? -12.715 -89.569 -52.476 1.00 49.64 ? 99 LEU C CA 1 ATOM 3887 C C . LEU C 3 98 ? -11.896 -88.291 -52.299 1.00 49.68 ? 99 LEU C C 1 ATOM 3888 O O . LEU C 3 98 ? -12.055 -87.564 -51.319 1.00 50.21 ? 99 LEU C O 1 ATOM 3889 C CB . LEU C 3 98 ? -11.904 -90.785 -52.021 1.00 49.72 ? 99 LEU C CB 1 ATOM 3890 C CG . LEU C 3 98 ? -12.637 -92.129 -52.023 1.00 50.28 ? 99 LEU C CG 1 ATOM 3891 C CD1 . LEU C 3 98 ? -11.690 -93.270 -51.680 1.00 50.82 ? 99 LEU C CD1 1 ATOM 3892 C CD2 . LEU C 3 98 ? -13.817 -92.100 -51.063 1.00 50.59 ? 99 LEU C CD2 1 ATOM 3893 N N . GLY C 3 99 ? -11.020 -88.033 -53.266 1.00 49.57 ? 100 GLY C N 1 ATOM 3894 C CA . GLY C 3 99 ? -10.137 -86.879 -53.242 1.00 49.32 ? 100 GLY C CA 1 ATOM 3895 C C . GLY C 3 99 ? -10.840 -85.547 -53.421 1.00 49.17 ? 100 GLY C C 1 ATOM 3896 O O . GLY C 3 99 ? -11.862 -85.459 -54.103 1.00 49.23 ? 100 GLY C O 1 ATOM 3897 N N . ARG C 3 100 ? -10.078 -84.490 -52.839 1.00 54.41 ? 103 ARG C N 1 ATOM 3898 C CA . ARG C 3 100 ? -10.767 -83.205 -52.888 1.00 54.47 ? 103 ARG C CA 1 ATOM 3899 C C . ARG C 3 100 ? -9.919 -82.149 -53.588 1.00 54.17 ? 103 ARG C C 1 ATOM 3900 O O . ARG C 3 100 ? -8.813 -82.448 -54.039 1.00 54.20 ? 103 ARG C O 1 ATOM 3901 C CB . ARG C 3 100 ? -11.139 -82.740 -51.479 1.00 54.65 ? 103 ARG C CB 1 ATOM 3902 C CG . ARG C 3 100 ? -12.525 -83.170 -51.031 1.00 56.03 ? 103 ARG C CG 1 ATOM 3903 C CD . ARG C 3 100 ? -12.508 -84.570 -50.441 1.00 58.49 ? 103 ARG C CD 1 ATOM 3904 N NE . ARG C 3 100 ? -12.267 -84.558 -49.001 1.00 61.39 ? 103 ARG C NE 1 ATOM 3905 C CZ . ARG C 3 100 ? -12.831 -83.703 -48.155 1.00 63.14 ? 103 ARG C CZ 1 ATOM 3906 N NH1 . ARG C 3 100 ? -13.675 -82.784 -48.601 1.00 63.48 ? 103 ARG C NH1 1 ATOM 3907 N NH2 . ARG C 3 100 ? -12.551 -83.767 -46.861 1.00 63.53 ? 103 ARG C NH2 1 ATOM 3908 N N . LEU C 3 101 ? -10.252 -80.892 -53.311 1.00 53.71 ? 104 LEU C N 1 ATOM 3909 C CA . LEU C 3 101 ? -9.715 -79.777 -54.062 1.00 53.31 ? 104 LEU C CA 1 ATOM 3910 C C . LEU C 3 101 ? -9.112 -78.781 -53.084 1.00 53.28 ? 104 LEU C C 1 ATOM 3911 O O . LEU C 3 101 ? -9.695 -78.504 -52.031 1.00 53.47 ? 104 LEU C O 1 ATOM 3912 C CB . LEU C 3 101 ? -10.802 -79.127 -54.916 1.00 53.15 ? 104 LEU C CB 1 ATOM 3913 C CG . LEU C 3 101 ? -11.518 -80.009 -55.945 1.00 52.88 ? 104 LEU C CG 1 ATOM 3914 C CD1 . LEU C 3 101 ? -12.838 -79.374 -56.365 1.00 52.71 ? 104 LEU C CD1 1 ATOM 3915 C CD2 . LEU C 3 101 ? -10.636 -80.272 -57.159 1.00 52.98 ? 104 LEU C CD2 1 ATOM 3916 N N . HIS C 3 102 ? -7.930 -78.275 -53.429 1.00 53.06 ? 105 HIS C N 1 ATOM 3917 C CA . HIS C 3 102 ? -7.226 -77.273 -52.640 1.00 52.83 ? 105 HIS C CA 1 ATOM 3918 C C . HIS C 3 102 ? -7.144 -75.987 -53.455 1.00 52.95 ? 105 HIS C C 1 ATOM 3919 O O . HIS C 3 102 ? -6.566 -75.973 -54.542 1.00 53.10 ? 105 HIS C O 1 ATOM 3920 C CB . HIS C 3 102 ? -5.834 -77.778 -52.271 1.00 52.68 ? 105 HIS C CB 1 ATOM 3921 C CG . HIS C 3 102 ? -5.850 -79.046 -51.478 1.00 52.46 ? 105 HIS C CG 1 ATOM 3922 N ND1 . HIS C 3 102 ? -5.397 -79.118 -50.178 1.00 52.14 ? 105 HIS C ND1 1 ATOM 3923 C CD2 . HIS C 3 102 ? -6.281 -80.289 -51.796 1.00 52.47 ? 105 HIS C CD2 1 ATOM 3924 C CE1 . HIS C 3 102 ? -5.541 -80.354 -49.734 1.00 52.31 ? 105 HIS C CE1 1 ATOM 3925 N NE2 . HIS C 3 102 ? -6.079 -81.083 -50.695 1.00 52.37 ? 105 HIS C NE2 1 ATOM 3926 N N . PHE C 3 103 ? -7.732 -74.915 -52.929 1.00 52.94 ? 106 PHE C N 1 ATOM 3927 C CA . PHE C 3 103 ? -7.938 -73.694 -53.698 1.00 52.78 ? 106 PHE C CA 1 ATOM 3928 C C . PHE C 3 103 ? -6.881 -72.635 -53.447 1.00 53.06 ? 106 PHE C C 1 ATOM 3929 O O . PHE C 3 103 ? -6.515 -72.373 -52.303 1.00 53.05 ? 106 PHE C O 1 ATOM 3930 C CB . PHE C 3 103 ? -9.321 -73.112 -53.407 1.00 52.69 ? 106 PHE C CB 1 ATOM 3931 C CG . PHE C 3 103 ? -10.456 -73.919 -53.976 1.00 51.88 ? 106 PHE C CG 1 ATOM 3932 C CD1 . PHE C 3 103 ? -10.822 -75.134 -53.411 1.00 51.17 ? 106 PHE C CD1 1 ATOM 3933 C CD2 . PHE C 3 103 ? -11.174 -73.448 -55.063 1.00 51.48 ? 106 PHE C CD2 1 ATOM 3934 C CE1 . PHE C 3 103 ? -11.873 -75.875 -53.929 1.00 51.05 ? 106 PHE C CE1 1 ATOM 3935 C CE2 . PHE C 3 103 ? -12.227 -74.185 -55.591 1.00 51.55 ? 106 PHE C CE2 1 ATOM 3936 C CZ . PHE C 3 103 ? -12.578 -75.401 -55.020 1.00 51.27 ? 106 PHE C CZ 1 ATOM 3937 N N . GLY C 3 104 ? -6.393 -72.044 -54.537 1.00 53.46 ? 107 GLY C N 1 ATOM 3938 C CA . GLY C 3 104 ? -5.537 -70.866 -54.491 1.00 53.91 ? 107 GLY C CA 1 ATOM 3939 C C . GLY C 3 104 ? -6.386 -69.620 -54.335 1.00 54.39 ? 107 GLY C C 1 ATOM 3940 O O . GLY C 3 104 ? -7.572 -69.622 -54.674 1.00 54.35 ? 107 GLY C O 1 ATOM 3941 N N . ALA C 3 105 ? -5.778 -68.555 -53.817 1.00 54.93 ? 108 ALA C N 1 ATOM 3942 C CA . ALA C 3 105 ? -6.493 -67.321 -53.500 1.00 55.43 ? 108 ALA C CA 1 ATOM 3943 C C . ALA C 3 105 ? -6.854 -66.490 -54.739 1.00 55.97 ? 108 ALA C C 1 ATOM 3944 O O . ALA C 3 105 ? -7.600 -65.514 -54.645 1.00 55.99 ? 108 ALA C O 1 ATOM 3945 C CB . ALA C 3 105 ? -5.694 -66.495 -52.500 1.00 55.32 ? 108 ALA C CB 1 ATOM 3946 N N . GLY C 3 106 ? -6.323 -66.878 -55.894 1.00 56.68 ? 109 GLY C N 1 ATOM 3947 C CA . GLY C 3 106 ? -6.689 -66.247 -57.156 1.00 57.57 ? 109 GLY C CA 1 ATOM 3948 C C . GLY C 3 106 ? -5.886 -65.018 -57.539 1.00 58.21 ? 109 GLY C C 1 ATOM 3949 O O . GLY C 3 106 ? -5.269 -64.370 -56.692 1.00 58.11 ? 109 GLY C O 1 ATOM 3950 N N . THR C 3 107 ? -5.918 -64.707 -58.832 1.00 58.93 ? 110 THR C N 1 ATOM 3951 C CA . THR C 3 107 ? -5.226 -63.564 -59.400 1.00 59.73 ? 110 THR C CA 1 ATOM 3952 C C . THR C 3 107 ? -6.223 -62.722 -60.186 1.00 60.47 ? 110 THR C C 1 ATOM 3953 O O . THR C 3 107 ? -6.902 -63.239 -61.072 1.00 60.60 ? 110 THR C O 1 ATOM 3954 C CB . THR C 3 107 ? -4.123 -64.040 -60.356 1.00 59.65 ? 110 THR C CB 1 ATOM 3955 O OG1 . THR C 3 107 ? -3.156 -64.808 -59.631 1.00 59.68 ? 110 THR C OG1 1 ATOM 3956 C CG2 . THR C 3 107 ? -3.433 -62.866 -61.025 1.00 59.92 ? 110 THR C CG2 1 ATOM 3957 N N . GLN C 3 108 ? -6.327 -61.434 -59.860 1.00 61.36 ? 111 GLN C N 1 ATOM 3958 C CA . GLN C 3 108 ? -7.113 -60.525 -60.681 1.00 62.35 ? 111 GLN C CA 1 ATOM 3959 C C . GLN C 3 108 ? -6.316 -60.158 -61.917 1.00 63.01 ? 111 GLN C C 1 ATOM 3960 O O . GLN C 3 108 ? -5.142 -59.785 -61.821 1.00 63.21 ? 111 GLN C O 1 ATOM 3961 C CB . GLN C 3 108 ? -7.487 -59.253 -59.926 1.00 62.33 ? 111 GLN C CB 1 ATOM 3962 C CG . GLN C 3 108 ? -8.756 -59.369 -59.103 1.00 63.51 ? 111 GLN C CG 1 ATOM 3963 C CD . GLN C 3 108 ? -8.495 -59.829 -57.673 1.00 64.85 ? 111 GLN C CD 1 ATOM 3964 O OE1 . GLN C 3 108 ? -7.631 -59.281 -56.979 1.00 65.49 ? 111 GLN C OE1 1 ATOM 3965 N NE2 . GLN C 3 108 ? -9.255 -60.830 -57.220 1.00 64.77 ? 111 GLN C NE2 1 ATOM 3966 N N . LEU C 3 109 ? -6.949 -60.287 -63.078 1.00 63.73 ? 112 LEU C N 1 ATOM 3967 C CA . LEU C 3 109 ? -6.381 -59.775 -64.310 1.00 64.39 ? 112 LEU C CA 1 ATOM 3968 C C . LEU C 3 109 ? -7.056 -58.456 -64.597 1.00 65.28 ? 112 LEU C C 1 ATOM 3969 O O . LEU C 3 109 ? -8.254 -58.319 -64.390 1.00 65.31 ? 112 LEU C O 1 ATOM 3970 C CB . LEU C 3 109 ? -6.620 -60.742 -65.463 1.00 64.08 ? 112 LEU C CB 1 ATOM 3971 C CG . LEU C 3 109 ? -5.893 -60.425 -66.767 1.00 63.45 ? 112 LEU C CG 1 ATOM 3972 C CD1 . LEU C 3 109 ? -4.384 -60.553 -66.618 1.00 62.79 ? 112 LEU C CD1 1 ATOM 3973 C CD2 . LEU C 3 109 ? -6.398 -61.335 -67.851 1.00 63.24 ? 112 LEU C CD2 1 ATOM 3974 N N . ILE C 3 110 ? -6.283 -57.474 -65.044 1.00 66.53 ? 113 ILE C N 1 ATOM 3975 C CA . ILE C 3 110 ? -6.846 -56.192 -65.448 1.00 67.73 ? 113 ILE C CA 1 ATOM 3976 C C . ILE C 3 110 ? -6.372 -55.876 -66.860 1.00 68.65 ? 113 ILE C C 1 ATOM 3977 O O . ILE C 3 110 ? -5.197 -55.548 -67.085 1.00 68.76 ? 113 ILE C O 1 ATOM 3978 C CB . ILE C 3 110 ? -6.483 -55.047 -64.468 1.00 67.64 ? 113 ILE C CB 1 ATOM 3979 C CG1 . ILE C 3 110 ? -6.970 -55.369 -63.049 1.00 67.56 ? 113 ILE C CG1 1 ATOM 3980 C CG2 . ILE C 3 110 ? -7.112 -53.743 -64.934 1.00 68.19 ? 113 ILE C CG2 1 ATOM 3981 C CD1 . ILE C 3 110 ? -6.282 -54.579 -61.942 1.00 66.83 ? 113 ILE C CD1 1 ATOM 3982 N N . VAL C 3 111 ? -7.291 -55.999 -67.810 1.00 69.82 ? 114 VAL C N 1 ATOM 3983 C CA . VAL C 3 111 ? -6.969 -55.766 -69.210 1.00 71.11 ? 114 VAL C CA 1 ATOM 3984 C C . VAL C 3 111 ? -7.241 -54.303 -69.566 1.00 72.06 ? 114 VAL C C 1 ATOM 3985 O O . VAL C 3 111 ? -8.378 -53.838 -69.480 1.00 72.38 ? 114 VAL C O 1 ATOM 3986 C CB . VAL C 3 111 ? -7.701 -56.771 -70.155 1.00 70.95 ? 114 VAL C CB 1 ATOM 3987 C CG1 . VAL C 3 111 ? -9.180 -56.876 -69.820 1.00 71.10 ? 114 VAL C CG1 1 ATOM 3988 C CG2 . VAL C 3 111 ? -7.491 -56.406 -71.613 1.00 71.13 ? 114 VAL C CG2 1 ATOM 3989 N N . ILE C 3 112 ? -6.178 -53.586 -69.930 1.00 73.23 ? 115 ILE C N 1 ATOM 3990 C CA . ILE C 3 112 ? -6.260 -52.178 -70.340 1.00 74.26 ? 115 ILE C CA 1 ATOM 3991 C C . ILE C 3 112 ? -6.457 -52.045 -71.866 1.00 75.18 ? 115 ILE C C 1 ATOM 3992 O O . ILE C 3 112 ? -5.823 -52.773 -72.644 1.00 75.31 ? 115 ILE C O 1 ATOM 3993 C CB . ILE C 3 112 ? -5.016 -51.388 -69.852 1.00 74.10 ? 115 ILE C CB 1 ATOM 3994 C CG1 . ILE C 3 112 ? -5.161 -51.040 -68.368 1.00 74.10 ? 115 ILE C CG1 1 ATOM 3995 C CG2 . ILE C 3 112 ? -4.798 -50.123 -70.675 1.00 74.24 ? 115 ILE C CG2 1 ATOM 3996 C CD1 . ILE C 3 112 ? -3.931 -50.376 -67.751 1.00 74.04 ? 115 ILE C CD1 1 ATOM 3997 N N . PRO C 3 113 ? -7.345 -51.122 -72.295 1.00 76.03 ? 116 PRO C N 1 ATOM 3998 C CA . PRO C 3 113 ? -7.627 -50.943 -73.718 1.00 76.85 ? 116 PRO C CA 1 ATOM 3999 C C . PRO C 3 113 ? -6.504 -50.233 -74.466 1.00 77.85 ? 116 PRO C C 1 ATOM 4000 O O . PRO C 3 113 ? -5.764 -49.435 -73.877 1.00 77.94 ? 116 PRO C O 1 ATOM 4001 C CB . PRO C 3 113 ? -8.867 -50.057 -73.706 1.00 76.69 ? 116 PRO C CB 1 ATOM 4002 C CG . PRO C 3 113 ? -8.715 -49.252 -72.468 1.00 76.36 ? 116 PRO C CG 1 ATOM 4003 C CD . PRO C 3 113 ? -8.148 -50.205 -71.466 1.00 76.03 ? 116 PRO C CD 1 ATOM 4004 N N . ASP C 3 114 ? -6.388 -50.531 -75.758 1.00 79.03 ? 117 ASP C N 1 ATOM 4005 C CA . ASP C 3 114 ? -5.462 -49.827 -76.631 1.00 80.17 ? 117 ASP C CA 1 ATOM 4006 C C . ASP C 3 114 ? -6.242 -48.775 -77.415 1.00 81.05 ? 117 ASP C C 1 ATOM 4007 O O . ASP C 3 114 ? -6.832 -49.075 -78.465 1.00 81.12 ? 117 ASP C O 1 ATOM 4008 C CB . ASP C 3 114 ? -4.748 -50.803 -77.573 1.00 80.15 ? 117 ASP C CB 1 ATOM 4009 C CG . ASP C 3 114 ? -3.509 -50.200 -78.219 1.00 80.11 ? 117 ASP C CG 1 ATOM 4010 O OD1 . ASP C 3 114 ? -3.223 -49.009 -77.982 1.00 79.60 ? 117 ASP C OD1 1 ATOM 4011 O OD2 . ASP C 3 114 ? -2.816 -50.922 -78.967 1.00 80.37 ? 117 ASP C OD2 1 ATOM 4012 N N . ILE C 3 115 ? -6.256 -47.551 -76.877 1.00 82.09 ? 118 ILE C N 1 ATOM 4013 C CA . ILE C 3 115 ? -6.951 -46.413 -77.494 1.00 83.11 ? 118 ILE C CA 1 ATOM 4014 C C . ILE C 3 115 ? -6.122 -45.874 -78.665 1.00 83.88 ? 118 ILE C C 1 ATOM 4015 O O . ILE C 3 115 ? -5.122 -45.177 -78.461 1.00 83.91 ? 118 ILE C O 1 ATOM 4016 C CB . ILE C 3 115 ? -7.245 -45.273 -76.467 1.00 83.01 ? 118 ILE C CB 1 ATOM 4017 C CG1 . ILE C 3 115 ? -7.811 -45.830 -75.152 1.00 83.01 ? 118 ILE C CG1 1 ATOM 4018 C CG2 . ILE C 3 115 ? -8.180 -44.217 -77.072 1.00 82.88 ? 118 ILE C CG2 1 ATOM 4019 C CD1 . ILE C 3 115 ? -9.293 -46.203 -75.192 1.00 82.57 ? 118 ILE C CD1 1 ATOM 4020 N N . GLN C 3 116 ? -6.540 -46.204 -79.886 1.00 84.91 ? 119 GLN C N 1 ATOM 4021 C CA . GLN C 3 116 ? -5.736 -45.906 -81.076 1.00 85.98 ? 119 GLN C CA 1 ATOM 4022 C C . GLN C 3 116 ? -5.814 -44.442 -81.521 1.00 86.61 ? 119 GLN C C 1 ATOM 4023 O O . GLN C 3 116 ? -4.855 -43.919 -82.102 1.00 86.81 ? 119 GLN C O 1 ATOM 4024 C CB . GLN C 3 116 ? -6.054 -46.870 -82.231 1.00 86.00 ? 119 GLN C CB 1 ATOM 4025 C CG . GLN C 3 116 ? -5.571 -48.321 -81.999 1.00 86.55 ? 119 GLN C CG 1 ATOM 4026 C CD . GLN C 3 116 ? -4.066 -48.541 -82.228 1.00 86.86 ? 119 GLN C CD 1 ATOM 4027 O OE1 . GLN C 3 116 ? -3.672 -49.497 -82.896 1.00 87.09 ? 119 GLN C OE1 1 ATOM 4028 N NE2 . GLN C 3 116 ? -3.229 -47.672 -81.663 1.00 86.81 ? 119 GLN C NE2 1 ATOM 4029 N N . ASN C 3 117 ? -6.946 -43.790 -81.245 1.00 87.24 ? 120 ASN C N 1 ATOM 4030 C CA . ASN C 3 117 ? -7.085 -42.348 -81.477 1.00 87.76 ? 120 ASN C CA 1 ATOM 4031 C C . ASN C 3 117 ? -7.736 -41.632 -80.285 1.00 87.95 ? 120 ASN C C 1 ATOM 4032 O O . ASN C 3 117 ? -8.964 -41.508 -80.222 1.00 87.77 ? 120 ASN C O 1 ATOM 4033 C CB . ASN C 3 117 ? -7.834 -42.061 -82.790 1.00 87.92 ? 120 ASN C CB 1 ATOM 4034 C CG . ASN C 3 117 ? -7.033 -42.465 -84.032 1.00 88.41 ? 120 ASN C CG 1 ATOM 4035 O OD1 . ASN C 3 117 ? -5.888 -42.039 -84.225 1.00 88.79 ? 120 ASN C OD1 1 ATOM 4036 N ND2 . ASN C 3 117 ? -7.645 -43.284 -84.884 1.00 88.70 ? 120 ASN C ND2 1 ATOM 4037 N N . PRO C 3 118 ? -6.907 -41.165 -79.328 1.00 88.29 ? 121 PRO C N 1 ATOM 4038 C CA . PRO C 3 118 ? -7.417 -40.515 -78.120 1.00 88.67 ? 121 PRO C CA 1 ATOM 4039 C C . PRO C 3 118 ? -7.898 -39.083 -78.364 1.00 89.16 ? 121 PRO C C 1 ATOM 4040 O O . PRO C 3 118 ? -7.103 -38.226 -78.755 1.00 89.25 ? 121 PRO C O 1 ATOM 4041 C CB . PRO C 3 118 ? -6.211 -40.531 -77.171 1.00 88.61 ? 121 PRO C CB 1 ATOM 4042 C CG . PRO C 3 118 ? -5.025 -40.589 -78.049 1.00 88.42 ? 121 PRO C CG 1 ATOM 4043 C CD . PRO C 3 118 ? -5.435 -41.275 -79.323 1.00 88.25 ? 121 PRO C CD 1 ATOM 4044 N N . ASP C 3 119 ? -9.188 -38.837 -78.119 1.00 89.72 ? 122 ASP C N 1 ATOM 4045 C CA . ASP C 3 119 ? -9.806 -37.518 -78.331 1.00 90.15 ? 122 ASP C CA 1 ATOM 4046 C C . ASP C 3 119 ? -10.414 -36.942 -77.038 1.00 90.39 ? 122 ASP C C 1 ATOM 4047 O O . ASP C 3 119 ? -11.629 -36.741 -76.973 1.00 90.16 ? 122 ASP C O 1 ATOM 4048 C CB . ASP C 3 119 ? -10.878 -37.623 -79.434 1.00 90.22 ? 122 ASP C CB 1 ATOM 4049 C CG . ASP C 3 119 ? -11.326 -36.258 -79.976 1.00 90.63 ? 122 ASP C CG 1 ATOM 4050 O OD1 . ASP C 3 119 ? -11.011 -35.213 -79.364 1.00 91.03 ? 122 ASP C OD1 1 ATOM 4051 O OD2 . ASP C 3 119 ? -12.008 -36.234 -81.027 1.00 90.60 ? 122 ASP C OD2 1 ATOM 4052 N N . PRO C 3 120 ? -9.574 -36.655 -76.014 1.00 90.92 ? 123 PRO C N 1 ATOM 4053 C CA . PRO C 3 120 ? -10.102 -36.261 -74.697 1.00 91.58 ? 123 PRO C CA 1 ATOM 4054 C C . PRO C 3 120 ? -11.071 -35.076 -74.772 1.00 92.36 ? 123 PRO C C 1 ATOM 4055 O O . PRO C 3 120 ? -10.708 -34.024 -75.296 1.00 92.61 ? 123 PRO C O 1 ATOM 4056 C CB . PRO C 3 120 ? -8.839 -35.883 -73.908 1.00 91.33 ? 123 PRO C CB 1 ATOM 4057 C CG . PRO C 3 120 ? -7.743 -36.600 -74.582 1.00 90.97 ? 123 PRO C CG 1 ATOM 4058 C CD . PRO C 3 120 ? -8.101 -36.591 -76.033 1.00 90.86 ? 123 PRO C CD 1 ATOM 4059 N N . ALA C 3 121 ? -12.292 -35.260 -74.263 1.00 93.21 ? 124 ALA C N 1 ATOM 4060 C CA . ALA C 3 121 ? -13.353 -34.246 -74.346 1.00 94.02 ? 124 ALA C CA 1 ATOM 4061 C C . ALA C 3 121 ? -14.458 -34.477 -73.317 1.00 94.68 ? 124 ALA C C 1 ATOM 4062 O O . ALA C 3 121 ? -14.929 -35.601 -73.154 1.00 94.71 ? 124 ALA C O 1 ATOM 4063 C CB . ALA C 3 121 ? -13.945 -34.219 -75.747 1.00 93.92 ? 124 ALA C CB 1 ATOM 4064 N N . VAL C 3 122 ? -14.875 -33.411 -72.634 1.00 95.68 ? 125 VAL C N 1 ATOM 4065 C CA . VAL C 3 122 ? -15.951 -33.498 -71.630 1.00 96.60 ? 125 VAL C CA 1 ATOM 4066 C C . VAL C 3 122 ? -17.242 -32.807 -72.093 1.00 97.37 ? 125 VAL C C 1 ATOM 4067 O O . VAL C 3 122 ? -17.224 -31.652 -72.527 1.00 97.52 ? 125 VAL C O 1 ATOM 4068 C CB . VAL C 3 122 ? -15.507 -33.002 -70.207 1.00 96.51 ? 125 VAL C CB 1 ATOM 4069 C CG1 . VAL C 3 122 ? -13.990 -33.163 -70.015 1.00 96.40 ? 125 VAL C CG1 1 ATOM 4070 C CG2 . VAL C 3 122 ? -15.963 -31.570 -69.921 1.00 96.37 ? 125 VAL C CG2 1 ATOM 4071 N N . TYR C 3 123 ? -18.354 -33.529 -71.999 1.00 98.34 ? 126 TYR C N 1 ATOM 4072 C CA . TYR C 3 123 ? -19.642 -33.055 -72.504 1.00 99.37 ? 126 TYR C CA 1 ATOM 4073 C C . TYR C 3 123 ? -20.636 -32.948 -71.351 1.00 100.16 ? 126 TYR C C 1 ATOM 4074 O O . TYR C 3 123 ? -20.330 -33.379 -70.237 1.00 100.23 ? 126 TYR C O 1 ATOM 4075 C CB . TYR C 3 123 ? -20.154 -33.997 -73.601 1.00 99.27 ? 126 TYR C CB 1 ATOM 4076 C CG . TYR C 3 123 ? -19.159 -34.209 -74.719 1.00 99.46 ? 126 TYR C CG 1 ATOM 4077 C CD1 . TYR C 3 123 ? -19.025 -33.277 -75.747 1.00 99.44 ? 126 TYR C CD1 1 ATOM 4078 C CD2 . TYR C 3 123 ? -18.333 -35.332 -74.738 1.00 99.67 ? 126 TYR C CD2 1 ATOM 4079 C CE1 . TYR C 3 123 ? -18.095 -33.460 -76.766 1.00 99.25 ? 126 TYR C CE1 1 ATOM 4080 C CE2 . TYR C 3 123 ? -17.403 -35.524 -75.757 1.00 99.60 ? 126 TYR C CE2 1 ATOM 4081 C CZ . TYR C 3 123 ? -17.296 -34.588 -76.769 1.00 99.34 ? 126 TYR C CZ 1 ATOM 4082 O OH . TYR C 3 123 ? -16.383 -34.778 -77.780 1.00 99.29 ? 126 TYR C OH 1 ATOM 4083 N N . GLN C 3 124 ? -21.813 -32.370 -71.603 1.00 101.17 ? 127 GLN C N 1 ATOM 4084 C CA . GLN C 3 124 ? -22.800 -32.188 -70.532 1.00 102.10 ? 127 GLN C CA 1 ATOM 4085 C C . GLN C 3 124 ? -24.201 -32.746 -70.791 1.00 102.83 ? 127 GLN C C 1 ATOM 4086 O O . GLN C 3 124 ? -24.833 -32.470 -71.819 1.00 102.77 ? 127 GLN C O 1 ATOM 4087 C CB . GLN C 3 124 ? -22.882 -30.719 -70.069 1.00 102.07 ? 127 GLN C CB 1 ATOM 4088 C CG . GLN C 3 124 ? -23.757 -30.513 -68.817 1.00 101.95 ? 127 GLN C CG 1 ATOM 4089 C CD . GLN C 3 124 ? -23.670 -29.120 -68.211 1.00 101.59 ? 127 GLN C CD 1 ATOM 4090 O OE1 . GLN C 3 124 ? -22.815 -28.849 -67.366 1.00 101.23 ? 127 GLN C OE1 1 ATOM 4091 N NE2 . GLN C 3 124 ? -24.585 -28.243 -68.610 1.00 101.28 ? 127 GLN C NE2 1 ATOM 4092 N N . LEU C 3 125 ? -24.634 -33.559 -69.827 1.00 103.84 ? 128 LEU C N 1 ATOM 4093 C CA . LEU C 3 125 ? -26.030 -33.919 -69.580 1.00 104.83 ? 128 LEU C CA 1 ATOM 4094 C C . LEU C 3 125 ? -26.642 -32.865 -68.631 1.00 105.53 ? 128 LEU C C 1 ATOM 4095 O O . LEU C 3 125 ? -26.006 -32.540 -67.624 1.00 105.80 ? 128 LEU C O 1 ATOM 4096 C CB . LEU C 3 125 ? -26.107 -35.315 -68.935 1.00 104.77 ? 128 LEU C CB 1 ATOM 4097 C CG . LEU C 3 125 ? -25.267 -35.811 -67.727 1.00 104.92 ? 128 LEU C CG 1 ATOM 4098 C CD1 . LEU C 3 125 ? -23.771 -35.796 -68.002 1.00 104.96 ? 128 LEU C CD1 1 ATOM 4099 C CD2 . LEU C 3 125 ? -25.570 -35.154 -66.365 1.00 104.73 ? 128 LEU C CD2 1 ATOM 4100 N N . ARG C 3 126 ? -27.849 -32.384 -68.927 1.00 106.24 ? 129 ARG C N 1 ATOM 4101 C CA . ARG C 3 126 ? -28.625 -32.848 -70.080 1.00 106.86 ? 129 ARG C CA 1 ATOM 4102 C C . ARG C 3 126 ? -28.816 -34.368 -70.112 1.00 107.10 ? 129 ARG C C 1 ATOM 4103 O O . ARG C 3 126 ? -28.461 -35.004 -71.103 1.00 107.21 ? 129 ARG C O 1 ATOM 4104 C CB . ARG C 3 126 ? -27.977 -32.376 -71.384 1.00 106.98 ? 129 ARG C CB 1 ATOM 4105 C CG . ARG C 3 126 ? -28.366 -30.965 -71.795 1.00 107.76 ? 129 ARG C CG 1 ATOM 4106 C CD . ARG C 3 126 ? -27.457 -30.440 -72.895 1.00 109.46 ? 129 ARG C CD 1 ATOM 4107 N NE . ARG C 3 126 ? -27.187 -29.013 -72.746 1.00 110.56 ? 129 ARG C NE 1 ATOM 4108 C CZ . ARG C 3 126 ? -26.662 -28.249 -73.698 1.00 111.01 ? 129 ARG C CZ 1 ATOM 4109 N NH1 . ARG C 3 126 ? -26.349 -28.773 -74.875 1.00 111.20 ? 129 ARG C NH1 1 ATOM 4110 N NH2 . ARG C 3 126 ? -26.450 -26.959 -73.474 1.00 111.10 ? 129 ARG C NH2 1 ATOM 4111 N N . ASP C 3 127 ? -29.241 -34.973 -69.003 1.00 107.46 ? 130 ASP C N 1 ATOM 4112 C CA . ASP C 3 127 ? -30.066 -34.367 -67.957 1.00 107.75 ? 130 ASP C CA 1 ATOM 4113 C C . ASP C 3 127 ? -31.568 -34.634 -68.142 1.00 108.00 ? 130 ASP C C 1 ATOM 4114 O O . ASP C 3 127 ? -32.379 -34.230 -67.309 1.00 107.99 ? 130 ASP C O 1 ATOM 4115 C CB . ASP C 3 127 ? -29.828 -32.860 -67.863 1.00 107.77 ? 130 ASP C CB 1 ATOM 4116 C CG . ASP C 3 127 ? -29.531 -32.404 -66.449 1.00 107.64 ? 130 ASP C CG 1 ATOM 4117 O OD1 . ASP C 3 127 ? -29.882 -33.137 -65.500 1.00 107.61 ? 130 ASP C OD1 1 ATOM 4118 O OD2 . ASP C 3 127 ? -28.946 -31.313 -66.285 1.00 107.38 ? 130 ASP C OD2 1 ATOM 4119 N N . SER C 3 128 ? -31.932 -35.322 -69.221 1.00 108.38 ? 131 SER C N 1 ATOM 4120 C CA . SER C 3 128 ? -33.306 -35.787 -69.426 1.00 108.77 ? 131 SER C CA 1 ATOM 4121 C C . SER C 3 128 ? -33.586 -36.948 -68.472 1.00 109.04 ? 131 SER C C 1 ATOM 4122 O O . SER C 3 128 ? -32.646 -37.596 -68.012 1.00 109.11 ? 131 SER C O 1 ATOM 4123 C CB . SER C 3 128 ? -33.518 -36.227 -70.874 1.00 108.79 ? 131 SER C CB 1 ATOM 4124 O OG . SER C 3 128 ? -33.070 -35.234 -71.780 1.00 108.91 ? 131 SER C OG 1 ATOM 4125 N N . LYS C 3 129 ? -34.851 -37.205 -68.137 1.00 109.42 ? 132 LYS C N 1 ATOM 4126 C CA . LYS C 3 129 ? -36.014 -36.550 -68.706 1.00 109.77 ? 132 LYS C CA 1 ATOM 4127 C C . LYS C 3 129 ? -36.651 -35.653 -67.647 1.00 109.95 ? 132 LYS C C 1 ATOM 4128 O O . LYS C 3 129 ? -37.006 -36.118 -66.559 1.00 109.98 ? 132 LYS C O 1 ATOM 4129 C CB . LYS C 3 129 ? -37.008 -37.592 -69.230 1.00 109.82 ? 132 LYS C CB 1 ATOM 4130 C CG . LYS C 3 129 ? -37.210 -38.765 -68.286 1.00 110.01 ? 132 LYS C CG 1 ATOM 4131 C CD . LYS C 3 129 ? -38.046 -39.857 -68.894 1.00 110.48 ? 132 LYS C CD 1 ATOM 4132 C CE . LYS C 3 129 ? -37.991 -41.089 -68.012 1.00 110.90 ? 132 LYS C CE 1 ATOM 4133 N NZ . LYS C 3 129 ? -38.784 -42.209 -68.577 1.00 111.31 ? 132 LYS C NZ 1 ATOM 4134 N N . SER C 3 130 ? -36.742 -34.360 -67.963 1.00 110.13 ? 133 SER C N 1 ATOM 4135 C CA . SER C 3 130 ? -37.494 -33.367 -67.169 1.00 110.19 ? 133 SER C CA 1 ATOM 4136 C C . SER C 3 130 ? -36.861 -32.956 -65.820 1.00 110.17 ? 133 SER C C 1 ATOM 4137 O O . SER C 3 130 ? -37.505 -32.287 -65.008 1.00 110.13 ? 133 SER C O 1 ATOM 4138 C CB . SER C 3 130 ? -38.959 -33.818 -66.985 1.00 110.21 ? 133 SER C CB 1 ATOM 4139 O OG . SER C 3 130 ? -39.746 -32.825 -66.350 1.00 110.27 ? 133 SER C OG 1 ATOM 4140 N N . SER C 3 131 ? -35.603 -33.329 -65.595 1.00 110.22 ? 134 SER C N 1 ATOM 4141 C CA . SER C 3 131 ? -34.944 -33.057 -64.307 1.00 110.27 ? 134 SER C CA 1 ATOM 4142 C C . SER C 3 131 ? -33.614 -32.290 -64.420 1.00 110.28 ? 134 SER C C 1 ATOM 4143 O O . SER C 3 131 ? -32.532 -32.862 -64.227 1.00 110.31 ? 134 SER C O 1 ATOM 4144 C CB . SER C 3 131 ? -34.767 -34.359 -63.504 1.00 110.27 ? 134 SER C CB 1 ATOM 4145 O OG . SER C 3 131 ? -34.102 -35.361 -64.261 1.00 110.16 ? 134 SER C OG 1 ATOM 4146 N N . ASP C 3 132 ? -33.712 -30.990 -64.710 1.00 110.19 ? 135 ASP C N 1 ATOM 4147 C CA . ASP C 3 132 ? -32.536 -30.130 -64.887 1.00 109.98 ? 135 ASP C CA 1 ATOM 4148 C C . ASP C 3 132 ? -32.690 -28.785 -64.184 1.00 109.88 ? 135 ASP C C 1 ATOM 4149 O O . ASP C 3 132 ? -32.211 -28.603 -63.066 1.00 109.75 ? 135 ASP C O 1 ATOM 4150 C CB . ASP C 3 132 ? -32.234 -29.924 -66.378 1.00 109.97 ? 135 ASP C CB 1 ATOM 4151 C CG . ASP C 3 132 ? -33.479 -29.594 -67.193 1.00 109.86 ? 135 ASP C CG 1 ATOM 4152 O OD1 . ASP C 3 132 ? -34.116 -28.553 -66.921 1.00 109.75 ? 135 ASP C OD1 1 ATOM 4153 O OD2 . ASP C 3 132 ? -33.810 -30.376 -68.112 1.00 109.51 ? 135 ASP C OD2 1 ATOM 4154 N N . CYS C 3 136 ? -21.192 -34.799 -65.334 1.00 102.51 ? 139 CYS C N 1 ATOM 4155 C CA . CYS C 3 136 ? -21.001 -34.837 -66.779 1.00 102.68 ? 139 CYS C CA 1 ATOM 4156 C C . CYS C 3 136 ? -19.880 -35.787 -67.217 1.00 102.12 ? 139 CYS C C 1 ATOM 4157 O O . CYS C 3 136 ? -18.965 -36.089 -66.445 1.00 102.07 ? 139 CYS C O 1 ATOM 4158 C CB . CYS C 3 136 ? -20.809 -33.427 -67.347 1.00 103.06 ? 139 CYS C CB 1 ATOM 4159 S SG . CYS C 3 136 ? -19.813 -32.300 -66.333 1.00 105.22 ? 139 CYS C SG 1 ATOM 4160 N N . LEU C 3 137 ? -19.975 -36.244 -68.463 1.00 101.56 ? 140 LEU C N 1 ATOM 4161 C CA . LEU C 3 137 ? -19.106 -37.287 -69.011 1.00 101.08 ? 140 LEU C CA 1 ATOM 4162 C C . LEU C 3 137 ? -17.712 -36.777 -69.367 1.00 100.80 ? 140 LEU C C 1 ATOM 4163 O O . LEU C 3 137 ? -17.572 -35.697 -69.939 1.00 100.88 ? 140 LEU C O 1 ATOM 4164 C CB . LEU C 3 137 ? -19.766 -37.893 -70.257 1.00 101.04 ? 140 LEU C CB 1 ATOM 4165 C CG . LEU C 3 137 ? -19.049 -38.983 -71.057 1.00 101.05 ? 140 LEU C CG 1 ATOM 4166 C CD1 . LEU C 3 137 ? -19.369 -40.366 -70.515 1.00 101.03 ? 140 LEU C CD1 1 ATOM 4167 C CD2 . LEU C 3 137 ? -19.433 -38.891 -72.518 1.00 101.09 ? 140 LEU C CD2 1 ATOM 4168 N N . PHE C 3 138 ? -16.691 -37.559 -69.025 1.00 100.35 ? 141 PHE C N 1 ATOM 4169 C CA . PHE C 3 138 ? -15.325 -37.312 -69.479 1.00 99.95 ? 141 PHE C CA 1 ATOM 4170 C C . PHE C 3 138 ? -14.824 -38.542 -70.211 1.00 99.78 ? 141 PHE C C 1 ATOM 4171 O O . PHE C 3 138 ? -14.723 -39.611 -69.621 1.00 99.82 ? 141 PHE C O 1 ATOM 4172 C CB . PHE C 3 138 ? -14.418 -36.988 -68.300 1.00 99.89 ? 141 PHE C CB 1 ATOM 4173 C CG . PHE C 3 138 ? -12.953 -37.032 -68.626 1.00 99.82 ? 141 PHE C CG 1 ATOM 4174 C CD1 . PHE C 3 138 ? -12.452 -36.399 -69.761 1.00 99.84 ? 141 PHE C CD1 1 ATOM 4175 C CD2 . PHE C 3 138 ? -12.067 -37.691 -67.783 1.00 99.78 ? 141 PHE C CD2 1 ATOM 4176 C CE1 . PHE C 3 138 ? -11.097 -36.438 -70.059 1.00 99.91 ? 141 PHE C CE1 1 ATOM 4177 C CE2 . PHE C 3 138 ? -10.706 -37.732 -68.069 1.00 99.76 ? 141 PHE C CE2 1 ATOM 4178 C CZ . PHE C 3 138 ? -10.221 -37.105 -69.209 1.00 99.90 ? 141 PHE C CZ 1 ATOM 4179 N N . THR C 3 139 ? -14.493 -38.383 -71.489 1.00 99.66 ? 142 THR C N 1 ATOM 4180 C CA . THR C 3 139 ? -14.324 -39.537 -72.376 1.00 99.61 ? 142 THR C CA 1 ATOM 4181 C C . THR C 3 139 ? -13.072 -39.517 -73.271 1.00 99.55 ? 142 THR C C 1 ATOM 4182 O O . THR C 3 139 ? -12.270 -38.586 -73.225 1.00 99.52 ? 142 THR C O 1 ATOM 4183 C CB . THR C 3 139 ? -15.615 -39.767 -73.230 1.00 99.57 ? 142 THR C CB 1 ATOM 4184 O OG1 . THR C 3 139 ? -15.541 -41.024 -73.912 1.00 99.68 ? 142 THR C OG1 1 ATOM 4185 C CG2 . THR C 3 139 ? -15.819 -38.651 -74.247 1.00 99.63 ? 142 THR C CG2 1 ATOM 4186 N N . ASP C 3 140 ? -12.913 -40.588 -74.045 1.00 99.58 ? 143 ASP C N 1 ATOM 4187 C CA . ASP C 3 140 ? -11.916 -40.709 -75.110 1.00 99.63 ? 143 ASP C CA 1 ATOM 4188 C C . ASP C 3 140 ? -10.457 -40.487 -74.709 1.00 99.71 ? 143 ASP C C 1 ATOM 4189 O O . ASP C 3 140 ? -9.615 -40.235 -75.568 1.00 99.80 ? 143 ASP C O 1 ATOM 4190 C CB . ASP C 3 140 ? -12.295 -39.823 -76.303 1.00 99.63 ? 143 ASP C CB 1 ATOM 4191 C CG . ASP C 3 140 ? -13.683 -40.122 -76.840 1.00 99.72 ? 143 ASP C CG 1 ATOM 4192 O OD1 . ASP C 3 140 ? -14.361 -41.018 -76.297 1.00 99.40 ? 143 ASP C OD1 1 ATOM 4193 O OD2 . ASP C 3 140 ? -14.100 -39.453 -77.811 1.00 100.26 ? 143 ASP C OD2 1 ATOM 4194 N N . PHE C 3 141 ? -10.153 -40.586 -73.420 1.00 99.84 ? 144 PHE C N 1 ATOM 4195 C CA . PHE C 3 141 ? -8.766 -40.478 -72.961 1.00 100.14 ? 144 PHE C CA 1 ATOM 4196 C C . PHE C 3 141 ? -7.987 -41.793 -73.153 1.00 100.53 ? 144 PHE C C 1 ATOM 4197 O O . PHE C 3 141 ? -8.551 -42.789 -73.619 1.00 100.64 ? 144 PHE C O 1 ATOM 4198 C CB . PHE C 3 141 ? -8.688 -39.952 -71.518 1.00 99.98 ? 144 PHE C CB 1 ATOM 4199 C CG . PHE C 3 141 ? -9.578 -40.676 -70.545 1.00 99.72 ? 144 PHE C CG 1 ATOM 4200 C CD1 . PHE C 3 141 ? -9.045 -41.592 -69.644 1.00 99.48 ? 144 PHE C CD1 1 ATOM 4201 C CD2 . PHE C 3 141 ? -10.945 -40.425 -70.509 1.00 99.62 ? 144 PHE C CD2 1 ATOM 4202 C CE1 . PHE C 3 141 ? -9.859 -42.260 -68.731 1.00 99.05 ? 144 PHE C CE1 1 ATOM 4203 C CE2 . PHE C 3 141 ? -11.767 -41.092 -69.604 1.00 99.48 ? 144 PHE C CE2 1 ATOM 4204 C CZ . PHE C 3 141 ? -11.222 -42.009 -68.712 1.00 99.12 ? 144 PHE C CZ 1 ATOM 4205 N N . ASP C 3 142 ? -6.694 -41.786 -72.818 1.00 100.94 ? 145 ASP C N 1 ATOM 4206 C CA . ASP C 3 142 ? -5.820 -42.944 -73.049 1.00 101.25 ? 145 ASP C CA 1 ATOM 4207 C C . ASP C 3 142 ? -5.500 -43.736 -71.778 1.00 101.57 ? 145 ASP C C 1 ATOM 4208 O O . ASP C 3 142 ? -5.935 -43.379 -70.681 1.00 101.47 ? 145 ASP C O 1 ATOM 4209 C CB . ASP C 3 142 ? -4.527 -42.521 -73.773 1.00 101.22 ? 145 ASP C CB 1 ATOM 4210 C CG . ASP C 3 142 ? -3.565 -41.727 -72.881 1.00 101.24 ? 145 ASP C CG 1 ATOM 4211 O OD1 . ASP C 3 142 ? -3.914 -41.396 -71.726 1.00 101.41 ? 145 ASP C OD1 1 ATOM 4212 O OD2 . ASP C 3 142 ? -2.442 -41.431 -73.344 1.00 101.09 ? 145 ASP C OD2 1 ATOM 4213 N N . SER C 3 143 ? -4.722 -44.802 -71.947 1.00 102.12 ? 146 SER C N 1 ATOM 4214 C CA . SER C 3 143 ? -4.333 -45.704 -70.859 1.00 102.64 ? 146 SER C CA 1 ATOM 4215 C C . SER C 3 143 ? -3.685 -45.028 -69.640 1.00 103.01 ? 146 SER C C 1 ATOM 4216 O O . SER C 3 143 ? -4.083 -45.292 -68.503 1.00 103.05 ? 146 SER C O 1 ATOM 4217 C CB . SER C 3 143 ? -3.411 -46.804 -71.397 1.00 102.64 ? 146 SER C CB 1 ATOM 4218 O OG . SER C 3 143 ? -2.276 -46.259 -72.051 1.00 102.68 ? 146 SER C OG 1 ATOM 4219 N N . GLN C 3 144 ? -2.699 -44.162 -69.887 1.00 103.48 ? 147 GLN C N 1 ATOM 4220 C CA . GLN C 3 144 ? -1.930 -43.498 -68.822 1.00 103.83 ? 147 GLN C CA 1 ATOM 4221 C C . GLN C 3 144 ? -2.782 -42.655 -67.871 1.00 104.20 ? 147 GLN C C 1 ATOM 4222 O O . GLN C 3 144 ? -2.489 -42.575 -66.677 1.00 104.18 ? 147 GLN C O 1 ATOM 4223 C CB . GLN C 3 144 ? -0.808 -42.630 -69.403 0.04 103.75 ? 147 GLN C CB 1 ATOM 4224 C CG . GLN C 3 144 ? 0.397 -43.404 -69.921 0.04 103.41 ? 147 GLN C CG 1 ATOM 4225 C CD . GLN C 3 144 ? 0.361 -43.615 -71.421 0.04 102.94 ? 147 GLN C CD 1 ATOM 4226 O OE1 . GLN C 3 144 ? 0.194 -42.668 -72.189 1.00 102.78 ? 147 GLN C OE1 1 ATOM 4227 N NE2 . GLN C 3 144 ? 0.535 -44.858 -71.846 1.00 102.30 ? 147 GLN C NE2 1 ATOM 4228 N N . THR C 3 145 ? -3.826 -42.024 -68.401 1.00 104.70 ? 148 THR C N 1 ATOM 4229 C CA . THR C 3 145 ? -4.713 -41.192 -67.588 1.00 105.29 ? 148 THR C CA 1 ATOM 4230 C C . THR C 3 145 ? -5.525 -42.016 -66.587 1.00 105.74 ? 148 THR C C 1 ATOM 4231 O O . THR C 3 145 ? -6.243 -42.945 -66.972 1.00 105.91 ? 148 THR C O 1 ATOM 4232 C CB . THR C 3 145 ? -5.682 -40.357 -68.459 1.00 105.25 ? 148 THR C CB 1 ATOM 4233 O OG1 . THR C 3 145 ? -5.984 -41.074 -69.663 1.00 105.01 ? 148 THR C OG1 1 ATOM 4234 C CG2 . THR C 3 145 ? -5.060 -39.019 -68.816 1.00 105.28 ? 148 THR C CG2 1 ATOM 4235 N N . ASN C 3 146 ? -5.392 -41.677 -65.305 1.00 106.11 ? 149 ASN C N 1 ATOM 4236 C CA . ASN C 3 146 ? -6.203 -42.294 -64.247 1.00 106.46 ? 149 ASN C CA 1 ATOM 4237 C C . ASN C 3 146 ? -6.971 -41.270 -63.401 1.00 106.79 ? 149 ASN C C 1 ATOM 4238 O O . ASN C 3 146 ? -6.367 -40.428 -62.733 1.00 106.78 ? 149 ASN C O 1 ATOM 4239 C CB . ASN C 3 146 ? -5.368 -43.245 -63.365 1.00 106.39 ? 149 ASN C CB 1 ATOM 4240 C CG . ASN C 3 146 ? -4.036 -42.642 -62.914 1.00 106.22 ? 149 ASN C CG 1 ATOM 4241 O OD1 . ASN C 3 146 ? -3.782 -41.448 -63.074 1.00 105.89 ? 149 ASN C OD1 1 ATOM 4242 N ND2 . ASN C 3 146 ? -3.179 -43.481 -62.345 1.00 106.07 ? 149 ASN C ND2 1 ATOM 4243 N N . VAL C 3 147 ? -8.304 -41.351 -63.450 1.00 107.20 ? 150 VAL C N 1 ATOM 4244 C CA . VAL C 3 147 ? -9.207 -40.415 -62.756 1.00 107.54 ? 150 VAL C CA 1 ATOM 4245 C C . VAL C 3 147 ? -9.176 -40.593 -61.234 1.00 107.92 ? 150 VAL C C 1 ATOM 4246 O O . VAL C 3 147 ? -9.376 -41.701 -60.729 1.00 108.03 ? 150 VAL C O 1 ATOM 4247 C CB . VAL C 3 147 ? -10.680 -40.578 -63.235 1.00 107.45 ? 150 VAL C CB 1 ATOM 4248 C CG1 . VAL C 3 147 ? -11.574 -39.510 -62.620 1.00 107.40 ? 150 VAL C CG1 1 ATOM 4249 C CG2 . VAL C 3 147 ? -10.774 -40.536 -64.750 1.00 107.44 ? 150 VAL C CG2 1 ATOM 4250 N N . SER C 3 148 ? -8.932 -39.501 -60.510 1.00 108.33 ? 151 SER C N 1 ATOM 4251 C CA . SER C 3 148 ? -8.965 -39.522 -59.042 1.00 108.65 ? 151 SER C CA 1 ATOM 4252 C C . SER C 3 148 ? -10.293 -39.016 -58.497 1.00 108.84 ? 151 SER C C 1 ATOM 4253 O O . SER C 3 148 ? -10.807 -37.985 -58.945 1.00 108.82 ? 151 SER C O 1 ATOM 4254 C CB . SER C 3 148 ? -7.810 -38.715 -58.444 1.00 108.66 ? 151 SER C CB 1 ATOM 4255 O OG . SER C 3 148 ? -6.774 -39.570 -57.993 1.00 108.68 ? 151 SER C OG 1 ATOM 4256 N N . GLN C 3 149 ? -10.838 -39.748 -57.526 1.00 109.14 ? 152 GLN C N 1 ATOM 4257 C CA . GLN C 3 149 ? -12.115 -39.385 -56.916 1.00 109.41 ? 152 GLN C CA 1 ATOM 4258 C C . GLN C 3 149 ? -11.959 -38.209 -55.958 1.00 109.56 ? 152 GLN C C 1 ATOM 4259 O O . GLN C 3 149 ? -10.926 -38.063 -55.293 1.00 109.51 ? 152 GLN C O 1 ATOM 4260 C CB . GLN C 3 149 ? -12.762 -40.575 -56.201 1.00 109.41 ? 152 GLN C CB 1 ATOM 4261 C CG . GLN C 3 149 ? -14.269 -40.400 -56.002 1.00 109.42 ? 152 GLN C CG 1 ATOM 4262 C CD . GLN C 3 149 ? -14.844 -41.251 -54.887 1.00 109.24 ? 152 GLN C CD 1 ATOM 4263 O OE1 . GLN C 3 149 ? -14.114 -41.793 -54.052 1.00 108.97 ? 152 GLN C OE1 1 ATOM 4264 N NE2 . GLN C 3 149 ? -16.168 -41.361 -54.860 1.00 108.99 ? 152 GLN C NE2 1 ATOM 4265 N N . SER C 3 150 ? -13.007 -37.390 -55.894 1.00 109.78 ? 153 SER C N 1 ATOM 4266 C CA . SER C 3 150 ? -12.993 -36.120 -55.173 1.00 109.96 ? 153 SER C CA 1 ATOM 4267 C C . SER C 3 150 ? -12.740 -36.258 -53.670 1.00 110.01 ? 153 SER C C 1 ATOM 4268 O O . SER C 3 150 ? -13.096 -37.270 -53.053 1.00 109.94 ? 153 SER C O 1 ATOM 4269 C CB . SER C 3 150 ? -14.304 -35.363 -55.411 1.00 109.98 ? 153 SER C CB 1 ATOM 4270 O OG . SER C 3 150 ? -14.143 -33.973 -55.184 1.00 110.17 ? 153 SER C OG 1 ATOM 4271 N N . LYS C 3 151 ? -12.109 -35.229 -53.105 1.00 110.04 ? 154 LYS C N 1 ATOM 4272 C CA . LYS C 3 151 ? -11.934 -35.090 -51.661 1.00 109.98 ? 154 LYS C CA 1 ATOM 4273 C C . LYS C 3 151 ? -13.163 -34.429 -51.024 1.00 109.93 ? 154 LYS C C 1 ATOM 4274 O O . LYS C 3 151 ? -13.197 -34.213 -49.806 1.00 109.99 ? 154 LYS C O 1 ATOM 4275 C CB . LYS C 3 151 ? -10.678 -34.272 -51.347 0.04 109.97 ? 154 LYS C CB 1 ATOM 4276 C CG . LYS C 3 151 ? -9.368 -35.025 -51.524 0.04 109.94 ? 154 LYS C CG 1 ATOM 4277 C CD . LYS C 3 151 ? -8.188 -34.172 -51.086 0.04 109.89 ? 154 LYS C CD 1 ATOM 4278 C CE . LYS C 3 151 ? -6.890 -34.963 -51.113 0.04 109.86 ? 154 LYS C CE 1 ATOM 4279 N NZ . LYS C 3 151 ? -6.572 -35.460 -52.480 0.04 109.84 ? 154 LYS C NZ 1 ATOM 4280 N N . ASP C 3 152 ? -14.159 -34.107 -51.857 1.00 109.76 ? 155 ASP C N 1 ATOM 4281 C CA . ASP C 3 152 ? -15.418 -33.505 -51.407 1.00 109.57 ? 155 ASP C CA 1 ATOM 4282 C C . ASP C 3 152 ? -16.547 -34.530 -51.280 1.00 109.32 ? 155 ASP C C 1 ATOM 4283 O O . ASP C 3 152 ? -16.545 -35.568 -51.953 1.00 109.31 ? 155 ASP C O 1 ATOM 4284 C CB . ASP C 3 152 ? -15.854 -32.377 -52.353 1.00 109.67 ? 155 ASP C CB 1 ATOM 4285 C CG . ASP C 3 152 ? -15.121 -31.066 -52.093 1.00 110.06 ? 155 ASP C CG 1 ATOM 4286 O OD1 . ASP C 3 152 ? -14.936 -30.693 -50.912 1.00 110.41 ? 155 ASP C OD1 1 ATOM 4287 O OD2 . ASP C 3 152 ? -14.743 -30.398 -53.081 1.00 110.46 ? 155 ASP C OD2 1 ATOM 4288 N N . SER C 3 153 ? -17.511 -34.217 -50.415 1.00 108.94 ? 156 SER C N 1 ATOM 4289 C CA . SER C 3 153 ? -18.678 -35.068 -50.179 1.00 108.55 ? 156 SER C CA 1 ATOM 4290 C C . SER C 3 153 ? -19.840 -34.699 -51.099 1.00 108.21 ? 156 SER C C 1 ATOM 4291 O O . SER C 3 153 ? -20.718 -35.526 -51.363 1.00 108.10 ? 156 SER C O 1 ATOM 4292 C CB . SER C 3 153 ? -19.129 -34.950 -48.722 1.00 108.62 ? 156 SER C CB 1 ATOM 4293 O OG . SER C 3 153 ? -18.030 -35.059 -47.834 1.00 108.60 ? 156 SER C OG 1 ATOM 4294 N N . ASP C 3 154 ? -19.833 -33.452 -51.570 1.00 107.79 ? 157 ASP C N 1 ATOM 4295 C CA . ASP C 3 154 ? -20.884 -32.909 -52.438 1.00 107.30 ? 157 ASP C CA 1 ATOM 4296 C C . ASP C 3 154 ? -20.903 -33.605 -53.802 1.00 107.00 ? 157 ASP C C 1 ATOM 4297 O O . ASP C 3 154 ? -21.975 -33.936 -54.321 1.00 106.90 ? 157 ASP C O 1 ATOM 4298 C CB . ASP C 3 154 ? -20.697 -31.393 -52.649 1.00 107.28 ? 157 ASP C CB 1 ATOM 4299 C CG . ASP C 3 154 ? -19.856 -30.732 -51.558 1.00 107.03 ? 157 ASP C CG 1 ATOM 4300 O OD1 . ASP C 3 154 ? -20.149 -30.940 -50.363 1.00 106.91 ? 157 ASP C OD1 1 ATOM 4301 O OD2 . ASP C 3 154 ? -18.905 -29.991 -51.899 1.00 106.41 ? 157 ASP C OD2 1 ATOM 4302 N N . VAL C 3 155 ? -19.710 -33.820 -54.364 1.00 106.57 ? 158 VAL C N 1 ATOM 4303 C CA . VAL C 3 155 ? -19.540 -34.333 -55.729 1.00 106.07 ? 158 VAL C CA 1 ATOM 4304 C C . VAL C 3 155 ? -19.155 -35.813 -55.720 1.00 105.60 ? 158 VAL C C 1 ATOM 4305 O O . VAL C 3 155 ? -18.476 -36.288 -54.798 1.00 105.53 ? 158 VAL C O 1 ATOM 4306 C CB . VAL C 3 155 ? -18.463 -33.530 -56.535 1.00 106.17 ? 158 VAL C CB 1 ATOM 4307 C CG1 . VAL C 3 155 ? -18.708 -33.649 -58.038 1.00 106.17 ? 158 VAL C CG1 1 ATOM 4308 C CG2 . VAL C 3 155 ? -18.442 -32.056 -56.133 1.00 106.26 ? 158 VAL C CG2 1 ATOM 4309 N N . TYR C 3 156 ? -19.597 -36.526 -56.756 1.00 104.99 ? 159 TYR C N 1 ATOM 4310 C CA . TYR C 3 156 ? -19.295 -37.946 -56.931 1.00 104.27 ? 159 TYR C CA 1 ATOM 4311 C C . TYR C 3 156 ? -18.648 -38.194 -58.282 1.00 103.41 ? 159 TYR C C 1 ATOM 4312 O O . TYR C 3 156 ? -19.130 -37.709 -59.309 1.00 103.25 ? 159 TYR C O 1 ATOM 4313 C CB . TYR C 3 156 ? -20.568 -38.789 -56.792 1.00 104.51 ? 159 TYR C CB 1 ATOM 4314 C CG . TYR C 3 156 ? -21.223 -38.678 -55.432 1.00 105.12 ? 159 TYR C CG 1 ATOM 4315 C CD1 . TYR C 3 156 ? -20.551 -39.102 -54.277 1.00 105.75 ? 159 TYR C CD1 1 ATOM 4316 C CD2 . TYR C 3 156 ? -22.513 -38.152 -55.296 1.00 105.29 ? 159 TYR C CD2 1 ATOM 4317 C CE1 . TYR C 3 156 ? -21.141 -39.003 -53.021 1.00 106.15 ? 159 TYR C CE1 1 ATOM 4318 C CE2 . TYR C 3 156 ? -23.116 -38.051 -54.044 1.00 105.84 ? 159 TYR C CE2 1 ATOM 4319 C CZ . TYR C 3 156 ? -22.422 -38.479 -52.912 1.00 106.41 ? 159 TYR C CZ 1 ATOM 4320 O OH . TYR C 3 156 ? -23.001 -38.384 -51.668 1.00 106.90 ? 159 TYR C OH 1 ATOM 4321 N N . ILE C 3 157 ? -17.553 -38.945 -58.275 1.00 102.37 ? 160 ILE C N 1 ATOM 4322 C CA . ILE C 3 157 ? -16.816 -39.216 -59.504 1.00 101.47 ? 160 ILE C CA 1 ATOM 4323 C C . ILE C 3 157 ? -16.433 -40.695 -59.640 1.00 100.62 ? 160 ILE C C 1 ATOM 4324 O O . ILE C 3 157 ? -15.582 -41.203 -58.903 1.00 100.61 ? 160 ILE C O 1 ATOM 4325 C CB . ILE C 3 157 ? -15.561 -38.317 -59.624 1.00 101.61 ? 160 ILE C CB 1 ATOM 4326 C CG1 . ILE C 3 157 ? -15.908 -36.854 -59.320 1.00 101.51 ? 160 ILE C CG1 1 ATOM 4327 C CG2 . ILE C 3 157 ? -14.957 -38.448 -61.017 1.00 101.98 ? 160 ILE C CG2 1 ATOM 4328 C CD1 . ILE C 3 157 ? -14.726 -36.004 -58.928 1.00 101.70 ? 160 ILE C CD1 1 ATOM 4329 N N . THR C 3 158 ? -17.066 -41.371 -60.596 1.00 99.45 ? 161 THR C N 1 ATOM 4330 C CA . THR C 3 158 ? -16.865 -42.803 -60.813 1.00 98.24 ? 161 THR C CA 1 ATOM 4331 C C . THR C 3 158 ? -15.521 -43.072 -61.465 1.00 97.42 ? 161 THR C C 1 ATOM 4332 O O . THR C 3 158 ? -14.948 -42.188 -62.103 1.00 97.33 ? 161 THR C O 1 ATOM 4333 C CB . THR C 3 158 ? -17.969 -43.390 -61.703 1.00 98.33 ? 161 THR C CB 1 ATOM 4334 O OG1 . THR C 3 158 ? -18.035 -42.651 -62.929 1.00 98.32 ? 161 THR C OG1 1 ATOM 4335 C CG2 . THR C 3 158 ? -19.317 -43.319 -60.999 1.00 98.19 ? 161 THR C CG2 1 ATOM 4336 N N . ASP C 3 159 ? -15.027 -44.295 -61.305 1.00 96.40 ? 162 ASP C N 1 ATOM 4337 C CA . ASP C 3 159 ? -13.755 -44.701 -61.896 1.00 95.46 ? 162 ASP C CA 1 ATOM 4338 C C . ASP C 3 159 ? -13.857 -44.954 -63.413 1.00 94.80 ? 162 ASP C C 1 ATOM 4339 O O . ASP C 3 159 ? -14.961 -45.060 -63.964 1.00 94.76 ? 162 ASP C O 1 ATOM 4340 C CB . ASP C 3 159 ? -13.214 -45.936 -61.174 1.00 95.51 ? 162 ASP C CB 1 ATOM 4341 C CG . ASP C 3 159 ? -11.778 -46.243 -61.542 1.00 95.41 ? 162 ASP C CG 1 ATOM 4342 O OD1 . ASP C 3 159 ? -11.486 -47.406 -61.898 1.00 95.39 ? 162 ASP C OD1 1 ATOM 4343 O OD2 . ASP C 3 159 ? -10.945 -45.315 -61.494 1.00 95.16 ? 162 ASP C OD2 1 ATOM 4344 N N . LYS C 3 160 ? -12.699 -45.041 -64.072 1.00 93.84 ? 163 LYS C N 1 ATOM 4345 C CA . LYS C 3 160 ? -12.608 -45.274 -65.519 1.00 92.89 ? 163 LYS C CA 1 ATOM 4346 C C . LYS C 3 160 ? -13.261 -46.588 -65.955 1.00 92.34 ? 163 LYS C C 1 ATOM 4347 O O . LYS C 3 160 ? -13.109 -47.614 -65.290 1.00 92.38 ? 163 LYS C O 1 ATOM 4348 C CB . LYS C 3 160 ? -11.146 -45.190 -66.009 1.00 92.86 ? 163 LYS C CB 1 ATOM 4349 C CG . LYS C 3 160 ? -10.123 -46.002 -65.208 1.00 92.42 ? 163 LYS C CG 1 ATOM 4350 C CD . LYS C 3 160 ? -8.709 -45.841 -65.761 1.00 91.52 ? 163 LYS C CD 1 ATOM 4351 C CE . LYS C 3 160 ? -7.684 -46.592 -64.920 0.04 91.70 ? 163 LYS C CE 1 ATOM 4352 N NZ . LYS C 3 160 ? -7.811 -48.072 -65.043 0.04 91.64 ? 163 LYS C NZ 1 ATOM 4353 N N . CYS C 3 161 ? -13.986 -46.536 -67.073 1.00 91.49 ? 164 CYS C N 1 ATOM 4354 C CA . CYS C 3 161 ? -14.743 -47.673 -67.605 1.00 90.55 ? 164 CYS C CA 1 ATOM 4355 C C . CYS C 3 161 ? -14.509 -47.763 -69.111 1.00 90.28 ? 164 CYS C C 1 ATOM 4356 O O . CYS C 3 161 ? -14.465 -46.742 -69.792 1.00 90.27 ? 164 CYS C O 1 ATOM 4357 C CB . CYS C 3 161 ? -16.233 -47.468 -67.319 1.00 90.33 ? 164 CYS C CB 1 ATOM 4358 S SG . CYS C 3 161 ? -17.298 -48.937 -67.365 1.00 89.21 ? 164 CYS C SG 1 ATOM 4359 N N . VAL C 3 162 ? -14.376 -48.981 -69.633 1.00 89.93 ? 165 VAL C N 1 ATOM 4360 C CA . VAL C 3 162 ? -14.084 -49.182 -71.056 1.00 89.61 ? 165 VAL C CA 1 ATOM 4361 C C . VAL C 3 162 ? -15.230 -49.877 -71.803 1.00 89.49 ? 165 VAL C C 1 ATOM 4362 O O . VAL C 3 162 ? -15.580 -51.013 -71.485 1.00 89.50 ? 165 VAL C O 1 ATOM 4363 C CB . VAL C 3 162 ? -12.792 -50.004 -71.256 1.00 89.57 ? 165 VAL C CB 1 ATOM 4364 C CG1 . VAL C 3 162 ? -12.246 -49.776 -72.647 1.00 89.59 ? 165 VAL C CG1 1 ATOM 4365 C CG2 . VAL C 3 162 ? -11.742 -49.653 -70.202 1.00 89.48 ? 165 VAL C CG2 1 ATOM 4366 N N . LEU C 3 163 ? -15.812 -49.199 -72.791 1.00 89.33 ? 166 LEU C N 1 ATOM 4367 C CA . LEU C 3 163 ? -16.854 -49.810 -73.620 1.00 89.30 ? 166 LEU C CA 1 ATOM 4368 C C . LEU C 3 163 ? -16.326 -50.221 -74.995 1.00 89.38 ? 166 LEU C C 1 ATOM 4369 O O . LEU C 3 163 ? -15.401 -49.609 -75.516 1.00 89.45 ? 166 LEU C O 1 ATOM 4370 C CB . LEU C 3 163 ? -18.097 -48.911 -73.738 1.00 89.29 ? 166 LEU C CB 1 ATOM 4371 C CG . LEU C 3 163 ? -18.165 -47.459 -74.247 1.00 89.41 ? 166 LEU C CG 1 ATOM 4372 C CD1 . LEU C 3 163 ? -17.325 -46.488 -73.415 1.00 89.84 ? 166 LEU C CD1 1 ATOM 4373 C CD2 . LEU C 3 163 ? -17.846 -47.327 -75.735 1.00 89.61 ? 166 LEU C CD2 1 ATOM 4374 N N . ASP C 3 164 ? -16.918 -51.258 -75.576 1.00 89.48 ? 167 ASP C N 1 ATOM 4375 C CA . ASP C 3 164 ? -16.462 -51.784 -76.856 1.00 89.69 ? 167 ASP C CA 1 ATOM 4376 C C . ASP C 3 164 ? -17.607 -51.787 -77.861 1.00 89.99 ? 167 ASP C C 1 ATOM 4377 O O . ASP C 3 164 ? -18.520 -52.608 -77.769 1.00 90.10 ? 167 ASP C O 1 ATOM 4378 C CB . ASP C 3 164 ? -15.902 -53.204 -76.659 1.00 89.68 ? 167 ASP C CB 1 ATOM 4379 C CG . ASP C 3 164 ? -15.319 -53.813 -77.938 1.00 89.57 ? 167 ASP C CG 1 ATOM 4380 O OD1 . ASP C 3 164 ? -14.696 -54.890 -77.838 1.00 89.30 ? 167 ASP C OD1 1 ATOM 4381 O OD2 . ASP C 3 164 ? -15.476 -53.241 -79.036 1.00 89.72 ? 167 ASP C OD2 1 ATOM 4382 N N . MET C 3 165 ? -17.560 -50.864 -78.816 1.00 90.34 ? 168 MET C N 1 ATOM 4383 C CA . MET C 3 165 ? -18.533 -50.849 -79.909 1.00 90.80 ? 168 MET C CA 1 ATOM 4384 C C . MET C 3 165 ? -18.083 -51.851 -80.958 1.00 91.13 ? 168 MET C C 1 ATOM 4385 O O . MET C 3 165 ? -17.224 -51.546 -81.783 1.00 91.14 ? 168 MET C O 1 ATOM 4386 C CB . MET C 3 165 ? -18.649 -49.451 -80.515 1.00 90.79 ? 168 MET C CB 1 ATOM 4387 C CG . MET C 3 165 ? -19.063 -48.376 -79.519 1.00 90.91 ? 168 MET C CG 1 ATOM 4388 S SD . MET C 3 165 ? -18.997 -46.706 -80.194 1.00 90.94 ? 168 MET C SD 1 ATOM 4389 C CE . MET C 3 165 ? -20.458 -46.687 -81.236 1.00 90.95 ? 168 MET C CE 1 ATOM 4390 N N . ARG C 3 166 ? -18.664 -53.047 -80.917 1.00 91.58 ? 169 ARG C N 1 ATOM 4391 C CA . ARG C 3 166 ? -18.106 -54.197 -81.637 1.00 92.05 ? 169 ARG C CA 1 ATOM 4392 C C . ARG C 3 166 ? -18.201 -54.179 -83.164 1.00 92.25 ? 169 ARG C C 1 ATOM 4393 O O . ARG C 3 166 ? -17.254 -54.588 -83.834 1.00 92.31 ? 169 ARG C O 1 ATOM 4394 C CB . ARG C 3 166 ? -18.623 -55.520 -81.063 1.00 92.14 ? 169 ARG C CB 1 ATOM 4395 C CG . ARG C 3 166 ? -17.654 -56.164 -80.069 1.00 92.57 ? 169 ARG C CG 1 ATOM 4396 C CD . ARG C 3 166 ? -18.167 -57.502 -79.536 1.00 93.13 ? 169 ARG C CD 1 ATOM 4397 N NE . ARG C 3 166 ? -19.261 -57.328 -78.576 1.00 93.37 ? 169 ARG C NE 1 ATOM 4398 C CZ . ARG C 3 166 ? -19.106 -57.168 -77.261 1.00 93.09 ? 169 ARG C CZ 1 ATOM 4399 N NH1 . ARG C 3 166 ? -17.896 -57.159 -76.713 1.00 92.96 ? 169 ARG C NH1 1 ATOM 4400 N NH2 . ARG C 3 166 ? -20.170 -57.018 -76.488 1.00 92.77 ? 169 ARG C NH2 1 ATOM 4401 N N . SER C 3 167 ? -19.322 -53.721 -83.717 1.00 92.58 ? 170 SER C N 1 ATOM 4402 C CA . SER C 3 167 ? -19.444 -53.608 -85.175 1.00 92.98 ? 170 SER C CA 1 ATOM 4403 C C . SER C 3 167 ? -18.374 -52.649 -85.708 1.00 93.20 ? 170 SER C C 1 ATOM 4404 O O . SER C 3 167 ? -17.746 -52.903 -86.740 1.00 93.21 ? 170 SER C O 1 ATOM 4405 C CB . SER C 3 167 ? -20.852 -53.161 -85.589 1.00 93.00 ? 170 SER C CB 1 ATOM 4406 O OG . SER C 3 167 ? -21.161 -51.871 -85.087 1.00 93.20 ? 170 SER C OG 1 ATOM 4407 N N . MET C 3 168 ? -18.172 -51.557 -84.972 1.00 93.45 ? 171 MET C N 1 ATOM 4408 C CA . MET C 3 168 ? -17.065 -50.635 -85.185 1.00 93.63 ? 171 MET C CA 1 ATOM 4409 C C . MET C 3 168 ? -15.793 -51.328 -84.704 1.00 93.62 ? 171 MET C C 1 ATOM 4410 O O . MET C 3 168 ? -15.857 -52.284 -83.927 1.00 93.59 ? 171 MET C O 1 ATOM 4411 C CB . MET C 3 168 ? -17.292 -49.378 -84.340 1.00 93.74 ? 171 MET C CB 1 ATOM 4412 C CG . MET C 3 168 ? -17.285 -48.050 -85.091 1.00 94.22 ? 171 MET C CG 1 ATOM 4413 S SD . MET C 3 168 ? -18.842 -47.658 -85.948 1.00 95.44 ? 171 MET C SD 1 ATOM 4414 C CE . MET C 3 168 ? -20.081 -47.762 -84.652 1.00 94.83 ? 171 MET C CE 1 ATOM 4415 N N . ASP C 3 169 ? -14.636 -50.866 -85.159 1.00 93.60 ? 172 ASP C N 1 ATOM 4416 C CA . ASP C 3 169 ? -13.386 -51.318 -84.557 1.00 93.59 ? 172 ASP C CA 1 ATOM 4417 C C . ASP C 3 169 ? -12.912 -50.229 -83.602 1.00 93.34 ? 172 ASP C C 1 ATOM 4418 O O . ASP C 3 169 ? -11.959 -49.504 -83.884 1.00 93.52 ? 172 ASP C O 1 ATOM 4419 C CB . ASP C 3 169 ? -12.337 -51.659 -85.624 1.00 93.79 ? 172 ASP C CB 1 ATOM 4420 C CG . ASP C 3 169 ? -12.522 -53.060 -86.208 1.00 94.31 ? 172 ASP C CG 1 ATOM 4421 O OD1 . ASP C 3 169 ? -12.688 -54.027 -85.426 1.00 94.30 ? 172 ASP C OD1 1 ATOM 4422 O OD2 . ASP C 3 169 ? -12.487 -53.196 -87.453 1.00 94.97 ? 172 ASP C OD2 1 ATOM 4423 N N . PHE C 3 170 ? -13.602 -50.116 -82.469 1.00 92.97 ? 173 PHE C N 1 ATOM 4424 C CA . PHE C 3 170 ? -13.448 -48.964 -81.584 1.00 92.64 ? 173 PHE C CA 1 ATOM 4425 C C . PHE C 3 170 ? -13.677 -49.308 -80.115 1.00 92.27 ? 173 PHE C C 1 ATOM 4426 O O . PHE C 3 170 ? -14.609 -50.034 -79.764 1.00 92.26 ? 173 PHE C O 1 ATOM 4427 C CB . PHE C 3 170 ? -14.415 -47.852 -82.016 1.00 92.82 ? 173 PHE C CB 1 ATOM 4428 C CG . PHE C 3 170 ? -14.211 -46.530 -81.301 1.00 93.24 ? 173 PHE C CG 1 ATOM 4429 C CD1 . PHE C 3 170 ? -13.419 -45.530 -81.865 1.00 93.46 ? 173 PHE C CD1 1 ATOM 4430 C CD2 . PHE C 3 170 ? -14.839 -46.272 -80.080 1.00 93.46 ? 173 PHE C CD2 1 ATOM 4431 C CE1 . PHE C 3 170 ? -13.239 -44.301 -81.213 1.00 93.48 ? 173 PHE C CE1 1 ATOM 4432 C CE2 . PHE C 3 170 ? -14.662 -45.048 -79.423 1.00 93.34 ? 173 PHE C CE2 1 ATOM 4433 C CZ . PHE C 3 170 ? -13.861 -44.063 -79.990 1.00 93.22 ? 173 PHE C CZ 1 ATOM 4434 N N . LYS C 3 171 ? -12.809 -48.762 -79.267 1.00 91.84 ? 174 LYS C N 1 ATOM 4435 C CA . LYS C 3 171 ? -12.926 -48.838 -77.811 1.00 91.37 ? 174 LYS C CA 1 ATOM 4436 C C . LYS C 3 171 ? -12.613 -47.454 -77.240 1.00 91.13 ? 174 LYS C C 1 ATOM 4437 O O . LYS C 3 171 ? -11.949 -46.648 -77.893 1.00 91.22 ? 174 LYS C O 1 ATOM 4438 C CB . LYS C 3 171 ? -11.952 -49.873 -77.238 1.00 91.31 ? 174 LYS C CB 1 ATOM 4439 C CG . LYS C 3 171 ? -12.288 -51.312 -77.586 1.00 90.96 ? 174 LYS C CG 1 ATOM 4440 C CD . LYS C 3 171 ? -11.033 -52.150 -77.733 1.00 90.42 ? 174 LYS C CD 1 ATOM 4441 C CE . LYS C 3 171 ? -11.359 -53.510 -78.323 1.00 90.33 ? 174 LYS C CE 1 ATOM 4442 N NZ . LYS C 3 171 ? -11.939 -53.418 -79.693 1.00 90.37 ? 174 LYS C NZ 1 ATOM 4443 N N . SER C 3 172 ? -13.085 -47.183 -76.027 1.00 90.81 ? 175 SER C N 1 ATOM 4444 C CA . SER C 3 172 ? -12.856 -45.889 -75.382 1.00 90.47 ? 175 SER C CA 1 ATOM 4445 C C . SER C 3 172 ? -13.111 -45.923 -73.886 1.00 90.20 ? 175 SER C C 1 ATOM 4446 O O . SER C 3 172 ? -14.054 -46.561 -73.420 1.00 90.14 ? 175 SER C O 1 ATOM 4447 C CB . SER C 3 172 ? -13.742 -44.816 -76.011 1.00 90.55 ? 175 SER C CB 1 ATOM 4448 O OG . SER C 3 172 ? -15.094 -45.240 -76.041 1.00 90.60 ? 175 SER C OG 1 ATOM 4449 N N . ASN C 3 173 ? -12.282 -45.215 -73.123 1.00 89.90 ? 176 ASN C N 1 ATOM 4450 C CA . ASN C 3 173 ? -12.482 -45.063 -71.677 1.00 89.76 ? 176 ASN C CA 1 ATOM 4451 C C . ASN C 3 173 ? -13.661 -44.152 -71.305 1.00 89.81 ? 176 ASN C C 1 ATOM 4452 O O . ASN C 3 173 ? -13.960 -43.197 -72.023 1.00 89.88 ? 176 ASN C O 1 ATOM 4453 C CB . ASN C 3 173 ? -11.200 -44.558 -71.010 1.00 89.62 ? 176 ASN C CB 1 ATOM 4454 C CG . ASN C 3 173 ? -10.259 -45.685 -70.630 1.00 89.81 ? 176 ASN C CG 1 ATOM 4455 O OD1 . ASN C 3 173 ? -10.582 -46.521 -69.787 1.00 89.81 ? 176 ASN C OD1 1 ATOM 4456 N ND2 . ASN C 3 173 ? -9.086 -45.711 -71.252 1.00 90.40 ? 176 ASN C ND2 1 ATOM 4457 N N . SER C 3 174 ? -14.325 -44.446 -70.187 1.00 89.92 ? 177 SER C N 1 ATOM 4458 C CA . SER C 3 174 ? -15.459 -43.634 -69.729 1.00 90.00 ? 177 SER C CA 1 ATOM 4459 C C . SER C 3 174 ? -15.438 -43.302 -68.228 1.00 90.16 ? 177 SER C C 1 ATOM 4460 O O . SER C 3 174 ? -14.988 -44.106 -67.411 1.00 90.06 ? 177 SER C O 1 ATOM 4461 C CB . SER C 3 174 ? -16.781 -44.315 -70.092 1.00 89.95 ? 177 SER C CB 1 ATOM 4462 O OG . SER C 3 174 ? -16.659 -45.059 -71.292 1.00 90.07 ? 177 SER C OG 1 ATOM 4463 N N . ALA C 3 175 ? -15.934 -42.114 -67.880 1.00 90.55 ? 178 ALA C N 1 ATOM 4464 C CA . ALA C 3 175 ? -16.054 -41.675 -66.485 1.00 91.10 ? 178 ALA C CA 1 ATOM 4465 C C . ALA C 3 175 ? -17.227 -40.701 -66.320 1.00 91.43 ? 178 ALA C C 1 ATOM 4466 O O . ALA C 3 175 ? -17.663 -40.095 -67.298 1.00 91.60 ? 178 ALA C O 1 ATOM 4467 C CB . ALA C 3 175 ? -14.758 -41.035 -66.017 1.00 91.10 ? 178 ALA C CB 1 ATOM 4468 N N . VAL C 3 176 ? -17.739 -40.542 -65.098 1.00 91.76 ? 179 VAL C N 1 ATOM 4469 C CA . VAL C 3 176 ? -18.848 -39.609 -64.886 1.00 92.00 ? 179 VAL C CA 1 ATOM 4470 C C . VAL C 3 176 ? -18.733 -38.894 -63.532 1.00 92.36 ? 179 VAL C C 1 ATOM 4471 O O . VAL C 3 176 ? -18.244 -39.470 -62.550 1.00 92.27 ? 179 VAL C O 1 ATOM 4472 C CB . VAL C 3 176 ? -20.224 -40.335 -65.039 1.00 91.91 ? 179 VAL C CB 1 ATOM 4473 C CG1 . VAL C 3 176 ? -21.392 -39.423 -64.697 1.00 91.77 ? 179 VAL C CG1 1 ATOM 4474 C CG2 . VAL C 3 176 ? -20.388 -40.875 -66.452 1.00 91.72 ? 179 VAL C CG2 1 ATOM 4475 N N . ALA C 3 177 ? -19.166 -37.630 -63.511 1.00 92.79 ? 180 ALA C N 1 ATOM 4476 C CA . ALA C 3 177 ? -19.243 -36.821 -62.289 1.00 93.13 ? 180 ALA C CA 1 ATOM 4477 C C . ALA C 3 177 ? -20.596 -36.118 -62.167 1.00 93.41 ? 180 ALA C C 1 ATOM 4478 O O . ALA C 3 177 ? -21.215 -35.762 -63.177 1.00 93.35 ? 180 ALA C O 1 ATOM 4479 C CB . ALA C 3 177 ? -18.115 -35.807 -62.249 1.00 93.12 ? 180 ALA C CB 1 ATOM 4480 N N . TRP C 3 178 ? -21.051 -35.927 -60.927 1.00 93.84 ? 181 TRP C N 1 ATOM 4481 C CA . TRP C 3 178 ? -22.333 -35.260 -60.651 1.00 94.33 ? 181 TRP C CA 1 ATOM 4482 C C . TRP C 3 178 ? -22.433 -34.703 -59.222 1.00 94.33 ? 181 TRP C C 1 ATOM 4483 O O . TRP C 3 178 ? -21.778 -35.207 -58.298 1.00 94.32 ? 181 TRP C O 1 ATOM 4484 C CB . TRP C 3 178 ? -23.523 -36.203 -60.935 1.00 94.52 ? 181 TRP C CB 1 ATOM 4485 C CG . TRP C 3 178 ? -23.717 -37.314 -59.905 1.00 95.45 ? 181 TRP C CG 1 ATOM 4486 C CD1 . TRP C 3 178 ? -24.428 -37.239 -58.733 1.00 95.89 ? 181 TRP C CD1 1 ATOM 4487 C CD2 . TRP C 3 178 ? -23.198 -38.650 -59.968 1.00 96.10 ? 181 TRP C CD2 1 ATOM 4488 N NE1 . TRP C 3 178 ? -24.375 -38.439 -58.066 1.00 96.07 ? 181 TRP C NE1 1 ATOM 4489 C CE2 . TRP C 3 178 ? -23.629 -39.323 -58.801 1.00 96.16 ? 181 TRP C CE2 1 ATOM 4490 C CE3 . TRP C 3 178 ? -22.408 -39.343 -60.895 1.00 96.51 ? 181 TRP C CE3 1 ATOM 4491 C CZ2 . TRP C 3 178 ? -23.295 -40.653 -58.537 1.00 96.34 ? 181 TRP C CZ2 1 ATOM 4492 C CZ3 . TRP C 3 178 ? -22.078 -40.668 -60.632 1.00 96.75 ? 181 TRP C CZ3 1 ATOM 4493 C CH2 . TRP C 3 178 ? -22.522 -41.307 -59.461 1.00 96.65 ? 181 TRP C CH2 1 ATOM 4494 N N . SER C 3 179 ? -23.253 -33.662 -59.060 1.00 94.32 ? 182 SER C N 1 ATOM 4495 C CA . SER C 3 179 ? -23.693 -33.200 -57.739 1.00 94.29 ? 182 SER C CA 1 ATOM 4496 C C . SER C 3 179 ? -25.111 -32.631 -57.793 1.00 94.23 ? 182 SER C C 1 ATOM 4497 O O . SER C 3 179 ? -25.446 -31.842 -58.678 1.00 94.14 ? 182 SER C O 1 ATOM 4498 C CB . SER C 3 179 ? -22.731 -32.169 -57.150 1.00 94.28 ? 182 SER C CB 1 ATOM 4499 O OG . SER C 3 179 ? -23.044 -31.918 -55.788 1.00 94.37 ? 182 SER C OG 1 ATOM 4500 N N . ALA C 3 185 ? -21.103 -27.198 -61.970 1.00 110.29 ? 188 ALA C N 1 ATOM 4501 C CA . ALA C 3 185 ? -19.658 -27.051 -62.110 1.00 110.29 ? 188 ALA C CA 1 ATOM 4502 C C . ALA C 3 185 ? -19.058 -28.171 -62.972 1.00 110.27 ? 188 ALA C C 1 ATOM 4503 O O . ALA C 3 185 ? -18.334 -29.034 -62.472 1.00 110.27 ? 188 ALA C O 1 ATOM 4504 C CB . ALA C 3 185 ? -18.994 -26.998 -60.730 1.00 110.28 ? 188 ALA C CB 1 ATOM 4505 N N . CYS C 3 186 ? -19.371 -28.148 -64.267 1.00 110.28 ? 189 CYS C N 1 ATOM 4506 C CA . CYS C 3 186 ? -18.882 -29.163 -65.211 1.00 110.21 ? 189 CYS C CA 1 ATOM 4507 C C . CYS C 3 186 ? -17.431 -28.893 -65.613 1.00 110.36 ? 189 CYS C C 1 ATOM 4508 O O . CYS C 3 186 ? -16.551 -29.730 -65.379 1.00 110.29 ? 189 CYS C O 1 ATOM 4509 C CB . CYS C 3 186 ? -19.789 -29.240 -66.452 1.00 110.01 ? 189 CYS C CB 1 ATOM 4510 S SG . CYS C 3 186 ? -19.514 -30.679 -67.541 1.00 109.02 ? 189 CYS C SG 1 ATOM 4511 N N . ALA C 3 187 ? -17.199 -27.713 -66.194 1.00 110.52 ? 190 ALA C N 1 ATOM 4512 C CA . ALA C 3 187 ? -15.874 -27.264 -66.636 1.00 110.68 ? 190 ALA C CA 1 ATOM 4513 C C . ALA C 3 187 ? -14.755 -27.582 -65.637 1.00 110.79 ? 190 ALA C C 1 ATOM 4514 O O . ALA C 3 187 ? -13.618 -27.831 -66.036 1.00 110.81 ? 190 ALA C O 1 ATOM 4515 C CB . ALA C 3 187 ? -15.903 -25.774 -66.960 1.00 110.65 ? 190 ALA C CB 1 ATOM 4516 N N . ASN C 3 188 ? -15.082 -27.565 -64.348 1.00 110.94 ? 191 ASN C N 1 ATOM 4517 C CA . ASN C 3 188 ? -14.172 -28.064 -63.330 1.00 111.18 ? 191 ASN C CA 1 ATOM 4518 C C . ASN C 3 188 ? -14.728 -29.290 -62.627 1.00 111.43 ? 191 ASN C C 1 ATOM 4519 O O . ASN C 3 188 ? -15.774 -29.223 -61.981 1.00 111.44 ? 191 ASN C O 1 ATOM 4520 C CB . ASN C 3 188 ? -13.839 -26.993 -62.293 1.00 111.16 ? 191 ASN C CB 1 ATOM 4521 C CG . ASN C 3 188 ? -13.131 -27.570 -61.076 1.00 111.12 ? 191 ASN C CG 1 ATOM 4522 O OD1 . ASN C 3 188 ? -11.971 -27.983 -61.150 1.00 110.79 ? 191 ASN C OD1 1 ATOM 4523 N ND2 . ASN C 3 188 ? -13.838 -27.618 -59.952 1.00 111.07 ? 191 ASN C ND2 1 ATOM 4524 N N . ALA C 3 189 ? -14.003 -30.398 -62.756 1.00 111.80 ? 192 ALA C N 1 ATOM 4525 C CA . ALA C 3 189 ? -14.299 -31.649 -62.060 1.00 112.05 ? 192 ALA C CA 1 ATOM 4526 C C . ALA C 3 189 ? -13.051 -32.539 -62.031 1.00 112.30 ? 192 ALA C C 1 ATOM 4527 O O . ALA C 3 189 ? -12.107 -32.318 -62.793 1.00 112.28 ? 192 ALA C O 1 ATOM 4528 C CB . ALA C 3 189 ? -15.465 -32.373 -62.733 1.00 111.98 ? 192 ALA C CB 1 ATOM 4529 N N . PHE C 3 190 ? -13.057 -33.527 -61.135 1.00 112.68 ? 193 PHE C N 1 ATOM 4530 C CA . PHE C 3 190 ? -12.018 -34.585 -61.032 1.00 113.09 ? 193 PHE C CA 1 ATOM 4531 C C . PHE C 3 190 ? -10.538 -34.237 -61.323 1.00 113.24 ? 193 PHE C C 1 ATOM 4532 O O . PHE C 3 190 ? -9.832 -35.028 -61.964 1.00 113.28 ? 193 PHE C O 1 ATOM 4533 C CB . PHE C 3 190 ? -12.434 -35.871 -61.797 1.00 113.13 ? 193 PHE C CB 1 ATOM 4534 C CG . PHE C 3 190 ? -13.031 -35.627 -63.173 1.00 113.26 ? 193 PHE C CG 1 ATOM 4535 C CD1 . PHE C 3 190 ? -12.232 -35.225 -64.243 1.00 113.41 ? 193 PHE C CD1 1 ATOM 4536 C CD2 . PHE C 3 190 ? -14.393 -35.830 -63.400 1.00 113.05 ? 193 PHE C CD2 1 ATOM 4537 C CE1 . PHE C 3 190 ? -12.787 -35.007 -65.508 1.00 113.20 ? 193 PHE C CE1 1 ATOM 4538 C CE2 . PHE C 3 190 ? -14.954 -35.618 -64.662 1.00 112.81 ? 193 PHE C CE2 1 ATOM 4539 C CZ . PHE C 3 190 ? -14.150 -35.203 -65.711 1.00 112.92 ? 193 PHE C CZ 1 ATOM 4540 N N . ASN C 3 191 ? -10.049 -33.089 -60.843 1.00 113.33 ? 194 ASN C N 1 ATOM 4541 C CA . ASN C 3 191 ? -8.632 -32.696 -61.037 1.00 113.35 ? 194 ASN C CA 1 ATOM 4542 C C . ASN C 3 191 ? -7.498 -33.532 -60.381 1.00 113.49 ? 194 ASN C C 1 ATOM 4543 O O . ASN C 3 191 ? -6.510 -33.862 -61.037 1.00 113.49 ? 194 ASN C O 1 ATOM 4544 C CB . ASN C 3 191 ? -8.447 -31.218 -60.675 1.00 113.26 ? 194 ASN C CB 1 ATOM 4545 C CG . ASN C 3 191 ? -9.740 -30.432 -60.755 1.00 113.23 ? 194 ASN C CG 1 ATOM 4546 O OD1 . ASN C 3 191 ? -10.649 -30.785 -61.507 1.00 113.15 ? 194 ASN C OD1 1 ATOM 4547 N ND2 . ASN C 3 191 ? -9.830 -29.359 -59.978 1.00 113.20 ? 194 ASN C ND2 1 ATOM 4548 N N . ASN C 3 192 ? -7.657 -33.878 -59.103 1.00 113.64 ? 195 ASN C N 1 ATOM 4549 C CA . ASN C 3 192 ? -6.827 -34.858 -58.393 1.00 113.76 ? 195 ASN C CA 1 ATOM 4550 C C . ASN C 3 192 ? -7.221 -34.902 -56.915 1.00 113.73 ? 195 ASN C C 1 ATOM 4551 O O . ASN C 3 192 ? -7.885 -35.836 -56.459 1.00 113.71 ? 195 ASN C O 1 ATOM 4552 C CB . ASN C 3 192 ? -5.334 -34.509 -58.532 1.00 113.80 ? 195 ASN C CB 1 ATOM 4553 C CG . ASN C 3 192 ? -4.412 -35.676 -58.183 1.00 113.81 ? 195 ASN C CG 1 ATOM 4554 O OD1 . ASN C 3 192 ? -4.375 -36.144 -57.043 1.00 114.02 ? 195 ASN C OD1 1 ATOM 4555 N ND2 . ASN C 3 192 ? -3.642 -36.129 -59.166 1.00 113.66 ? 195 ASN C ND2 1 ATOM 4556 N N . ILE C 3 195 ? -4.434 -35.126 -65.545 1.00 121.03 ? 198 ILE C N 1 ATOM 4557 C CA . ILE C 3 195 ? -5.354 -34.642 -66.571 1.00 121.16 ? 198 ILE C CA 1 ATOM 4558 C C . ILE C 3 195 ? -4.614 -33.885 -67.686 1.00 121.34 ? 198 ILE C C 1 ATOM 4559 O O . ILE C 3 195 ? -3.820 -32.984 -67.397 1.00 121.38 ? 198 ILE C O 1 ATOM 4560 C CB . ILE C 3 195 ? -6.457 -33.748 -65.959 1.00 121.08 ? 198 ILE C CB 1 ATOM 4561 C CG1 . ILE C 3 195 ? -7.217 -34.523 -64.881 1.00 121.02 ? 198 ILE C CG1 1 ATOM 4562 C CG2 . ILE C 3 195 ? -7.411 -33.217 -67.042 1.00 120.81 ? 198 ILE C CG2 1 ATOM 4563 C CD1 . ILE C 3 195 ? -8.386 -33.775 -64.305 1.00 121.33 ? 198 ILE C CD1 1 ATOM 4564 N N . PRO C 3 196 ? -4.872 -34.253 -68.963 1.00 121.44 ? 199 PRO C N 1 ATOM 4565 C CA . PRO C 3 196 ? -4.245 -33.575 -70.103 1.00 121.46 ? 199 PRO C CA 1 ATOM 4566 C C . PRO C 3 196 ? -4.954 -32.273 -70.490 1.00 121.52 ? 199 PRO C C 1 ATOM 4567 O O . PRO C 3 196 ? -6.182 -32.183 -70.390 1.00 121.48 ? 199 PRO C O 1 ATOM 4568 C CB . PRO C 3 196 ? -4.367 -34.599 -71.245 1.00 121.45 ? 199 PRO C CB 1 ATOM 4569 C CG . PRO C 3 196 ? -5.144 -35.768 -70.696 1.00 121.41 ? 199 PRO C CG 1 ATOM 4570 C CD . PRO C 3 196 ? -5.755 -35.346 -69.406 1.00 121.44 ? 199 PRO C CD 1 ATOM 4571 N N . GLU C 3 197 ? -4.175 -31.283 -70.931 1.00 121.58 ? 200 GLU C N 1 ATOM 4572 C CA . GLU C 3 197 ? -4.709 -29.984 -71.371 1.00 121.60 ? 200 GLU C CA 1 ATOM 4573 C C . GLU C 3 197 ? -5.306 -30.033 -72.782 1.00 121.59 ? 200 GLU C C 1 ATOM 4574 O O . GLU C 3 197 ? -6.028 -29.119 -73.190 1.00 121.55 ? 200 GLU C O 1 ATOM 4575 C CB . GLU C 3 197 ? -3.631 -28.891 -71.311 1.00 121.61 ? 200 GLU C CB 1 ATOM 4576 C CG . GLU C 3 197 ? -3.108 -28.566 -69.916 1.00 121.62 ? 200 GLU C CG 1 ATOM 4577 C CD . GLU C 3 197 ? -1.853 -29.343 -69.551 1.00 121.71 ? 200 GLU C CD 1 ATOM 4578 O OE1 . GLU C 3 197 ? -1.219 -28.984 -68.539 1.00 121.90 ? 200 GLU C OE1 1 ATOM 4579 O OE2 . GLU C 3 197 ? -1.492 -30.302 -70.267 1.00 121.64 ? 200 GLU C OE2 1 ATOM 4580 N N . ASP C 3 198 ? -5.006 -31.106 -73.513 1.00 121.58 ? 201 ASP C N 1 ATOM 4581 C CA . ASP C 3 198 ? -5.441 -31.280 -74.905 1.00 121.52 ? 201 ASP C CA 1 ATOM 4582 C C . ASP C 3 198 ? -6.965 -31.412 -75.043 1.00 121.47 ? 201 ASP C C 1 ATOM 4583 O O . ASP C 3 198 ? -7.480 -31.609 -76.147 1.00 121.36 ? 201 ASP C O 1 ATOM 4584 C CB . ASP C 3 198 ? -4.743 -32.504 -75.518 1.00 121.48 ? 201 ASP C CB 1 ATOM 4585 C CG . ASP C 3 198 ? -3.268 -32.599 -75.132 1.00 121.54 ? 201 ASP C CG 1 ATOM 4586 O OD1 . ASP C 3 198 ? -2.546 -31.582 -75.226 1.00 121.57 ? 201 ASP C OD1 1 ATOM 4587 O OD2 . ASP C 3 198 ? -2.829 -33.698 -74.734 1.00 121.63 ? 201 ASP C OD2 1 ATOM 4588 N N . THR C 3 199 ? -7.667 -31.273 -73.918 1.00 121.50 ? 202 THR C N 1 ATOM 4589 C CA . THR C 3 199 ? -9.107 -31.541 -73.815 1.00 121.51 ? 202 THR C CA 1 ATOM 4590 C C . THR C 3 199 ? -10.004 -30.476 -74.458 1.00 121.47 ? 202 THR C C 1 ATOM 4591 O O . THR C 3 199 ? -9.624 -29.308 -74.562 1.00 121.51 ? 202 THR C O 1 ATOM 4592 C CB . THR C 3 199 ? -9.544 -31.751 -72.339 1.00 121.52 ? 202 THR C CB 1 ATOM 4593 O OG1 . THR C 3 199 ? -9.117 -30.638 -71.546 1.00 121.52 ? 202 THR C OG1 1 ATOM 4594 C CG2 . THR C 3 199 ? -8.949 -33.034 -71.767 1.00 121.51 ? 202 THR C CG2 1 ATOM 4595 N N . PHE C 3 200 ? -11.195 -30.906 -74.880 1.00 121.38 ? 203 PHE C N 1 ATOM 4596 C CA . PHE C 3 200 ? -12.196 -30.050 -75.520 1.00 121.33 ? 203 PHE C CA 1 ATOM 4597 C C . PHE C 3 200 ? -13.266 -29.634 -74.508 1.00 121.25 ? 203 PHE C C 1 ATOM 4598 O O . PHE C 3 200 ? -13.524 -30.350 -73.538 1.00 121.27 ? 203 PHE C O 1 ATOM 4599 C CB . PHE C 3 200 ? -12.827 -30.793 -76.712 1.00 121.40 ? 203 PHE C CB 1 ATOM 4600 C CG . PHE C 3 200 ? -13.886 -30.006 -77.457 1.00 121.66 ? 203 PHE C CG 1 ATOM 4601 C CD1 . PHE C 3 200 ? -13.538 -29.172 -78.520 1.00 121.87 ? 203 PHE C CD1 1 ATOM 4602 C CD2 . PHE C 3 200 ? -15.233 -30.124 -77.114 1.00 121.97 ? 203 PHE C CD2 1 ATOM 4603 C CE1 . PHE C 3 200 ? -14.513 -28.454 -79.217 1.00 122.02 ? 203 PHE C CE1 1 ATOM 4604 C CE2 . PHE C 3 200 ? -16.215 -29.408 -77.801 1.00 122.17 ? 203 PHE C CE2 1 ATOM 4605 C CZ . PHE C 3 200 ? -15.854 -28.573 -78.855 1.00 122.22 ? 203 PHE C CZ 1 ATOM 4606 N N . PHE C 3 201 ? -13.869 -28.466 -74.737 1.00 121.15 ? 204 PHE C N 1 ATOM 4607 C CA . PHE C 3 201 ? -14.976 -27.955 -73.926 1.00 120.92 ? 204 PHE C CA 1 ATOM 4608 C C . PHE C 3 201 ? -15.998 -27.257 -74.821 1.00 120.80 ? 204 PHE C C 1 ATOM 4609 O O . PHE C 3 201 ? -17.135 -27.015 -74.419 1.00 120.60 ? 204 PHE C O 1 ATOM 4610 C CB . PHE C 3 201 ? -14.465 -26.983 -72.855 1.00 120.89 ? 204 PHE C CB 1 ATOM 4611 C CG . PHE C 3 201 ? -13.696 -27.646 -71.740 1.00 120.70 ? 204 PHE C CG 1 ATOM 4612 C CD1 . PHE C 3 201 ? -14.353 -28.103 -70.601 1.00 120.45 ? 204 PHE C CD1 1 ATOM 4613 C CD2 . PHE C 3 201 ? -12.313 -27.800 -71.822 1.00 120.51 ? 204 PHE C CD2 1 ATOM 4614 C CE1 . PHE C 3 201 ? -13.647 -28.711 -69.566 1.00 120.25 ? 204 PHE C CE1 1 ATOM 4615 C CE2 . PHE C 3 201 ? -11.600 -28.411 -70.794 1.00 120.26 ? 204 PHE C CE2 1 ATOM 4616 C CZ . PHE C 3 201 ? -12.268 -28.865 -69.663 1.00 120.21 ? 204 PHE C CZ 1 ATOM 4617 N N . GLY D 4 3 ? -24.560 -81.955 -68.989 1.00 57.04 ? 1 GLY D N 1 ATOM 4618 C CA . GLY D 4 3 ? -25.662 -81.473 -69.884 1.00 57.53 ? 1 GLY D CA 1 ATOM 4619 C C . GLY D 4 3 ? -26.898 -81.000 -69.121 1.00 57.65 ? 1 GLY D C 1 ATOM 4620 O O . GLY D 4 3 ? -27.848 -81.767 -68.912 1.00 58.06 ? 1 GLY D O 1 ATOM 4621 N N . GLY D 4 4 ? -26.888 -79.728 -68.721 1.00 57.33 ? 2 GLY D N 1 ATOM 4622 C CA . GLY D 4 4 ? -27.892 -79.159 -67.817 1.00 56.65 ? 2 GLY D CA 1 ATOM 4623 C C . GLY D 4 4 ? -27.213 -78.098 -66.966 1.00 56.29 ? 2 GLY D C 1 ATOM 4624 O O . GLY D 4 4 ? -26.170 -77.567 -67.357 1.00 56.22 ? 2 GLY D O 1 ATOM 4625 N N . ILE D 4 5 ? -27.781 -77.783 -65.803 1.00 55.75 ? 3 ILE D N 1 ATOM 4626 C CA . ILE D 4 5 ? -27.193 -76.749 -64.948 1.00 55.18 ? 3 ILE D CA 1 ATOM 4627 C C . ILE D 4 5 ? -27.302 -76.989 -63.458 1.00 54.72 ? 3 ILE D C 1 ATOM 4628 O O . ILE D 4 5 ? -28.208 -77.663 -62.988 1.00 54.73 ? 3 ILE D O 1 ATOM 4629 C CB . ILE D 4 5 ? -27.788 -75.343 -65.199 1.00 55.27 ? 3 ILE D CB 1 ATOM 4630 C CG1 . ILE D 4 5 ? -29.324 -75.381 -65.151 1.00 55.01 ? 3 ILE D CG1 1 ATOM 4631 C CG2 . ILE D 4 5 ? -27.213 -74.727 -66.484 1.00 55.57 ? 3 ILE D CG2 1 ATOM 4632 C CD1 . ILE D 4 5 ? -29.945 -74.138 -64.530 1.00 54.45 ? 3 ILE D CD1 1 ATOM 4633 N N . ILE D 4 6 ? -26.361 -76.400 -62.730 1.00 54.21 ? 4 ILE D N 1 ATOM 4634 C CA . ILE D 4 6 ? -26.406 -76.311 -61.289 1.00 53.66 ? 4 ILE D CA 1 ATOM 4635 C C . ILE D 4 6 ? -26.774 -74.873 -60.937 1.00 53.73 ? 4 ILE D C 1 ATOM 4636 O O . ILE D 4 6 ? -26.141 -73.933 -61.417 1.00 53.85 ? 4 ILE D O 1 ATOM 4637 C CB . ILE D 4 6 ? -25.057 -76.691 -60.673 1.00 53.40 ? 4 ILE D CB 1 ATOM 4638 C CG1 . ILE D 4 6 ? -24.982 -76.202 -59.232 1.00 53.48 ? 4 ILE D CG1 1 ATOM 4639 C CG2 . ILE D 4 6 ? -23.919 -76.118 -61.497 1.00 53.16 ? 4 ILE D CG2 1 ATOM 4640 C CD1 . ILE D 4 6 ? -23.823 -76.736 -58.454 1.00 54.31 ? 4 ILE D CD1 1 ATOM 4641 N N . THR D 4 7 ? -27.802 -74.708 -60.105 1.00 53.83 ? 5 THR D N 1 ATOM 4642 C CA . THR D 4 7 ? -28.326 -73.381 -59.752 1.00 53.82 ? 5 THR D CA 1 ATOM 4643 C C . THR D 4 7 ? -28.527 -73.151 -58.248 1.00 53.85 ? 5 THR D C 1 ATOM 4644 O O . THR D 4 7 ? -29.151 -73.960 -57.565 1.00 53.67 ? 5 THR D O 1 ATOM 4645 C CB . THR D 4 7 ? -29.656 -73.086 -60.487 1.00 53.84 ? 5 THR D CB 1 ATOM 4646 O OG1 . THR D 4 7 ? -30.307 -71.975 -59.859 1.00 54.18 ? 5 THR D OG1 1 ATOM 4647 C CG2 . THR D 4 7 ? -30.598 -74.304 -60.461 1.00 53.62 ? 5 THR D CG2 1 ATOM 4648 N N . GLN D 4 8 ? -28.001 -72.034 -57.749 1.00 54.06 ? 6 GLN D N 1 ATOM 4649 C CA . GLN D 4 8 ? -28.197 -71.627 -56.357 1.00 54.48 ? 6 GLN D CA 1 ATOM 4650 C C . GLN D 4 8 ? -29.248 -70.535 -56.293 1.00 55.01 ? 6 GLN D C 1 ATOM 4651 O O . GLN D 4 8 ? -29.143 -69.534 -56.993 1.00 55.11 ? 6 GLN D O 1 ATOM 4652 C CB . GLN D 4 8 ? -26.914 -71.052 -55.756 1.00 54.25 ? 6 GLN D CB 1 ATOM 4653 C CG . GLN D 4 8 ? -25.650 -71.841 -56.008 1.00 54.32 ? 6 GLN D CG 1 ATOM 4654 C CD . GLN D 4 8 ? -24.392 -71.049 -55.679 1.00 53.89 ? 6 GLN D CD 1 ATOM 4655 O OE1 . GLN D 4 8 ? -24.401 -70.177 -54.813 1.00 53.14 ? 6 GLN D OE1 1 ATOM 4656 N NE2 . GLN D 4 8 ? -23.302 -71.357 -56.373 1.00 54.11 ? 6 GLN D NE2 1 ATOM 4657 N N . THR D 4 9 ? -30.259 -70.715 -55.454 1.00 55.73 ? 7 THR D N 1 ATOM 4658 C CA . THR D 4 9 ? -31.196 -69.630 -55.177 1.00 56.47 ? 7 THR D CA 1 ATOM 4659 C C . THR D 4 9 ? -31.091 -69.272 -53.697 1.00 57.12 ? 7 THR D C 1 ATOM 4660 O O . THR D 4 9 ? -31.047 -70.169 -52.854 1.00 57.10 ? 7 THR D O 1 ATOM 4661 C CB . THR D 4 9 ? -32.652 -70.004 -55.526 1.00 56.36 ? 7 THR D CB 1 ATOM 4662 O OG1 . THR D 4 9 ? -33.051 -71.116 -54.728 1.00 56.53 ? 7 THR D OG1 1 ATOM 4663 C CG2 . THR D 4 9 ? -32.803 -70.368 -57.005 1.00 56.34 ? 7 THR D CG2 1 ATOM 4664 N N . PRO D 4 10 ? -31.053 -67.965 -53.365 1.00 57.89 ? 8 PRO D N 1 ATOM 4665 C CA . PRO D 4 10 ? -31.159 -66.778 -54.224 1.00 58.48 ? 8 PRO D CA 1 ATOM 4666 C C . PRO D 4 10 ? -29.814 -66.197 -54.647 1.00 59.10 ? 8 PRO D C 1 ATOM 4667 O O . PRO D 4 10 ? -28.792 -66.501 -54.033 1.00 59.13 ? 8 PRO D O 1 ATOM 4668 C CB . PRO D 4 10 ? -31.867 -65.779 -53.318 1.00 58.52 ? 8 PRO D CB 1 ATOM 4669 C CG . PRO D 4 10 ? -31.393 -66.140 -51.923 1.00 58.09 ? 8 PRO D CG 1 ATOM 4670 C CD . PRO D 4 10 ? -30.978 -67.592 -51.938 1.00 57.89 ? 8 PRO D CD 1 ATOM 4671 N N . LYS D 4 11 ? -29.822 -65.354 -55.677 1.00 59.87 ? 9 LYS D N 1 ATOM 4672 C CA . LYS D 4 11 ? -28.591 -64.720 -56.141 1.00 60.70 ? 9 LYS D CA 1 ATOM 4673 C C . LYS D 4 11 ? -28.080 -63.785 -55.060 1.00 60.94 ? 9 LYS D C 1 ATOM 4674 O O . LYS D 4 11 ? -26.907 -63.821 -54.693 1.00 60.91 ? 9 LYS D O 1 ATOM 4675 C CB . LYS D 4 11 ? -28.818 -63.940 -57.435 1.00 60.92 ? 9 LYS D CB 1 ATOM 4676 C CG . LYS D 4 11 ? -29.265 -64.770 -58.638 1.00 62.49 ? 9 LYS D CG 1 ATOM 4677 C CD . LYS D 4 11 ? -29.277 -63.899 -59.902 1.00 65.02 ? 9 LYS D CD 1 ATOM 4678 C CE . LYS D 4 11 ? -29.980 -64.570 -61.081 1.00 66.11 ? 9 LYS D CE 1 ATOM 4679 N NZ . LYS D 4 11 ? -30.008 -63.653 -62.272 1.00 66.68 ? 9 LYS D NZ 1 ATOM 4680 N N . PHE D 4 12 ? -28.986 -62.960 -54.549 1.00 61.44 ? 10 PHE D N 1 ATOM 4681 C CA . PHE D 4 12 ? -28.675 -62.010 -53.494 1.00 62.06 ? 10 PHE D CA 1 ATOM 4682 C C . PHE D 4 12 ? -29.556 -62.297 -52.284 1.00 62.54 ? 10 PHE D C 1 ATOM 4683 O O . PHE D 4 12 ? -30.649 -62.836 -52.435 1.00 62.86 ? 10 PHE D O 1 ATOM 4684 C CB . PHE D 4 12 ? -28.882 -60.582 -54.001 1.00 61.98 ? 10 PHE D CB 1 ATOM 4685 C CG . PHE D 4 12 ? -28.037 -60.240 -55.195 1.00 62.07 ? 10 PHE D CG 1 ATOM 4686 C CD1 . PHE D 4 12 ? -26.665 -60.032 -55.058 1.00 62.16 ? 10 PHE D CD1 1 ATOM 4687 C CD2 . PHE D 4 12 ? -28.605 -60.140 -56.457 1.00 62.03 ? 10 PHE D CD2 1 ATOM 4688 C CE1 . PHE D 4 12 ? -25.871 -59.728 -56.163 1.00 62.49 ? 10 PHE D CE1 1 ATOM 4689 C CE2 . PHE D 4 12 ? -27.826 -59.834 -57.567 1.00 62.27 ? 10 PHE D CE2 1 ATOM 4690 C CZ . PHE D 4 12 ? -26.452 -59.628 -57.420 1.00 62.76 ? 10 PHE D CZ 1 ATOM 4691 N N . LEU D 4 13 ? -29.083 -61.943 -51.088 1.00 62.99 ? 11 LEU D N 1 ATOM 4692 C CA . LEU D 4 13 ? -29.802 -62.262 -49.847 1.00 63.32 ? 11 LEU D CA 1 ATOM 4693 C C . LEU D 4 13 ? -29.621 -61.210 -48.758 1.00 63.62 ? 11 LEU D C 1 ATOM 4694 O O . LEU D 4 13 ? -28.497 -60.886 -48.370 1.00 63.66 ? 11 LEU D O 1 ATOM 4695 C CB . LEU D 4 13 ? -29.366 -63.641 -49.338 1.00 63.47 ? 11 LEU D CB 1 ATOM 4696 C CG . LEU D 4 13 ? -29.540 -64.082 -47.882 1.00 63.41 ? 11 LEU D CG 1 ATOM 4697 C CD1 . LEU D 4 13 ? -31.009 -64.112 -47.481 1.00 63.69 ? 11 LEU D CD1 1 ATOM 4698 C CD2 . LEU D 4 13 ? -28.896 -65.449 -47.693 1.00 62.88 ? 11 LEU D CD2 1 ATOM 4699 N N . ILE D 4 14 ? -30.736 -60.681 -48.264 1.00 64.08 ? 12 ILE D N 1 ATOM 4700 C CA . ILE D 4 14 ? -30.688 -59.696 -47.187 1.00 64.65 ? 12 ILE D CA 1 ATOM 4701 C C . ILE D 4 14 ? -31.030 -60.356 -45.858 1.00 65.17 ? 12 ILE D C 1 ATOM 4702 O O . ILE D 4 14 ? -32.101 -60.952 -45.695 1.00 65.26 ? 12 ILE D O 1 ATOM 4703 C CB . ILE D 4 14 ? -31.598 -58.466 -47.450 1.00 64.55 ? 12 ILE D CB 1 ATOM 4704 C CG1 . ILE D 4 14 ? -31.082 -57.667 -48.652 1.00 64.74 ? 12 ILE D CG1 1 ATOM 4705 C CG2 . ILE D 4 14 ? -31.644 -57.565 -46.225 1.00 64.24 ? 12 ILE D CG2 1 ATOM 4706 C CD1 . ILE D 4 14 ? -32.078 -56.681 -49.234 1.00 64.55 ? 12 ILE D CD1 1 ATOM 4707 N N . GLY D 4 15 ? -30.090 -60.262 -44.924 1.00 65.70 ? 13 GLY D N 1 ATOM 4708 C CA . GLY D 4 15 ? -30.240 -60.851 -43.602 1.00 66.34 ? 13 GLY D CA 1 ATOM 4709 C C . GLY D 4 15 ? -29.880 -59.846 -42.528 1.00 66.81 ? 13 GLY D C 1 ATOM 4710 O O . GLY D 4 15 ? -29.162 -58.878 -42.794 1.00 66.89 ? 13 GLY D O 1 ATOM 4711 N N . GLN D 4 16 ? -30.390 -60.075 -41.318 1.00 67.19 ? 14 GLN D N 1 ATOM 4712 C CA . GLN D 4 16 ? -30.134 -59.200 -40.161 1.00 67.44 ? 14 GLN D CA 1 ATOM 4713 C C . GLN D 4 16 ? -29.325 -59.948 -39.101 1.00 67.38 ? 14 GLN D C 1 ATOM 4714 O O . GLN D 4 16 ? -29.264 -61.180 -39.123 1.00 67.53 ? 14 GLN D O 1 ATOM 4715 C CB . GLN D 4 16 ? -31.451 -58.684 -39.567 1.00 67.44 ? 14 GLN D CB 1 ATOM 4716 C CG . GLN D 4 16 ? -32.280 -57.840 -40.533 1.00 67.87 ? 14 GLN D CG 1 ATOM 4717 C CD . GLN D 4 16 ? -33.616 -57.402 -39.957 1.00 68.35 ? 14 GLN D CD 1 ATOM 4718 O OE1 . GLN D 4 16 ? -34.639 -57.425 -40.647 1.00 68.06 ? 14 GLN D OE1 1 ATOM 4719 N NE2 . GLN D 4 16 ? -33.611 -56.989 -38.690 1.00 68.80 ? 14 GLN D NE2 1 ATOM 4720 N N . GLU D 4 17 ? -28.708 -59.211 -38.178 1.00 67.13 ? 15 GLU D N 1 ATOM 4721 C CA . GLU D 4 17 ? -27.879 -59.836 -37.153 1.00 66.93 ? 15 GLU D CA 1 ATOM 4722 C C . GLU D 4 17 ? -28.664 -60.907 -36.398 1.00 66.58 ? 15 GLU D C 1 ATOM 4723 O O . GLU D 4 17 ? -29.810 -60.679 -36.000 1.00 66.52 ? 15 GLU D O 1 ATOM 4724 C CB . GLU D 4 17 ? -27.325 -58.793 -36.187 1.00 67.08 ? 15 GLU D CB 1 ATOM 4725 C CG . GLU D 4 17 ? -26.219 -59.328 -35.288 1.00 68.12 ? 15 GLU D CG 1 ATOM 4726 C CD . GLU D 4 17 ? -25.641 -58.279 -34.357 1.00 69.67 ? 15 GLU D CD 1 ATOM 4727 O OE1 . GLU D 4 17 ? -26.165 -57.145 -34.318 1.00 70.48 ? 15 GLU D OE1 1 ATOM 4728 O OE2 . GLU D 4 17 ? -24.651 -58.590 -33.659 1.00 70.52 ? 15 GLU D OE2 1 ATOM 4729 N N . GLY D 4 18 ? -28.048 -62.080 -36.246 1.00 66.19 ? 16 GLY D N 1 ATOM 4730 C CA . GLY D 4 18 ? -28.629 -63.200 -35.501 1.00 65.57 ? 16 GLY D CA 1 ATOM 4731 C C . GLY D 4 18 ? -29.783 -63.948 -36.158 1.00 65.17 ? 16 GLY D C 1 ATOM 4732 O O . GLY D 4 18 ? -30.381 -64.826 -35.533 1.00 65.23 ? 16 GLY D O 1 ATOM 4733 N N . GLN D 4 19 ? -30.095 -63.609 -37.409 1.00 64.62 ? 17 GLN D N 1 ATOM 4734 C CA . GLN D 4 19 ? -31.168 -64.262 -38.168 1.00 64.12 ? 17 GLN D CA 1 ATOM 4735 C C . GLN D 4 19 ? -30.750 -65.664 -38.652 1.00 63.89 ? 17 GLN D C 1 ATOM 4736 O O . GLN D 4 19 ? -29.560 -65.913 -38.877 1.00 64.06 ? 17 GLN D O 1 ATOM 4737 C CB . GLN D 4 19 ? -31.554 -63.373 -39.356 1.00 64.04 ? 17 GLN D CB 1 ATOM 4738 C CG . GLN D 4 19 ? -32.860 -63.738 -40.061 1.00 63.85 ? 17 GLN D CG 1 ATOM 4739 C CD . GLN D 4 19 ? -33.221 -62.783 -41.193 1.00 62.96 ? 17 GLN D CD 1 ATOM 4740 O OE1 . GLN D 4 19 ? -32.531 -61.794 -41.438 1.00 62.56 ? 17 GLN D OE1 1 ATOM 4741 N NE2 . GLN D 4 19 ? -34.313 -63.079 -41.886 1.00 62.54 ? 17 GLN D NE2 1 ATOM 4742 N N . LYS D 4 20 ? -31.719 -66.575 -38.791 1.00 63.39 ? 18 LYS D N 1 ATOM 4743 C CA . LYS D 4 20 ? -31.477 -67.890 -39.412 1.00 62.95 ? 18 LYS D CA 1 ATOM 4744 C C . LYS D 4 20 ? -31.644 -67.798 -40.936 1.00 62.49 ? 18 LYS D C 1 ATOM 4745 O O . LYS D 4 20 ? -32.691 -67.371 -41.428 1.00 62.36 ? 18 LYS D O 1 ATOM 4746 C CB . LYS D 4 20 ? -32.406 -68.970 -38.826 1.00 63.11 ? 18 LYS D CB 1 ATOM 4747 C CG . LYS D 4 20 ? -32.129 -70.403 -39.328 1.00 62.99 ? 18 LYS D CG 1 ATOM 4748 C CD . LYS D 4 20 ? -33.143 -71.419 -38.795 1.00 62.81 ? 18 LYS D CD 1 ATOM 4749 C CE . LYS D 4 20 ? -32.838 -72.820 -39.299 0.04 62.79 ? 18 LYS D CE 1 ATOM 4750 N NZ . LYS D 4 20 ? -33.832 -73.814 -38.806 0.04 62.75 ? 18 LYS D NZ 1 ATOM 4751 N N . LEU D 4 21 ? -30.609 -68.207 -41.671 1.00 61.95 ? 19 LEU D N 1 ATOM 4752 C CA . LEU D 4 21 ? -30.575 -68.055 -43.126 1.00 61.33 ? 19 LEU D CA 1 ATOM 4753 C C . LEU D 4 21 ? -30.375 -69.355 -43.891 1.00 60.93 ? 19 LEU D C 1 ATOM 4754 O O . LEU D 4 21 ? -29.525 -70.171 -43.538 1.00 60.86 ? 19 LEU D O 1 ATOM 4755 C CB . LEU D 4 21 ? -29.498 -67.051 -43.534 1.00 61.32 ? 19 LEU D CB 1 ATOM 4756 C CG . LEU D 4 21 ? -29.818 -65.554 -43.455 1.00 61.42 ? 19 LEU D CG 1 ATOM 4757 C CD1 . LEU D 4 21 ? -31.274 -65.259 -43.824 1.00 61.23 ? 19 LEU D CD1 1 ATOM 4758 C CD2 . LEU D 4 21 ? -29.457 -64.959 -42.099 1.00 61.69 ? 19 LEU D CD2 1 ATOM 4759 N N . THR D 4 22 ? -31.160 -69.516 -44.953 1.00 60.38 ? 20 THR D N 1 ATOM 4760 C CA . THR D 4 22 ? -31.150 -70.719 -45.784 1.00 60.00 ? 20 THR D CA 1 ATOM 4761 C C . THR D 4 22 ? -30.850 -70.356 -47.241 1.00 59.55 ? 20 THR D C 1 ATOM 4762 O O . THR D 4 22 ? -31.231 -69.281 -47.706 1.00 59.69 ? 20 THR D O 1 ATOM 4763 C CB . THR D 4 22 ? -32.512 -71.465 -45.678 1.00 60.05 ? 20 THR D CB 1 ATOM 4764 O OG1 . THR D 4 22 ? -32.731 -71.860 -44.319 1.00 60.17 ? 20 THR D OG1 1 ATOM 4765 C CG2 . THR D 4 22 ? -32.558 -72.710 -46.565 1.00 60.12 ? 20 THR D CG2 1 ATOM 4766 N N . LEU D 4 23 ? -30.148 -71.241 -47.948 1.00 58.77 ? 21 LEU D N 1 ATOM 4767 C CA . LEU D 4 23 ? -29.935 -71.084 -49.386 1.00 58.11 ? 21 LEU D CA 1 ATOM 4768 C C . LEU D 4 23 ? -29.926 -72.432 -50.088 1.00 57.72 ? 21 LEU D C 1 ATOM 4769 O O . LEU D 4 23 ? -29.159 -73.328 -49.733 1.00 57.81 ? 21 LEU D O 1 ATOM 4770 C CB . LEU D 4 23 ? -28.669 -70.271 -49.688 1.00 57.99 ? 21 LEU D CB 1 ATOM 4771 C CG . LEU D 4 23 ? -27.616 -70.174 -48.582 1.00 58.15 ? 21 LEU D CG 1 ATOM 4772 C CD1 . LEU D 4 23 ? -26.807 -71.432 -48.530 1.00 58.85 ? 21 LEU D CD1 1 ATOM 4773 C CD2 . LEU D 4 23 ? -26.700 -68.985 -48.772 1.00 58.06 ? 21 LEU D CD2 1 ATOM 4774 N N . LYS D 4 24 ? -30.811 -72.574 -51.068 1.00 57.16 ? 22 LYS D N 1 ATOM 4775 C CA . LYS D 4 24 ? -30.934 -73.805 -51.829 1.00 56.64 ? 22 LYS D CA 1 ATOM 4776 C C . LYS D 4 24 ? -29.893 -73.871 -52.948 1.00 56.31 ? 22 LYS D C 1 ATOM 4777 O O . LYS D 4 24 ? -29.284 -72.861 -53.325 1.00 56.01 ? 22 LYS D O 1 ATOM 4778 C CB . LYS D 4 24 ? -32.343 -73.946 -52.426 1.00 56.70 ? 22 LYS D CB 1 ATOM 4779 C CG . LYS D 4 24 ? -33.473 -74.064 -51.415 1.00 56.80 ? 22 LYS D CG 1 ATOM 4780 C CD . LYS D 4 24 ? -34.839 -74.219 -52.091 1.00 56.80 ? 22 LYS D CD 1 ATOM 4781 C CE . LYS D 4 24 ? -35.080 -75.646 -52.571 0.04 56.79 ? 22 LYS D CE 1 ATOM 4782 N NZ . LYS D 4 24 ? -36.422 -75.801 -53.197 0.04 56.75 ? 22 LYS D NZ 1 ATOM 4783 N N . CYS D 4 25 ? -29.710 -75.082 -53.466 1.00 55.87 ? 23 CYS D N 1 ATOM 4784 C CA . CYS D 4 25 ? -28.844 -75.347 -54.593 1.00 55.44 ? 23 CYS D CA 1 ATOM 4785 C C . CYS D 4 25 ? -29.365 -76.606 -55.270 1.00 55.43 ? 23 CYS D C 1 ATOM 4786 O O . CYS D 4 25 ? -29.496 -77.653 -54.630 1.00 55.57 ? 23 CYS D O 1 ATOM 4787 C CB . CYS D 4 25 ? -27.410 -75.547 -54.119 1.00 55.32 ? 23 CYS D CB 1 ATOM 4788 S SG . CYS D 4 25 ? -26.269 -75.984 -55.417 1.00 54.84 ? 23 CYS D SG 1 ATOM 4789 N N . GLN D 4 26 ? -29.692 -76.495 -56.555 1.00 55.24 ? 24 GLN D N 1 ATOM 4790 C CA . GLN D 4 26 ? -30.242 -77.622 -57.298 1.00 54.95 ? 24 GLN D CA 1 ATOM 4791 C C . GLN D 4 26 ? -29.379 -77.974 -58.500 1.00 54.38 ? 24 GLN D C 1 ATOM 4792 O O . GLN D 4 26 ? -28.720 -77.117 -59.092 1.00 54.35 ? 24 GLN D O 1 ATOM 4793 C CB . GLN D 4 26 ? -31.695 -77.368 -57.703 1.00 55.23 ? 24 GLN D CB 1 ATOM 4794 C CG . GLN D 4 26 ? -32.641 -77.238 -56.518 1.00 57.32 ? 24 GLN D CG 1 ATOM 4795 C CD . GLN D 4 26 ? -34.024 -77.795 -56.801 1.00 60.43 ? 24 GLN D CD 1 ATOM 4796 O OE1 . GLN D 4 26 ? -34.360 -78.914 -56.386 1.00 62.01 ? 24 GLN D OE1 1 ATOM 4797 N NE2 . GLN D 4 26 ? -34.836 -77.024 -57.517 1.00 61.28 ? 24 GLN D NE2 1 ATOM 4798 N N . GLN D 4 27 ? -29.399 -79.250 -58.855 1.00 53.66 ? 25 GLN D N 1 ATOM 4799 C CA . GLN D 4 27 ? -28.439 -79.811 -59.777 1.00 52.81 ? 25 GLN D CA 1 ATOM 4800 C C . GLN D 4 27 ? -29.121 -80.964 -60.494 1.00 52.44 ? 25 GLN D C 1 ATOM 4801 O O . GLN D 4 27 ? -29.720 -81.832 -59.853 1.00 52.57 ? 25 GLN D O 1 ATOM 4802 C CB . GLN D 4 27 ? -27.199 -80.263 -58.979 1.00 52.77 ? 25 GLN D CB 1 ATOM 4803 C CG . GLN D 4 27 ? -26.310 -81.312 -59.623 1.00 52.37 ? 25 GLN D CG 1 ATOM 4804 C CD . GLN D 4 27 ? -26.755 -82.724 -59.321 1.00 52.30 ? 25 GLN D CD 1 ATOM 4805 O OE1 . GLN D 4 27 ? -27.036 -83.502 -60.232 1.00 53.10 ? 25 GLN D OE1 1 ATOM 4806 N NE2 . GLN D 4 27 ? -26.838 -83.061 -58.040 1.00 52.17 ? 25 GLN D NE2 1 ATOM 4807 N N . ASN D 4 28 ? -29.042 -80.955 -61.822 1.00 51.74 ? 26 ASN D N 1 ATOM 4808 C CA . ASN D 4 28 ? -29.638 -81.997 -62.650 1.00 51.10 ? 26 ASN D CA 1 ATOM 4809 C C . ASN D 4 28 ? -28.576 -82.732 -63.489 1.00 50.58 ? 26 ASN D C 1 ATOM 4810 O O . ASN D 4 28 ? -28.829 -83.139 -64.632 1.00 50.66 ? 26 ASN D O 1 ATOM 4811 C CB . ASN D 4 28 ? -30.720 -81.385 -63.539 1.00 51.04 ? 26 ASN D CB 1 ATOM 4812 C CG . ASN D 4 28 ? -30.152 -80.398 -64.548 1.00 51.88 ? 26 ASN D CG 1 ATOM 4813 O OD1 . ASN D 4 28 ? -29.141 -79.741 -64.301 1.00 52.66 ? 26 ASN D OD1 1 ATOM 4814 N ND2 . ASN D 4 28 ? -30.792 -80.305 -65.701 1.00 53.56 ? 26 ASN D ND2 1 ATOM 4815 N N . PHE D 4 29 ? -27.386 -82.894 -62.914 1.00 49.72 ? 27 PHE D N 1 ATOM 4816 C CA . PHE D 4 29 ? -26.296 -83.614 -63.567 1.00 49.02 ? 27 PHE D CA 1 ATOM 4817 C C . PHE D 4 29 ? -26.263 -85.077 -63.183 1.00 48.44 ? 27 PHE D C 1 ATOM 4818 O O . PHE D 4 29 ? -25.422 -85.827 -63.686 1.00 48.51 ? 27 PHE D O 1 ATOM 4819 C CB . PHE D 4 29 ? -24.938 -82.988 -63.230 1.00 49.17 ? 27 PHE D CB 1 ATOM 4820 C CG . PHE D 4 29 ? -24.766 -81.591 -63.749 1.00 49.27 ? 27 PHE D CG 1 ATOM 4821 C CD1 . PHE D 4 29 ? -24.472 -80.547 -62.874 1.00 48.63 ? 27 PHE D CD1 1 ATOM 4822 C CD2 . PHE D 4 29 ? -24.901 -81.313 -65.110 1.00 48.76 ? 27 PHE D CD2 1 ATOM 4823 C CE1 . PHE D 4 29 ? -24.314 -79.250 -63.343 1.00 47.98 ? 27 PHE D CE1 1 ATOM 4824 C CE2 . PHE D 4 29 ? -24.746 -80.022 -65.580 1.00 48.48 ? 27 PHE D CE2 1 ATOM 4825 C CZ . PHE D 4 29 ? -24.451 -78.987 -64.693 1.00 47.82 ? 27 PHE D CZ 1 ATOM 4826 N N . ASN D 4 30 ? -27.163 -85.476 -62.284 1.00 47.78 ? 28 ASN D N 1 ATOM 4827 C CA . ASN D 4 30 ? -27.191 -86.830 -61.744 1.00 47.02 ? 28 ASN D CA 1 ATOM 4828 C C . ASN D 4 30 ? -25.974 -87.034 -60.847 1.00 46.53 ? 28 ASN D C 1 ATOM 4829 O O . ASN D 4 30 ? -25.542 -88.158 -60.612 1.00 46.66 ? 28 ASN D O 1 ATOM 4830 C CB . ASN D 4 30 ? -27.209 -87.849 -62.889 1.00 47.05 ? 28 ASN D CB 1 ATOM 4831 C CG . ASN D 4 30 ? -27.825 -89.156 -62.500 1.00 47.24 ? 28 ASN D CG 1 ATOM 4832 O OD1 . ASN D 4 30 ? -28.750 -89.205 -61.694 1.00 48.26 ? 28 ASN D OD1 1 ATOM 4833 N ND2 . ASN D 4 30 ? -27.328 -90.235 -63.086 1.00 47.58 ? 28 ASN D ND2 1 ATOM 4834 N N . HIS D 4 31 ? -25.419 -85.923 -60.365 1.00 46.01 ? 29 HIS D N 1 ATOM 4835 C CA . HIS D 4 31 ? -24.228 -85.925 -59.516 1.00 45.61 ? 29 HIS D CA 1 ATOM 4836 C C . HIS D 4 31 ? -24.553 -86.306 -58.092 1.00 45.53 ? 29 HIS D C 1 ATOM 4837 O O . HIS D 4 31 ? -25.458 -85.737 -57.468 1.00 45.44 ? 29 HIS D O 1 ATOM 4838 C CB . HIS D 4 31 ? -23.553 -84.552 -59.493 1.00 45.58 ? 29 HIS D CB 1 ATOM 4839 C CG . HIS D 4 31 ? -22.642 -84.302 -60.650 1.00 45.12 ? 29 HIS D CG 1 ATOM 4840 N ND1 . HIS D 4 31 ? -22.164 -83.048 -60.956 1.00 44.18 ? 29 HIS D ND1 1 ATOM 4841 C CD2 . HIS D 4 31 ? -22.130 -85.140 -61.581 1.00 44.96 ? 29 HIS D CD2 1 ATOM 4842 C CE1 . HIS D 4 31 ? -21.388 -83.126 -62.020 1.00 44.91 ? 29 HIS D CE1 1 ATOM 4843 N NE2 . HIS D 4 31 ? -21.351 -84.384 -62.419 1.00 45.00 ? 29 HIS D NE2 1 ATOM 4844 N N . ASP D 4 32 ? -23.787 -87.255 -57.573 1.00 45.39 ? 30 ASP D N 1 ATOM 4845 C CA . ASP D 4 32 ? -24.000 -87.741 -56.224 1.00 45.17 ? 30 ASP D CA 1 ATOM 4846 C C . ASP D 4 32 ? -23.386 -86.822 -55.166 1.00 45.06 ? 30 ASP D C 1 ATOM 4847 O O . ASP D 4 32 ? -23.971 -86.615 -54.109 1.00 45.07 ? 30 ASP D O 1 ATOM 4848 C CB . ASP D 4 32 ? -23.492 -89.173 -56.100 1.00 45.11 ? 30 ASP D CB 1 ATOM 4849 C CG . ASP D 4 32 ? -24.320 -90.150 -56.913 1.00 45.57 ? 30 ASP D CG 1 ATOM 4850 O OD1 . ASP D 4 32 ? -23.748 -90.845 -57.780 1.00 46.80 ? 30 ASP D OD1 1 ATOM 4851 O OD2 . ASP D 4 32 ? -25.549 -90.222 -56.695 1.00 45.48 ? 30 ASP D OD2 1 ATOM 4852 N N . THR D 4 33 ? -22.228 -86.241 -55.456 1.00 45.02 ? 31 THR D N 1 ATOM 4853 C CA . THR D 4 33 ? -21.571 -85.354 -54.494 1.00 45.00 ? 31 THR D CA 1 ATOM 4854 C C . THR D 4 33 ? -21.988 -83.908 -54.685 1.00 45.07 ? 31 THR D C 1 ATOM 4855 O O . THR D 4 33 ? -22.071 -83.430 -55.815 1.00 45.17 ? 31 THR D O 1 ATOM 4856 C CB . THR D 4 33 ? -20.046 -85.407 -54.607 1.00 44.93 ? 31 THR D CB 1 ATOM 4857 O OG1 . THR D 4 33 ? -19.637 -86.714 -55.020 1.00 45.46 ? 31 THR D OG1 1 ATOM 4858 C CG2 . THR D 4 33 ? -19.433 -85.097 -53.281 1.00 44.60 ? 31 THR D CG2 1 ATOM 4859 N N . MET D 4 34 ? -22.243 -83.214 -53.581 1.00 45.08 ? 32 MET D N 1 ATOM 4860 C CA . MET D 4 34 ? -22.578 -81.794 -53.632 1.00 45.15 ? 32 MET D CA 1 ATOM 4861 C C . MET D 4 34 ? -21.899 -81.028 -52.511 1.00 45.57 ? 32 MET D C 1 ATOM 4862 O O . MET D 4 34 ? -21.839 -81.505 -51.380 1.00 45.55 ? 32 MET D O 1 ATOM 4863 C CB . MET D 4 34 ? -24.088 -81.576 -53.599 1.00 44.90 ? 32 MET D CB 1 ATOM 4864 C CG . MET D 4 34 ? -24.768 -81.909 -54.902 1.00 44.21 ? 32 MET D CG 1 ATOM 4865 S SD . MET D 4 34 ? -26.505 -81.484 -54.922 1.00 43.56 ? 32 MET D SD 1 ATOM 4866 C CE . MET D 4 34 ? -26.424 -79.722 -55.241 1.00 44.87 ? 32 MET D CE 1 ATOM 4867 N N . TYR D 4 35 ? -21.400 -79.836 -52.837 1.00 46.01 ? 33 TYR D N 1 ATOM 4868 C CA . TYR D 4 35 ? -20.531 -79.079 -51.938 1.00 46.61 ? 33 TYR D CA 1 ATOM 4869 C C . TYR D 4 35 ? -21.050 -77.657 -51.675 1.00 46.86 ? 33 TYR D C 1 ATOM 4870 O O . TYR D 4 35 ? -21.782 -77.093 -52.499 1.00 46.94 ? 33 TYR D O 1 ATOM 4871 C CB . TYR D 4 35 ? -19.097 -79.017 -52.501 1.00 46.67 ? 33 TYR D CB 1 ATOM 4872 C CG . TYR D 4 35 ? -18.504 -80.336 -52.986 1.00 47.16 ? 33 TYR D CG 1 ATOM 4873 C CD1 . TYR D 4 35 ? -18.867 -80.872 -54.217 1.00 48.03 ? 33 TYR D CD1 1 ATOM 4874 C CD2 . TYR D 4 35 ? -17.560 -81.029 -52.225 1.00 47.60 ? 33 TYR D CD2 1 ATOM 4875 C CE1 . TYR D 4 35 ? -18.328 -82.071 -54.674 1.00 49.12 ? 33 TYR D CE1 1 ATOM 4876 C CE2 . TYR D 4 35 ? -17.007 -82.235 -52.671 1.00 48.31 ? 33 TYR D CE2 1 ATOM 4877 C CZ . TYR D 4 35 ? -17.394 -82.745 -53.905 1.00 49.34 ? 33 TYR D CZ 1 ATOM 4878 O OH . TYR D 4 35 ? -16.872 -83.929 -54.389 1.00 49.28 ? 33 TYR D OH 1 ATOM 4879 N N . TRP D 4 36 ? -20.674 -77.094 -50.520 1.00 47.08 ? 34 TRP D N 1 ATOM 4880 C CA . TRP D 4 36 ? -20.915 -75.681 -50.192 1.00 47.32 ? 34 TRP D CA 1 ATOM 4881 C C . TRP D 4 36 ? -19.616 -75.022 -49.750 1.00 48.00 ? 34 TRP D C 1 ATOM 4882 O O . TRP D 4 36 ? -19.095 -75.334 -48.678 1.00 48.20 ? 34 TRP D O 1 ATOM 4883 C CB . TRP D 4 36 ? -21.949 -75.519 -49.073 1.00 47.07 ? 34 TRP D CB 1 ATOM 4884 C CG . TRP D 4 36 ? -23.364 -75.432 -49.530 1.00 46.17 ? 34 TRP D CG 1 ATOM 4885 C CD1 . TRP D 4 36 ? -24.344 -76.339 -49.304 1.00 45.85 ? 34 TRP D CD1 1 ATOM 4886 C CD2 . TRP D 4 36 ? -23.960 -74.378 -50.285 1.00 45.82 ? 34 TRP D CD2 1 ATOM 4887 N NE1 . TRP D 4 36 ? -25.518 -75.929 -49.876 1.00 45.88 ? 34 TRP D NE1 1 ATOM 4888 C CE2 . TRP D 4 36 ? -25.311 -74.725 -50.487 1.00 45.76 ? 34 TRP D CE2 1 ATOM 4889 C CE3 . TRP D 4 36 ? -23.484 -73.177 -50.817 1.00 46.02 ? 34 TRP D CE3 1 ATOM 4890 C CZ2 . TRP D 4 36 ? -26.194 -73.919 -51.198 1.00 45.92 ? 34 TRP D CZ2 1 ATOM 4891 C CZ3 . TRP D 4 36 ? -24.362 -72.369 -51.522 1.00 46.12 ? 34 TRP D CZ3 1 ATOM 4892 C CH2 . TRP D 4 36 ? -25.705 -72.747 -51.709 1.00 46.20 ? 34 TRP D CH2 1 ATOM 4893 N N . TYR D 4 37 ? -19.091 -74.115 -50.570 1.00 48.74 ? 35 TYR D N 1 ATOM 4894 C CA . TYR D 4 37 ? -17.852 -73.412 -50.241 1.00 49.44 ? 35 TYR D CA 1 ATOM 4895 C C . TYR D 4 37 ? -18.144 -71.990 -49.782 1.00 50.59 ? 35 TYR D C 1 ATOM 4896 O O . TYR D 4 37 ? -19.265 -71.501 -49.927 1.00 50.45 ? 35 TYR D O 1 ATOM 4897 C CB . TYR D 4 37 ? -16.909 -73.375 -51.447 1.00 48.90 ? 35 TYR D CB 1 ATOM 4898 C CG . TYR D 4 37 ? -16.421 -74.718 -51.917 1.00 47.19 ? 35 TYR D CG 1 ATOM 4899 C CD1 . TYR D 4 37 ? -17.137 -75.434 -52.866 1.00 45.86 ? 35 TYR D CD1 1 ATOM 4900 C CD2 . TYR D 4 37 ? -15.240 -75.272 -51.422 1.00 45.73 ? 35 TYR D CD2 1 ATOM 4901 C CE1 . TYR D 4 37 ? -16.702 -76.665 -53.306 1.00 45.35 ? 35 TYR D CE1 1 ATOM 4902 C CE2 . TYR D 4 37 ? -14.793 -76.512 -51.864 1.00 44.71 ? 35 TYR D CE2 1 ATOM 4903 C CZ . TYR D 4 37 ? -15.536 -77.196 -52.806 1.00 44.90 ? 35 TYR D CZ 1 ATOM 4904 O OH . TYR D 4 37 ? -15.138 -78.419 -53.271 1.00 46.13 ? 35 TYR D OH 1 ATOM 4905 N N . ARG D 4 38 ? -17.129 -71.329 -49.232 1.00 52.16 ? 36 ARG D N 1 ATOM 4906 C CA . ARG D 4 38 ? -17.216 -69.896 -48.969 1.00 53.82 ? 36 ARG D CA 1 ATOM 4907 C C . ARG D 4 38 ? -15.992 -69.140 -49.488 1.00 54.67 ? 36 ARG D C 1 ATOM 4908 O O . ARG D 4 38 ? -14.838 -69.474 -49.163 1.00 54.86 ? 36 ARG D O 1 ATOM 4909 C CB . ARG D 4 38 ? -17.441 -69.623 -47.485 1.00 54.05 ? 36 ARG D CB 1 ATOM 4910 C CG . ARG D 4 38 ? -17.670 -68.165 -47.145 1.00 55.01 ? 36 ARG D CG 1 ATOM 4911 C CD . ARG D 4 38 ? -18.192 -68.046 -45.733 1.00 57.82 ? 36 ARG D CD 1 ATOM 4912 N NE . ARG D 4 38 ? -18.301 -66.655 -45.308 1.00 60.09 ? 36 ARG D NE 1 ATOM 4913 C CZ . ARG D 4 38 ? -17.452 -66.055 -44.480 1.00 61.35 ? 36 ARG D CZ 1 ATOM 4914 N NH1 . ARG D 4 38 ? -16.427 -66.740 -43.979 1.00 62.04 ? 36 ARG D NH1 1 ATOM 4915 N NH2 . ARG D 4 38 ? -17.630 -64.775 -44.149 1.00 61.06 ? 36 ARG D NH2 1 ATOM 4916 N N . GLN D 4 39 ? -16.269 -68.122 -50.301 1.00 55.59 ? 37 GLN D N 1 ATOM 4917 C CA . GLN D 4 39 ? -15.242 -67.290 -50.891 1.00 56.55 ? 37 GLN D CA 1 ATOM 4918 C C . GLN D 4 39 ? -15.054 -66.067 -50.024 1.00 57.33 ? 37 GLN D C 1 ATOM 4919 O O . GLN D 4 39 ? -15.987 -65.277 -49.821 1.00 57.24 ? 37 GLN D O 1 ATOM 4920 C CB . GLN D 4 39 ? -15.637 -66.879 -52.302 1.00 56.47 ? 37 GLN D CB 1 ATOM 4921 C CG . GLN D 4 39 ? -14.524 -66.259 -53.099 1.00 56.68 ? 37 GLN D CG 1 ATOM 4922 C CD . GLN D 4 39 ? -14.902 -66.076 -54.546 1.00 57.51 ? 37 GLN D CD 1 ATOM 4923 O OE1 . GLN D 4 39 ? -15.853 -65.363 -54.866 1.00 58.27 ? 37 GLN D OE1 1 ATOM 4924 N NE2 . GLN D 4 39 ? -14.158 -66.719 -55.437 1.00 57.89 ? 37 GLN D NE2 1 ATOM 4925 N N . ASP D 4 40 ? -13.842 -65.939 -49.500 1.00 58.45 ? 38 ASP D N 1 ATOM 4926 C CA . ASP D 4 40 ? -13.443 -64.774 -48.721 1.00 59.69 ? 38 ASP D CA 1 ATOM 4927 C C . ASP D 4 40 ? -12.397 -63.961 -49.468 1.00 60.24 ? 38 ASP D C 1 ATOM 4928 O O . ASP D 4 40 ? -11.447 -64.517 -50.038 1.00 60.47 ? 38 ASP D O 1 ATOM 4929 C CB . ASP D 4 40 ? -12.893 -65.199 -47.363 1.00 59.90 ? 38 ASP D CB 1 ATOM 4930 C CG . ASP D 4 40 ? -13.908 -65.946 -46.542 1.00 60.70 ? 38 ASP D CG 1 ATOM 4931 O OD1 . ASP D 4 40 ? -14.995 -65.373 -46.278 1.00 61.11 ? 38 ASP D OD1 1 ATOM 4932 O OD2 . ASP D 4 40 ? -13.611 -67.104 -46.172 1.00 61.87 ? 38 ASP D OD2 1 ATOM 4933 N N . SER D 4 41 ? -12.524 -62.642 -49.443 1.00 60.80 ? 39 SER D N 1 ATOM 4934 C CA . SER D 4 41 ? -11.628 -61.852 -50.259 1.00 61.35 ? 39 SER D CA 1 ATOM 4935 C C . SER D 4 41 ? -10.218 -62.225 -49.841 1.00 61.62 ? 39 SER D C 1 ATOM 4936 O O . SER D 4 41 ? -9.895 -62.270 -48.654 1.00 61.70 ? 39 SER D O 1 ATOM 4937 C CB . SER D 4 41 ? -11.871 -60.359 -50.040 1.00 61.40 ? 39 SER D CB 1 ATOM 4938 O OG . SER D 4 41 ? -11.984 -59.674 -51.276 1.00 61.80 ? 39 SER D OG 1 ATOM 4939 N N . GLY D 4 42 ? -9.382 -62.496 -50.835 1.00 61.86 ? 40 GLY D N 1 ATOM 4940 C CA . GLY D 4 42 ? -8.020 -62.926 -50.600 1.00 62.04 ? 40 GLY D CA 1 ATOM 4941 C C . GLY D 4 42 ? -7.840 -64.188 -49.771 1.00 62.26 ? 40 GLY D C 1 ATOM 4942 O O . GLY D 4 42 ? -6.893 -64.262 -48.988 1.00 62.51 ? 40 GLY D O 1 ATOM 4943 N N . LYS D 4 43 ? -8.708 -65.188 -49.931 1.00 62.25 ? 41 LYS D N 1 ATOM 4944 C CA . LYS D 4 43 ? -8.447 -66.461 -49.258 1.00 62.28 ? 41 LYS D CA 1 ATOM 4945 C C . LYS D 4 43 ? -8.675 -67.691 -50.144 1.00 62.07 ? 41 LYS D C 1 ATOM 4946 O O . LYS D 4 43 ? -7.981 -68.706 -49.998 1.00 62.04 ? 41 LYS D O 1 ATOM 4947 C CB . LYS D 4 43 ? -9.244 -66.562 -47.953 1.00 62.41 ? 41 LYS D CB 1 ATOM 4948 C CG . LYS D 4 43 ? -8.504 -66.053 -46.708 1.00 63.02 ? 41 LYS D CG 1 ATOM 4949 C CD . LYS D 4 43 ? -7.541 -67.114 -46.130 1.00 64.04 ? 41 LYS D CD 1 ATOM 4950 C CE . LYS D 4 43 ? -7.091 -66.769 -44.698 1.00 63.81 ? 41 LYS D CE 1 ATOM 4951 N NZ . LYS D 4 43 ? -6.089 -67.732 -44.138 1.00 63.03 ? 41 LYS D NZ 1 ATOM 4952 N N . GLY D 4 44 ? -9.630 -67.597 -51.064 1.00 61.71 ? 42 GLY D N 1 ATOM 4953 C CA . GLY D 4 44 ? -9.995 -68.744 -51.889 1.00 61.40 ? 42 GLY D CA 1 ATOM 4954 C C . GLY D 4 44 ? -10.980 -69.636 -51.158 1.00 61.02 ? 42 GLY D C 1 ATOM 4955 O O . GLY D 4 44 ? -11.193 -69.483 -49.955 1.00 61.13 ? 42 GLY D O 1 ATOM 4956 N N . LEU D 4 45 ? -11.577 -70.575 -51.884 1.00 60.54 ? 43 LEU D N 1 ATOM 4957 C CA . LEU D 4 45 ? -12.691 -71.363 -51.356 1.00 60.00 ? 43 LEU D CA 1 ATOM 4958 C C . LEU D 4 45 ? -12.321 -72.255 -50.171 1.00 59.67 ? 43 LEU D C 1 ATOM 4959 O O . LEU D 4 45 ? -11.281 -72.918 -50.174 1.00 59.52 ? 43 LEU D O 1 ATOM 4960 C CB . LEU D 4 45 ? -13.355 -72.178 -52.472 1.00 60.01 ? 43 LEU D CB 1 ATOM 4961 C CG . LEU D 4 45 ? -14.431 -71.463 -53.297 1.00 59.86 ? 43 LEU D CG 1 ATOM 4962 C CD1 . LEU D 4 45 ? -13.914 -70.186 -53.944 1.00 60.24 ? 43 LEU D CD1 1 ATOM 4963 C CD2 . LEU D 4 45 ? -14.998 -72.395 -54.349 1.00 59.53 ? 43 LEU D CD2 1 ATOM 4964 N N . ARG D 4 46 ? -13.185 -72.235 -49.156 1.00 59.26 ? 44 ARG D N 1 ATOM 4965 C CA . ARG D 4 46 ? -13.050 -73.072 -47.961 1.00 58.76 ? 44 ARG D CA 1 ATOM 4966 C C . ARG D 4 46 ? -14.320 -73.899 -47.822 1.00 57.94 ? 44 ARG D C 1 ATOM 4967 O O . ARG D 4 46 ? -15.424 -73.344 -47.820 1.00 58.02 ? 44 ARG D O 1 ATOM 4968 C CB . ARG D 4 46 ? -12.832 -72.207 -46.717 1.00 58.93 ? 44 ARG D CB 1 ATOM 4969 C CG . ARG D 4 46 ? -11.542 -71.402 -46.762 1.00 60.70 ? 44 ARG D CG 1 ATOM 4970 C CD . ARG D 4 46 ? -11.604 -70.125 -45.915 1.00 63.89 ? 44 ARG D CD 1 ATOM 4971 N NE . ARG D 4 46 ? -11.476 -70.404 -44.482 1.00 66.24 ? 44 ARG D NE 1 ATOM 4972 C CZ . ARG D 4 46 ? -10.324 -70.611 -43.835 1.00 67.36 ? 44 ARG D CZ 1 ATOM 4973 N NH1 . ARG D 4 46 ? -9.155 -70.569 -44.477 1.00 67.45 ? 44 ARG D NH1 1 ATOM 4974 N NH2 . ARG D 4 46 ? -10.341 -70.862 -42.530 1.00 67.68 ? 44 ARG D NH2 1 ATOM 4975 N N . LEU D 4 47 ? -14.168 -75.219 -47.732 1.00 56.80 ? 45 LEU D N 1 ATOM 4976 C CA . LEU D 4 47 ? -15.316 -76.119 -47.685 1.00 55.60 ? 45 LEU D CA 1 ATOM 4977 C C . LEU D 4 47 ? -16.071 -75.993 -46.365 1.00 55.02 ? 45 LEU D C 1 ATOM 4978 O O . LEU D 4 47 ? -15.465 -75.906 -45.299 1.00 55.19 ? 45 LEU D O 1 ATOM 4979 C CB . LEU D 4 47 ? -14.875 -77.561 -47.917 1.00 55.40 ? 45 LEU D CB 1 ATOM 4980 C CG . LEU D 4 47 ? -15.966 -78.614 -48.132 1.00 55.12 ? 45 LEU D CG 1 ATOM 4981 C CD1 . LEU D 4 47 ? -16.940 -78.226 -49.247 1.00 54.62 ? 45 LEU D CD1 1 ATOM 4982 C CD2 . LEU D 4 47 ? -15.334 -79.971 -48.412 1.00 55.01 ? 45 LEU D CD2 1 ATOM 4983 N N . ILE D 4 48 ? -17.397 -75.964 -46.446 1.00 54.04 ? 46 ILE D N 1 ATOM 4984 C CA . ILE D 4 48 ? -18.239 -75.874 -45.259 1.00 53.03 ? 46 ILE D CA 1 ATOM 4985 C C . ILE D 4 48 ? -18.906 -77.222 -44.997 1.00 52.42 ? 46 ILE D C 1 ATOM 4986 O O . ILE D 4 48 ? -18.752 -77.794 -43.917 1.00 52.45 ? 46 ILE D O 1 ATOM 4987 C CB . ILE D 4 48 ? -19.328 -74.794 -45.406 1.00 53.01 ? 46 ILE D CB 1 ATOM 4988 C CG1 . ILE D 4 48 ? -18.727 -73.472 -45.877 1.00 53.09 ? 46 ILE D CG1 1 ATOM 4989 C CG2 . ILE D 4 48 ? -20.062 -74.599 -44.092 1.00 53.23 ? 46 ILE D CG2 1 ATOM 4990 C CD1 . ILE D 4 48 ? -19.756 -72.504 -46.413 1.00 53.09 ? 46 ILE D CD1 1 ATOM 4991 N N . TYR D 4 49 ? -19.648 -77.715 -45.987 1.00 51.43 ? 47 TYR D N 1 ATOM 4992 C CA . TYR D 4 49 ? -20.351 -78.980 -45.881 1.00 50.71 ? 47 TYR D CA 1 ATOM 4993 C C . TYR D 4 49 ? -20.407 -79.684 -47.216 1.00 50.03 ? 47 TYR D C 1 ATOM 4994 O O . TYR D 4 49 ? -20.636 -79.055 -48.248 1.00 50.09 ? 47 TYR D O 1 ATOM 4995 C CB . TYR D 4 49 ? -21.778 -78.759 -45.384 1.00 50.97 ? 47 TYR D CB 1 ATOM 4996 C CG . TYR D 4 49 ? -21.910 -78.747 -43.881 1.00 51.99 ? 47 TYR D CG 1 ATOM 4997 C CD1 . TYR D 4 49 ? -22.067 -79.933 -43.162 1.00 52.58 ? 47 TYR D CD1 1 ATOM 4998 C CD2 . TYR D 4 49 ? -21.877 -77.550 -43.177 1.00 53.31 ? 47 TYR D CD2 1 ATOM 4999 C CE1 . TYR D 4 49 ? -22.184 -79.921 -41.777 1.00 53.75 ? 47 TYR D CE1 1 ATOM 5000 C CE2 . TYR D 4 49 ? -21.992 -77.522 -41.796 1.00 54.36 ? 47 TYR D CE2 1 ATOM 5001 C CZ . TYR D 4 49 ? -22.147 -78.706 -41.099 1.00 54.90 ? 47 TYR D CZ 1 ATOM 5002 O OH . TYR D 4 49 ? -22.262 -78.655 -39.722 1.00 56.27 ? 47 TYR D OH 1 ATOM 5003 N N . TYR D 4 50 ? -20.202 -80.995 -47.199 1.00 49.11 ? 48 TYR D N 1 ATOM 5004 C CA . TYR D 4 50 ? -20.431 -81.791 -48.399 1.00 48.14 ? 48 TYR D CA 1 ATOM 5005 C C . TYR D 4 50 ? -21.434 -82.917 -48.157 1.00 47.99 ? 48 TYR D C 1 ATOM 5006 O O . TYR D 4 50 ? -22.109 -82.927 -47.133 1.00 47.97 ? 48 TYR D O 1 ATOM 5007 C CB . TYR D 4 50 ? -19.114 -82.260 -49.033 1.00 47.86 ? 48 TYR D CB 1 ATOM 5008 C CG . TYR D 4 50 ? -18.251 -83.192 -48.219 1.00 46.06 ? 48 TYR D CG 1 ATOM 5009 C CD1 . TYR D 4 50 ? -18.185 -84.545 -48.534 1.00 44.55 ? 48 TYR D CD1 1 ATOM 5010 C CD2 . TYR D 4 50 ? -17.464 -82.718 -47.168 1.00 44.52 ? 48 TYR D CD2 1 ATOM 5011 C CE1 . TYR D 4 50 ? -17.378 -85.415 -47.809 1.00 43.77 ? 48 TYR D CE1 1 ATOM 5012 C CE2 . TYR D 4 50 ? -16.650 -83.583 -46.434 1.00 43.83 ? 48 TYR D CE2 1 ATOM 5013 C CZ . TYR D 4 50 ? -16.614 -84.934 -46.765 1.00 43.35 ? 48 TYR D CZ 1 ATOM 5014 O OH . TYR D 4 50 ? -15.820 -85.814 -46.067 1.00 42.01 ? 48 TYR D OH 1 ATOM 5015 N N . SER D 4 51 ? -21.550 -83.844 -49.102 1.00 47.60 ? 49 SER D N 1 ATOM 5016 C CA . SER D 4 51 ? -22.586 -84.860 -49.048 1.00 47.45 ? 49 SER D CA 1 ATOM 5017 C C . SER D 4 51 ? -22.426 -85.823 -50.192 1.00 47.55 ? 49 SER D C 1 ATOM 5018 O O . SER D 4 51 ? -21.973 -85.443 -51.263 1.00 47.77 ? 49 SER D O 1 ATOM 5019 C CB . SER D 4 51 ? -23.960 -84.218 -49.167 1.00 47.35 ? 49 SER D CB 1 ATOM 5020 O OG . SER D 4 51 ? -24.927 -85.203 -49.466 1.00 47.44 ? 49 SER D OG 1 ATOM 5021 N N . TYR D 4 52 ? -22.836 -87.064 -49.972 1.00 47.58 ? 50 TYR D N 1 ATOM 5022 C CA . TYR D 4 52 ? -22.750 -88.094 -50.989 1.00 47.64 ? 50 TYR D CA 1 ATOM 5023 C C . TYR D 4 52 ? -24.138 -88.523 -51.463 1.00 47.94 ? 50 TYR D C 1 ATOM 5024 O O . TYR D 4 52 ? -24.284 -89.529 -52.154 1.00 48.03 ? 50 TYR D O 1 ATOM 5025 C CB . TYR D 4 52 ? -21.963 -89.288 -50.449 1.00 47.52 ? 50 TYR D CB 1 ATOM 5026 C CG . TYR D 4 52 ? -20.502 -88.991 -50.168 1.00 47.71 ? 50 TYR D CG 1 ATOM 5027 C CD1 . TYR D 4 52 ? -20.108 -88.400 -48.966 1.00 47.90 ? 50 TYR D CD1 1 ATOM 5028 C CD2 . TYR D 4 52 ? -19.509 -89.314 -51.103 1.00 47.47 ? 50 TYR D CD2 1 ATOM 5029 C CE1 . TYR D 4 52 ? -18.759 -88.134 -48.703 1.00 48.38 ? 50 TYR D CE1 1 ATOM 5030 C CE2 . TYR D 4 52 ? -18.158 -89.051 -50.849 1.00 47.53 ? 50 TYR D CE2 1 ATOM 5031 C CZ . TYR D 4 52 ? -17.788 -88.458 -49.650 1.00 47.90 ? 50 TYR D CZ 1 ATOM 5032 O OH . TYR D 4 52 ? -16.458 -88.190 -49.394 1.00 47.42 ? 50 TYR D OH 1 ATOM 5033 N N . GLY D 4 53 ? -25.150 -87.742 -51.106 1.00 48.37 ? 51 GLY D N 1 ATOM 5034 C CA . GLY D 4 53 ? -26.543 -88.096 -51.365 1.00 49.11 ? 51 GLY D CA 1 ATOM 5035 C C . GLY D 4 53 ? -27.387 -87.713 -50.165 1.00 49.80 ? 51 GLY D C 1 ATOM 5036 O O . GLY D 4 53 ? -26.861 -87.272 -49.145 1.00 49.70 ? 51 GLY D O 1 ATOM 5037 N N . ALA D 4 54 ? -28.702 -87.858 -50.286 1.00 50.57 ? 52 ALA D N 1 ATOM 5038 C CA . ALA D 4 54 ? -29.613 -87.565 -49.180 1.00 51.25 ? 52 ALA D CA 1 ATOM 5039 C C . ALA D 4 54 ? -29.540 -88.706 -48.175 1.00 51.82 ? 52 ALA D C 1 ATOM 5040 O O . ALA D 4 54 ? -29.482 -89.851 -48.589 1.00 52.42 ? 52 ALA D O 1 ATOM 5041 C CB . ALA D 4 54 ? -31.021 -87.442 -49.704 1.00 51.19 ? 52 ALA D CB 1 ATOM 5042 N N . GLY D 4 55 ? -29.505 -88.444 -46.870 1.00 52.22 ? 53 GLY D N 1 ATOM 5043 C CA . GLY D 4 55 ? -29.357 -87.129 -46.274 1.00 52.76 ? 53 GLY D CA 1 ATOM 5044 C C . GLY D 4 55 ? -28.014 -87.196 -45.574 1.00 53.14 ? 53 GLY D C 1 ATOM 5045 O O . GLY D 4 55 ? -27.900 -86.983 -44.359 1.00 53.01 ? 53 GLY D O 1 ATOM 5046 N N . SER D 4 56 ? -27.007 -87.558 -46.368 1.00 53.42 ? 54 SER D N 1 ATOM 5047 C CA . SER D 4 56 ? -25.615 -87.486 -45.979 1.00 53.59 ? 54 SER D CA 1 ATOM 5048 C C . SER D 4 56 ? -25.194 -86.019 -45.951 1.00 53.73 ? 54 SER D C 1 ATOM 5049 O O . SER D 4 56 ? -25.386 -85.292 -46.923 1.00 53.73 ? 54 SER D O 1 ATOM 5050 C CB . SER D 4 56 ? -24.759 -88.291 -46.963 1.00 53.48 ? 54 SER D CB 1 ATOM 5051 O OG . SER D 4 56 ? -23.416 -87.836 -46.994 1.00 53.81 ? 54 SER D OG 1 ATOM 5052 N N . THR D 4 57 ? -24.669 -85.586 -44.809 1.00 53.97 ? 55 THR D N 1 ATOM 5053 C CA . THR D 4 57 ? -24.087 -84.261 -44.666 1.00 54.30 ? 55 THR D CA 1 ATOM 5054 C C . THR D 4 57 ? -22.790 -84.423 -43.887 1.00 54.71 ? 55 THR D C 1 ATOM 5055 O O . THR D 4 57 ? -22.782 -85.000 -42.802 1.00 55.14 ? 55 THR D O 1 ATOM 5056 C CB . THR D 4 57 ? -25.023 -83.271 -43.927 1.00 54.21 ? 55 THR D CB 1 ATOM 5057 O OG1 . THR D 4 57 ? -24.745 -83.292 -42.524 1.00 54.33 ? 55 THR D OG1 1 ATOM 5058 C CG2 . THR D 4 57 ? -26.509 -83.590 -44.168 1.00 54.41 ? 55 THR D CG2 1 ATOM 5059 N N . GLU D 4 58 ? -21.686 -83.943 -44.443 1.00 55.10 ? 56 GLU D N 1 ATOM 5060 C CA . GLU D 4 58 ? -20.397 -84.126 -43.798 1.00 55.54 ? 56 GLU D CA 1 ATOM 5061 C C . GLU D 4 58 ? -19.696 -82.812 -43.638 1.00 55.78 ? 56 GLU D C 1 ATOM 5062 O O . GLU D 4 58 ? -19.679 -81.989 -44.553 1.00 55.75 ? 56 GLU D O 1 ATOM 5063 C CB . GLU D 4 58 ? -19.509 -85.085 -44.585 1.00 55.71 ? 56 GLU D CB 1 ATOM 5064 C CG . GLU D 4 58 ? -20.131 -86.452 -44.870 1.00 56.44 ? 56 GLU D CG 1 ATOM 5065 C CD . GLU D 4 58 ? -20.319 -87.304 -43.627 1.00 57.11 ? 56 GLU D CD 1 ATOM 5066 O OE1 . GLU D 4 58 ? -21.296 -88.086 -43.611 1.00 57.01 ? 56 GLU D OE1 1 ATOM 5067 O OE2 . GLU D 4 58 ? -19.497 -87.196 -42.683 1.00 57.26 ? 56 GLU D OE2 1 ATOM 5068 N N . LYS D 4 59 ? -19.111 -82.637 -42.461 1.00 56.23 ? 57 LYS D N 1 ATOM 5069 C CA . LYS D 4 59 ? -18.459 -81.399 -42.079 1.00 56.64 ? 57 LYS D CA 1 ATOM 5070 C C . LYS D 4 59 ? -17.196 -81.176 -42.883 1.00 56.68 ? 57 LYS D C 1 ATOM 5071 O O . LYS D 4 59 ? -16.425 -82.101 -43.113 1.00 56.51 ? 57 LYS D O 1 ATOM 5072 C CB . LYS D 4 59 ? -18.124 -81.415 -40.586 1.00 56.85 ? 57 LYS D CB 1 ATOM 5073 C CG . LYS D 4 59 ? -19.333 -81.299 -39.667 1.00 57.71 ? 57 LYS D CG 1 ATOM 5074 C CD . LYS D 4 59 ? -18.919 -81.399 -38.201 1.00 59.24 ? 57 LYS D CD 1 ATOM 5075 C CE . LYS D 4 59 ? -19.981 -80.813 -37.266 1.00 60.03 ? 57 LYS D CE 1 ATOM 5076 N NZ . LYS D 4 59 ? -20.107 -79.320 -37.386 1.00 60.59 ? 57 LYS D NZ 1 ATOM 5077 N N . GLY D 4 60 ? -17.023 -79.940 -43.334 1.00 57.06 ? 58 GLY D N 1 ATOM 5078 C CA . GLY D 4 60 ? -15.782 -79.483 -43.941 1.00 57.66 ? 58 GLY D CA 1 ATOM 5079 C C . GLY D 4 60 ? -15.075 -78.600 -42.936 1.00 58.15 ? 58 GLY D C 1 ATOM 5080 O O . GLY D 4 60 ? -15.493 -78.516 -41.784 1.00 58.45 ? 58 GLY D O 1 ATOM 5081 N N . ASP D 4 61 ? -14.019 -77.920 -43.369 1.00 58.53 ? 59 ASP D N 1 ATOM 5082 C CA . ASP D 4 61 ? -13.172 -77.134 -42.462 1.00 58.85 ? 59 ASP D CA 1 ATOM 5083 C C . ASP D 4 61 ? -13.831 -75.890 -41.850 1.00 58.74 ? 59 ASP D C 1 ATOM 5084 O O . ASP D 4 61 ? -13.307 -75.310 -40.900 1.00 58.65 ? 59 ASP D O 1 ATOM 5085 C CB . ASP D 4 61 ? -11.873 -76.741 -43.171 1.00 59.15 ? 59 ASP D CB 1 ATOM 5086 C CG . ASP D 4 61 ? -11.088 -77.944 -43.657 1.00 59.60 ? 59 ASP D CG 1 ATOM 5087 O OD1 . ASP D 4 61 ? -9.956 -78.139 -43.164 1.00 60.51 ? 59 ASP D OD1 1 ATOM 5088 O OD2 . ASP D 4 61 ? -11.606 -78.692 -44.518 1.00 59.45 ? 59 ASP D OD2 1 ATOM 5089 N N . LEU D 4 62 ? -14.981 -75.497 -42.385 1.00 58.81 ? 60 LEU D N 1 ATOM 5090 C CA . LEU D 4 62 ? -15.647 -74.263 -41.968 1.00 58.83 ? 60 LEU D CA 1 ATOM 5091 C C . LEU D 4 62 ? -17.072 -74.507 -41.451 1.00 58.69 ? 60 LEU D C 1 ATOM 5092 O O . LEU D 4 62 ? -17.880 -73.577 -41.375 1.00 58.48 ? 60 LEU D O 1 ATOM 5093 C CB . LEU D 4 62 ? -15.674 -73.281 -43.145 1.00 58.92 ? 60 LEU D CB 1 ATOM 5094 C CG . LEU D 4 62 ? -15.474 -71.795 -42.838 1.00 59.15 ? 60 LEU D CG 1 ATOM 5095 C CD1 . LEU D 4 62 ? -13.997 -71.478 -42.635 1.00 59.18 ? 60 LEU D CD1 1 ATOM 5096 C CD2 . LEU D 4 62 ? -16.048 -70.945 -43.958 1.00 59.75 ? 60 LEU D CD2 1 ATOM 5097 N N . SER D 4 63 ? -17.361 -75.757 -41.085 1.00 58.62 ? 61 SER D N 1 ATOM 5098 C CA . SER D 4 63 ? -18.710 -76.190 -40.699 1.00 58.66 ? 61 SER D CA 1 ATOM 5099 C C . SER D 4 63 ? -19.273 -75.487 -39.461 1.00 58.69 ? 61 SER D C 1 ATOM 5100 O O . SER D 4 63 ? -20.495 -75.388 -39.294 1.00 58.62 ? 61 SER D O 1 ATOM 5101 C CB . SER D 4 63 ? -18.723 -77.697 -40.467 1.00 58.63 ? 61 SER D CB 1 ATOM 5102 O OG . SER D 4 63 ? -17.849 -78.042 -39.409 1.00 58.75 ? 61 SER D OG 1 ATOM 5103 N N . GLU D 4 64 ? -18.368 -75.006 -38.620 1.00 58.73 ? 62 GLU D N 1 ATOM 5104 C CA . GLU D 4 64 ? -18.802 -74.334 -37.427 1.00 58.65 ? 62 GLU D CA 1 ATOM 5105 C C . GLU D 4 64 ? -19.583 -73.132 -37.901 1.00 58.55 ? 62 GLU D C 1 ATOM 5106 O O . GLU D 4 64 ? -19.139 -72.366 -38.757 1.00 58.53 ? 62 GLU D O 1 ATOM 5107 C CB . GLU D 4 64 ? -17.603 -73.897 -36.586 1.00 58.67 ? 62 GLU D CB 1 ATOM 5108 C CG . GLU D 4 64 ? -17.976 -73.238 -35.268 1.00 58.30 ? 62 GLU D CG 1 ATOM 5109 C CD . GLU D 4 64 ? -16.763 -72.862 -34.441 0.00 64.21 ? 62 GLU D CD 1 ATOM 5110 O OE1 . GLU D 4 64 ? -15.628 -73.083 -34.913 1.00 75.08 ? 62 GLU D OE1 1 ATOM 5111 O OE2 . GLU D 4 64 ? -16.944 -72.346 -33.317 0.71 50.07 ? 62 GLU D OE2 1 ATOM 5112 N N . GLY D 4 65 ? -20.757 -72.981 -37.317 1.00 58.42 ? 63 GLY D N 1 ATOM 5113 C CA . GLY D 4 65 ? -21.624 -71.824 -37.527 1.00 58.08 ? 63 GLY D CA 1 ATOM 5114 C C . GLY D 4 65 ? -22.684 -72.057 -38.585 1.00 57.85 ? 63 GLY D C 1 ATOM 5115 O O . GLY D 4 65 ? -23.484 -71.163 -38.874 1.00 57.91 ? 63 GLY D O 1 ATOM 5116 N N . TYR D 4 66 ? -22.685 -73.257 -39.163 1.00 57.48 ? 64 TYR D N 1 ATOM 5117 C CA . TYR D 4 66 ? -23.619 -73.612 -40.225 1.00 57.07 ? 64 TYR D CA 1 ATOM 5118 C C . TYR D 4 66 ? -24.073 -75.047 -40.068 1.00 56.86 ? 64 TYR D C 1 ATOM 5119 O O . TYR D 4 66 ? -23.368 -75.876 -39.484 1.00 56.67 ? 64 TYR D O 1 ATOM 5120 C CB . TYR D 4 66 ? -22.957 -73.487 -41.603 1.00 57.14 ? 64 TYR D CB 1 ATOM 5121 C CG . TYR D 4 66 ? -22.216 -72.192 -41.873 1.00 57.13 ? 64 TYR D CG 1 ATOM 5122 C CD1 . TYR D 4 66 ? -22.855 -71.127 -42.498 1.00 57.11 ? 64 TYR D CD1 1 ATOM 5123 C CD2 . TYR D 4 66 ? -20.871 -72.042 -41.524 1.00 56.86 ? 64 TYR D CD2 1 ATOM 5124 C CE1 . TYR D 4 66 ? -22.183 -69.934 -42.758 1.00 57.19 ? 64 TYR D CE1 1 ATOM 5125 C CE2 . TYR D 4 66 ? -20.191 -70.856 -41.776 1.00 57.17 ? 64 TYR D CE2 1 ATOM 5126 C CZ . TYR D 4 66 ? -20.855 -69.802 -42.397 1.00 57.42 ? 64 TYR D CZ 1 ATOM 5127 O OH . TYR D 4 66 ? -20.200 -68.613 -42.665 1.00 57.78 ? 64 TYR D OH 1 ATOM 5128 N N . ASP D 4 67 ? -25.254 -75.335 -40.598 1.00 56.72 ? 65 ASP D N 1 ATOM 5129 C CA . ASP D 4 67 ? -25.635 -76.715 -40.874 1.00 56.81 ? 65 ASP D CA 1 ATOM 5130 C C . ASP D 4 67 ? -26.208 -76.837 -42.288 1.00 56.26 ? 65 ASP D C 1 ATOM 5131 O O . ASP D 4 67 ? -26.629 -75.845 -42.894 1.00 56.32 ? 65 ASP D O 1 ATOM 5132 C CB . ASP D 4 67 ? -26.603 -77.272 -39.819 1.00 57.21 ? 65 ASP D CB 1 ATOM 5133 C CG . ASP D 4 67 ? -26.648 -78.820 -39.802 1.00 58.57 ? 65 ASP D CG 1 ATOM 5134 O OD1 . ASP D 4 67 ? -27.590 -79.366 -39.182 1.00 60.61 ? 65 ASP D OD1 1 ATOM 5135 O OD2 . ASP D 4 67 ? -25.762 -79.495 -40.394 1.00 58.58 ? 65 ASP D OD2 1 ATOM 5136 N N . ALA D 4 68 ? -26.199 -78.059 -42.806 1.00 55.48 ? 66 ALA D N 1 ATOM 5137 C CA . ALA D 4 68 ? -26.660 -78.335 -44.151 1.00 54.71 ? 66 ALA D CA 1 ATOM 5138 C C . ALA D 4 68 ? -27.554 -79.559 -44.136 1.00 54.16 ? 66 ALA D C 1 ATOM 5139 O O . ALA D 4 68 ? -27.561 -80.318 -43.163 1.00 54.17 ? 66 ALA D O 1 ATOM 5140 C CB . ALA D 4 68 ? -25.477 -78.557 -45.066 1.00 54.80 ? 66 ALA D CB 1 ATOM 5141 N N . SER D 4 69 ? -28.305 -79.743 -45.218 1.00 53.35 ? 67 SER D N 1 ATOM 5142 C CA . SER D 4 69 ? -29.242 -80.846 -45.332 1.00 52.72 ? 67 SER D CA 1 ATOM 5143 C C . SER D 4 69 ? -29.473 -81.188 -46.792 1.00 52.33 ? 67 SER D C 1 ATOM 5144 O O . SER D 4 69 ? -29.678 -80.299 -47.618 1.00 52.46 ? 67 SER D O 1 ATOM 5145 C CB . SER D 4 69 ? -30.569 -80.477 -44.674 1.00 52.65 ? 67 SER D CB 1 ATOM 5146 O OG . SER D 4 69 ? -31.059 -79.262 -45.209 1.00 52.60 ? 67 SER D OG 1 ATOM 5147 N N . ARG D 4 70 ? -29.446 -82.481 -47.096 1.00 51.75 ? 68 ARG D N 1 ATOM 5148 C CA . ARG D 4 70 ? -29.635 -82.970 -48.450 1.00 51.15 ? 68 ARG D CA 1 ATOM 5149 C C . ARG D 4 70 ? -30.928 -83.775 -48.494 1.00 51.05 ? 68 ARG D C 1 ATOM 5150 O O . ARG D 4 70 ? -30.957 -84.949 -48.120 1.00 51.08 ? 68 ARG D O 1 ATOM 5151 C CB . ARG D 4 70 ? -28.458 -83.866 -48.851 1.00 51.05 ? 68 ARG D CB 1 ATOM 5152 C CG . ARG D 4 70 ? -28.462 -84.313 -50.298 1.00 50.12 ? 68 ARG D CG 1 ATOM 5153 C CD . ARG D 4 70 ? -27.585 -83.448 -51.167 1.00 48.17 ? 68 ARG D CD 1 ATOM 5154 N NE . ARG D 4 70 ? -27.501 -83.988 -52.523 1.00 47.47 ? 68 ARG D NE 1 ATOM 5155 C CZ . ARG D 4 70 ? -26.440 -84.606 -53.036 1.00 47.04 ? 68 ARG D CZ 1 ATOM 5156 N NH1 . ARG D 4 70 ? -25.336 -84.775 -52.320 1.00 47.34 ? 68 ARG D NH1 1 ATOM 5157 N NH2 . ARG D 4 70 ? -26.480 -85.050 -54.282 1.00 47.51 ? 68 ARG D NH2 1 ATOM 5158 N N . GLU D 4 71 ? -32.012 -83.107 -48.877 1.00 50.83 ? 69 GLU D N 1 ATOM 5159 C CA . GLU D 4 71 ? -33.320 -83.744 -48.998 1.00 50.70 ? 69 GLU D CA 1 ATOM 5160 C C . GLU D 4 71 ? -33.341 -84.810 -50.089 1.00 50.81 ? 69 GLU D C 1 ATOM 5161 O O . GLU D 4 71 ? -33.931 -85.877 -49.922 1.00 50.69 ? 69 GLU D O 1 ATOM 5162 C CB . GLU D 4 71 ? -34.402 -82.697 -49.268 1.00 50.52 ? 69 GLU D CB 1 ATOM 5163 C CG . GLU D 4 71 ? -34.488 -81.606 -48.213 0.00 47.02 ? 69 GLU D CG 1 ATOM 5164 C CD . GLU D 4 71 ? -35.835 -80.909 -48.204 0.00 49.05 ? 69 GLU D CD 1 ATOM 5165 O OE1 . GLU D 4 71 ? -36.310 -80.517 -49.290 1.00 39.41 ? 69 GLU D OE1 1 ATOM 5166 O OE2 . GLU D 4 71 ? -36.418 -80.753 -47.111 1.00 59.25 ? 69 GLU D OE2 1 ATOM 5167 N N . LYS D 4 72 ? -32.695 -84.504 -51.209 1.00 51.11 ? 70 LYS D N 1 ATOM 5168 C CA . LYS D 4 72 ? -32.686 -85.390 -52.372 1.00 51.41 ? 70 LYS D CA 1 ATOM 5169 C C . LYS D 4 72 ? -31.422 -85.261 -53.208 1.00 51.40 ? 70 LYS D C 1 ATOM 5170 O O . LYS D 4 72 ? -30.619 -84.359 -52.988 1.00 51.22 ? 70 LYS D O 1 ATOM 5171 C CB . LYS D 4 72 ? -33.958 -85.275 -53.239 1.00 51.52 ? 70 LYS D CB 1 ATOM 5172 C CG . LYS D 4 72 ? -34.420 -83.866 -53.598 1.00 51.63 ? 70 LYS D CG 1 ATOM 5173 C CD . LYS D 4 72 ? -35.759 -83.918 -54.336 1.00 52.55 ? 70 LYS D CD 1 ATOM 5174 C CE . LYS D 4 72 ? -36.312 -82.525 -54.639 1.00 53.12 ? 70 LYS D CE 1 ATOM 5175 N NZ . LYS D 4 72 ? -37.362 -82.585 -55.700 1.00 53.91 ? 70 LYS D NZ 1 ATOM 5176 N N . LYS D 4 73 ? -31.247 -86.180 -54.154 1.00 51.74 ? 71 LYS D N 1 ATOM 5177 C CA . LYS D 4 73 ? -30.094 -86.150 -55.044 1.00 52.12 ? 71 LYS D CA 1 ATOM 5178 C C . LYS D 4 73 ? -29.997 -84.754 -55.638 1.00 52.46 ? 71 LYS D C 1 ATOM 5179 O O . LYS D 4 73 ? -28.944 -84.105 -55.576 1.00 52.57 ? 71 LYS D O 1 ATOM 5180 C CB . LYS D 4 73 ? -30.239 -87.199 -56.153 1.00 52.01 ? 71 LYS D CB 1 ATOM 5181 C CG . LYS D 4 73 ? -28.939 -87.600 -56.851 1.00 51.58 ? 71 LYS D CG 1 ATOM 5182 C CD . LYS D 4 73 ? -29.199 -88.757 -57.814 1.00 51.43 ? 71 LYS D CD 1 ATOM 5183 C CE . LYS D 4 73 ? -27.928 -89.279 -58.457 1.00 51.01 ? 71 LYS D CE 1 ATOM 5184 N NZ . LYS D 4 73 ? -28.120 -90.651 -59.019 1.00 50.82 ? 71 LYS D NZ 1 ATOM 5185 N N . SER D 4 74 ? -31.127 -84.283 -56.161 1.00 52.64 ? 72 SER D N 1 ATOM 5186 C CA . SER D 4 74 ? -31.171 -83.054 -56.931 1.00 52.77 ? 72 SER D CA 1 ATOM 5187 C C . SER D 4 74 ? -30.930 -81.791 -56.111 1.00 52.67 ? 72 SER D C 1 ATOM 5188 O O . SER D 4 74 ? -30.709 -80.728 -56.688 1.00 52.91 ? 72 SER D O 1 ATOM 5189 C CB . SER D 4 74 ? -32.506 -82.949 -57.667 1.00 52.81 ? 72 SER D CB 1 ATOM 5190 O OG . SER D 4 74 ? -33.491 -82.353 -56.839 1.00 53.67 ? 72 SER D OG 1 ATOM 5191 N N . SER D 4 75 ? -30.961 -81.893 -54.784 1.00 52.54 ? 73 SER D N 1 ATOM 5192 C CA . SER D 4 75 ? -31.030 -80.685 -53.957 1.00 52.58 ? 73 SER D CA 1 ATOM 5193 C C . SER D 4 75 ? -30.195 -80.675 -52.684 1.00 52.41 ? 73 SER D C 1 ATOM 5194 O O . SER D 4 75 ? -30.142 -81.659 -51.964 1.00 52.23 ? 73 SER D O 1 ATOM 5195 C CB . SER D 4 75 ? -32.486 -80.372 -53.617 1.00 52.67 ? 73 SER D CB 1 ATOM 5196 O OG . SER D 4 75 ? -32.571 -79.236 -52.774 1.00 53.34 ? 73 SER D OG 1 ATOM 5197 N N . PHE D 4 76 ? -29.583 -79.530 -52.400 1.00 52.59 ? 74 PHE D N 1 ATOM 5198 C CA . PHE D 4 76 ? -28.663 -79.389 -51.277 1.00 53.01 ? 74 PHE D CA 1 ATOM 5199 C C . PHE D 4 76 ? -28.760 -78.002 -50.643 1.00 53.39 ? 74 PHE D C 1 ATOM 5200 O O . PHE D 4 76 ? -28.369 -77.006 -51.252 1.00 53.35 ? 74 PHE D O 1 ATOM 5201 C CB . PHE D 4 76 ? -27.233 -79.671 -51.748 1.00 53.03 ? 74 PHE D CB 1 ATOM 5202 C CG . PHE D 4 76 ? -26.224 -79.840 -50.635 1.00 53.25 ? 74 PHE D CG 1 ATOM 5203 C CD1 . PHE D 4 76 ? -26.581 -80.394 -49.412 1.00 53.09 ? 74 PHE D CD1 1 ATOM 5204 C CD2 . PHE D 4 76 ? -24.893 -79.482 -50.838 1.00 52.97 ? 74 PHE D CD2 1 ATOM 5205 C CE1 . PHE D 4 76 ? -25.641 -80.556 -48.409 1.00 52.88 ? 74 PHE D CE1 1 ATOM 5206 C CE2 . PHE D 4 76 ? -23.947 -79.648 -49.838 1.00 52.44 ? 74 PHE D CE2 1 ATOM 5207 C CZ . PHE D 4 76 ? -24.321 -80.185 -48.623 1.00 52.40 ? 74 PHE D CZ 1 ATOM 5208 N N . SER D 4 77 ? -29.275 -77.957 -49.412 1.00 54.04 ? 75 SER D N 1 ATOM 5209 C CA . SER D 4 77 ? -29.511 -76.707 -48.675 1.00 54.59 ? 75 SER D CA 1 ATOM 5210 C C . SER D 4 77 ? -28.492 -76.460 -47.573 1.00 54.95 ? 75 SER D C 1 ATOM 5211 O O . SER D 4 77 ? -28.089 -77.382 -46.868 1.00 55.12 ? 75 SER D O 1 ATOM 5212 C CB . SER D 4 77 ? -30.901 -76.715 -48.052 1.00 54.47 ? 75 SER D CB 1 ATOM 5213 O OG . SER D 4 77 ? -31.894 -76.811 -49.050 1.00 55.09 ? 75 SER D OG 1 ATOM 5214 N N . LEU D 4 78 ? -28.088 -75.205 -47.428 1.00 55.45 ? 76 LEU D N 1 ATOM 5215 C CA . LEU D 4 78 ? -27.185 -74.805 -46.361 1.00 56.14 ? 76 LEU D CA 1 ATOM 5216 C C . LEU D 4 78 ? -27.903 -73.785 -45.483 1.00 56.95 ? 76 LEU D C 1 ATOM 5217 O O . LEU D 4 78 ? -28.609 -72.909 -46.000 1.00 57.03 ? 76 LEU D O 1 ATOM 5218 C CB . LEU D 4 78 ? -25.896 -74.208 -46.947 1.00 55.89 ? 76 LEU D CB 1 ATOM 5219 C CG . LEU D 4 78 ? -24.858 -73.567 -46.018 1.00 55.33 ? 76 LEU D CG 1 ATOM 5220 C CD1 . LEU D 4 78 ? -24.018 -74.625 -45.323 1.00 55.29 ? 76 LEU D CD1 1 ATOM 5221 C CD2 . LEU D 4 78 ? -23.964 -72.606 -46.770 1.00 54.51 ? 76 LEU D CD2 1 ATOM 5222 N N . THR D 4 79 ? -27.732 -73.906 -44.163 1.00 57.78 ? 77 THR D N 1 ATOM 5223 C CA . THR D 4 79 ? -28.330 -72.963 -43.211 1.00 58.57 ? 77 THR D CA 1 ATOM 5224 C C . THR D 4 79 ? -27.306 -72.211 -42.405 1.00 59.20 ? 77 THR D C 1 ATOM 5225 O O . THR D 4 79 ? -26.441 -72.808 -41.763 1.00 59.18 ? 77 THR D O 1 ATOM 5226 C CB . THR D 4 79 ? -29.274 -73.631 -42.214 1.00 58.53 ? 77 THR D CB 1 ATOM 5227 O OG1 . THR D 4 79 ? -28.695 -74.857 -41.753 1.00 58.61 ? 77 THR D OG1 1 ATOM 5228 C CG2 . THR D 4 79 ? -30.637 -73.884 -42.847 1.00 58.70 ? 77 THR D CG2 1 ATOM 5229 N N . VAL D 4 80 ? -27.431 -70.890 -42.455 1.00 60.29 ? 78 VAL D N 1 ATOM 5230 C CA . VAL D 4 80 ? -26.605 -69.969 -41.689 1.00 61.41 ? 78 VAL D CA 1 ATOM 5231 C C . VAL D 4 80 ? -27.337 -69.756 -40.382 1.00 62.18 ? 78 VAL D C 1 ATOM 5232 O O . VAL D 4 80 ? -28.426 -69.182 -40.375 1.00 62.26 ? 78 VAL D O 1 ATOM 5233 C CB . VAL D 4 80 ? -26.441 -68.603 -42.416 1.00 61.39 ? 78 VAL D CB 1 ATOM 5234 C CG1 . VAL D 4 80 ? -25.606 -67.631 -41.582 1.00 61.40 ? 78 VAL D CG1 1 ATOM 5235 C CG2 . VAL D 4 80 ? -25.829 -68.786 -43.806 1.00 61.31 ? 78 VAL D CG2 1 ATOM 5236 N N . THR D 4 81 ? -26.742 -70.212 -39.281 1.00 63.25 ? 79 THR D N 1 ATOM 5237 C CA . THR D 4 81 ? -27.449 -70.259 -37.994 1.00 64.29 ? 79 THR D CA 1 ATOM 5238 C C . THR D 4 81 ? -27.640 -68.875 -37.372 1.00 64.96 ? 79 THR D C 1 ATOM 5239 O O . THR D 4 81 ? -28.771 -68.473 -37.088 1.00 65.05 ? 79 THR D O 1 ATOM 5240 C CB . THR D 4 81 ? -26.791 -71.235 -36.981 1.00 64.23 ? 79 THR D CB 1 ATOM 5241 O OG1 . THR D 4 81 ? -26.174 -72.323 -37.680 1.00 64.42 ? 79 THR D OG1 1 ATOM 5242 C CG2 . THR D 4 81 ? -27.839 -71.796 -36.025 1.00 64.21 ? 79 THR D CG2 1 ATOM 5243 N N . SER D 4 82 ? -26.541 -68.152 -37.176 1.00 65.82 ? 80 SER D N 1 ATOM 5244 C CA . SER D 4 82 ? -26.602 -66.790 -36.654 1.00 66.82 ? 80 SER D CA 1 ATOM 5245 C C . SER D 4 82 ? -25.762 -65.850 -37.506 1.00 67.49 ? 80 SER D C 1 ATOM 5246 O O . SER D 4 82 ? -24.530 -65.904 -37.472 1.00 67.57 ? 80 SER D O 1 ATOM 5247 C CB . SER D 4 82 ? -26.137 -66.742 -35.193 1.00 66.84 ? 80 SER D CB 1 ATOM 5248 O OG . SER D 4 82 ? -26.121 -65.410 -34.698 1.00 66.97 ? 80 SER D OG 1 ATOM 5249 N N . ALA D 4 83 ? -26.433 -64.990 -38.267 1.00 68.32 ? 81 ALA D N 1 ATOM 5250 C CA . ALA D 4 83 ? -25.744 -64.018 -39.108 1.00 69.32 ? 81 ALA D CA 1 ATOM 5251 C C . ALA D 4 83 ? -24.871 -63.080 -38.268 1.00 70.09 ? 81 ALA D C 1 ATOM 5252 O O . ALA D 4 83 ? -25.301 -62.609 -37.212 1.00 70.34 ? 81 ALA D O 1 ATOM 5253 C CB . ALA D 4 83 ? -26.747 -63.231 -39.916 1.00 69.22 ? 81 ALA D CB 1 ATOM 5254 N N . GLN D 4 84 ? -23.643 -62.831 -38.727 1.00 70.94 ? 82 GLN D N 1 ATOM 5255 C CA . GLN D 4 84 ? -22.730 -61.916 -38.031 1.00 71.72 ? 82 GLN D CA 1 ATOM 5256 C C . GLN D 4 84 ? -23.126 -60.460 -38.272 1.00 72.12 ? 82 GLN D C 1 ATOM 5257 O O . GLN D 4 84 ? -23.785 -60.138 -39.266 1.00 72.19 ? 82 GLN D O 1 ATOM 5258 C CB . GLN D 4 84 ? -21.268 -62.142 -38.440 1.00 71.78 ? 82 GLN D CB 1 ATOM 5259 C CG . GLN D 4 84 ? -20.734 -63.563 -38.216 1.00 72.75 ? 82 GLN D CG 1 ATOM 5260 C CD . GLN D 4 84 ? -20.401 -63.881 -36.757 1.00 74.18 ? 82 GLN D CD 1 ATOM 5261 O OE1 . GLN D 4 84 ? -20.691 -63.103 -35.842 1.00 74.79 ? 82 GLN D OE1 1 ATOM 5262 N NE2 . GLN D 4 84 ? -19.784 -65.040 -36.539 1.00 74.50 ? 82 GLN D NE2 1 ATOM 5263 N N . LYS D 4 85 ? -22.699 -59.596 -37.353 1.00 72.62 ? 83 LYS D N 1 ATOM 5264 C CA . LYS D 4 85 ? -23.089 -58.178 -37.297 1.00 72.91 ? 83 LYS D CA 1 ATOM 5265 C C . LYS D 4 85 ? -22.996 -57.412 -38.626 1.00 72.84 ? 83 LYS D C 1 ATOM 5266 O O . LYS D 4 85 ? -23.966 -56.790 -39.061 1.00 72.83 ? 83 LYS D O 1 ATOM 5267 C CB . LYS D 4 85 ? -22.249 -57.472 -36.222 1.00 73.04 ? 83 LYS D CB 1 ATOM 5268 C CG . LYS D 4 85 ? -22.835 -56.167 -35.690 1.00 73.69 ? 83 LYS D CG 1 ATOM 5269 C CD . LYS D 4 85 ? -21.957 -55.566 -34.589 1.00 74.23 ? 83 LYS D CD 1 ATOM 5270 C CE . LYS D 4 85 ? -22.135 -56.290 -33.254 1.00 74.42 ? 83 LYS D CE 1 ATOM 5271 N NZ . LYS D 4 85 ? -21.261 -55.713 -32.195 1.00 74.60 ? 83 LYS D NZ 1 ATOM 5272 N N . ASN D 4 86 ? -21.826 -57.468 -39.256 1.00 72.94 ? 84 ASN D N 1 ATOM 5273 C CA . ASN D 4 86 ? -21.528 -56.678 -40.450 1.00 73.10 ? 84 ASN D CA 1 ATOM 5274 C C . ASN D 4 86 ? -21.332 -57.590 -41.651 1.00 72.89 ? 84 ASN D C 1 ATOM 5275 O O . ASN D 4 86 ? -20.835 -57.162 -42.697 1.00 72.96 ? 84 ASN D O 1 ATOM 5276 C CB . ASN D 4 86 ? -20.255 -55.853 -40.219 1.00 73.26 ? 84 ASN D CB 1 ATOM 5277 C CG . ASN D 4 86 ? -20.052 -55.477 -38.749 1.00 74.29 ? 84 ASN D CG 1 ATOM 5278 O OD1 . ASN D 4 86 ? -19.125 -55.965 -38.085 1.00 75.25 ? 84 ASN D OD1 1 ATOM 5279 N ND2 . ASN D 4 86 ? -20.933 -54.620 -38.231 1.00 74.69 ? 84 ASN D ND2 1 ATOM 5280 N N . GLU D 4 87 ? -21.750 -58.846 -41.488 1.00 72.61 ? 85 GLU D N 1 ATOM 5281 C CA . GLU D 4 87 ? -21.373 -59.943 -42.383 1.00 72.28 ? 85 GLU D CA 1 ATOM 5282 C C . GLU D 4 87 ? -21.571 -59.621 -43.861 1.00 71.54 ? 85 GLU D C 1 ATOM 5283 O O . GLU D 4 87 ? -22.572 -59.018 -44.254 1.00 71.62 ? 85 GLU D O 1 ATOM 5284 C CB . GLU D 4 87 ? -22.112 -61.238 -41.991 1.00 72.55 ? 85 GLU D CB 1 ATOM 5285 C CG . GLU D 4 87 ? -21.624 -62.536 -42.667 1.00 73.75 ? 85 GLU D CG 1 ATOM 5286 C CD . GLU D 4 87 ? -20.302 -63.077 -42.105 1.00 75.69 ? 85 GLU D CD 1 ATOM 5287 O OE1 . GLU D 4 87 ? -19.704 -62.434 -41.212 1.00 76.27 ? 85 GLU D OE1 1 ATOM 5288 O OE2 . GLU D 4 87 ? -19.854 -64.156 -42.562 1.00 76.45 ? 85 GLU D OE2 1 ATOM 5289 N N . MET D 4 88 ? -20.576 -60.002 -44.655 1.00 70.52 ? 86 MET D N 1 ATOM 5290 C CA . MET D 4 88 ? -20.655 -59.973 -46.104 1.00 69.58 ? 86 MET D CA 1 ATOM 5291 C C . MET D 4 88 ? -19.867 -61.153 -46.627 1.00 68.53 ? 86 MET D C 1 ATOM 5292 O O . MET D 4 88 ? -18.670 -61.279 -46.354 1.00 68.67 ? 86 MET D O 1 ATOM 5293 C CB . MET D 4 88 ? -20.082 -58.672 -46.660 1.00 69.86 ? 86 MET D CB 1 ATOM 5294 C CG . MET D 4 88 ? -21.132 -57.637 -47.004 1.00 70.95 ? 86 MET D CG 1 ATOM 5295 S SD . MET D 4 88 ? -20.441 -55.986 -47.227 1.00 72.75 ? 86 MET D SD 1 ATOM 5296 C CE . MET D 4 88 ? -21.716 -55.219 -48.240 1.00 72.30 ? 86 MET D CE 1 ATOM 5297 N N . ALA D 4 89 ? -20.546 -62.032 -47.357 1.00 67.06 ? 87 ALA D N 1 ATOM 5298 C CA . ALA D 4 89 ? -19.898 -63.211 -47.920 1.00 65.46 ? 87 ALA D CA 1 ATOM 5299 C C . ALA D 4 89 ? -20.592 -63.695 -49.182 1.00 64.24 ? 87 ALA D C 1 ATOM 5300 O O . ALA D 4 89 ? -21.770 -63.406 -49.419 1.00 64.00 ? 87 ALA D O 1 ATOM 5301 C CB . ALA D 4 89 ? -19.835 -64.324 -46.889 1.00 65.69 ? 87 ALA D CB 1 ATOM 5302 N N . VAL D 4 90 ? -19.835 -64.421 -49.994 1.00 62.60 ? 88 VAL D N 1 ATOM 5303 C CA . VAL D 4 90 ? -20.381 -65.076 -51.165 1.00 60.99 ? 88 VAL D CA 1 ATOM 5304 C C . VAL D 4 90 ? -20.407 -66.566 -50.846 1.00 59.76 ? 88 VAL D C 1 ATOM 5305 O O . VAL D 4 90 ? -19.455 -67.092 -50.259 1.00 59.77 ? 88 VAL D O 1 ATOM 5306 C CB . VAL D 4 90 ? -19.529 -64.803 -52.434 1.00 61.07 ? 88 VAL D CB 1 ATOM 5307 C CG1 . VAL D 4 90 ? -20.276 -65.241 -53.682 1.00 61.07 ? 88 VAL D CG1 1 ATOM 5308 C CG2 . VAL D 4 90 ? -19.171 -63.329 -52.543 1.00 60.89 ? 88 VAL D CG2 1 ATOM 5309 N N . PHE D 4 91 ? -21.500 -67.233 -51.205 1.00 57.98 ? 89 PHE D N 1 ATOM 5310 C CA . PHE D 4 91 ? -21.619 -68.666 -50.999 1.00 56.41 ? 89 PHE D CA 1 ATOM 5311 C C . PHE D 4 91 ? -21.730 -69.391 -52.325 1.00 55.70 ? 89 PHE D C 1 ATOM 5312 O O . PHE D 4 91 ? -22.610 -69.093 -53.131 1.00 55.78 ? 89 PHE D O 1 ATOM 5313 C CB . PHE D 4 91 ? -22.816 -68.977 -50.111 1.00 56.24 ? 89 PHE D CB 1 ATOM 5314 C CG . PHE D 4 91 ? -22.645 -68.511 -48.700 1.00 55.89 ? 89 PHE D CG 1 ATOM 5315 C CD1 . PHE D 4 91 ? -21.817 -69.204 -47.818 1.00 55.17 ? 89 PHE D CD1 1 ATOM 5316 C CD2 . PHE D 4 91 ? -23.297 -67.371 -48.247 1.00 55.71 ? 89 PHE D CD2 1 ATOM 5317 C CE1 . PHE D 4 91 ? -21.647 -68.773 -46.510 1.00 54.01 ? 89 PHE D CE1 1 ATOM 5318 C CE2 . PHE D 4 91 ? -23.134 -66.934 -46.930 1.00 54.73 ? 89 PHE D CE2 1 ATOM 5319 C CZ . PHE D 4 91 ? -22.305 -67.638 -46.066 1.00 54.11 ? 89 PHE D CZ 1 ATOM 5320 N N . LEU D 4 92 ? -20.830 -70.340 -52.549 1.00 54.58 ? 90 LEU D N 1 ATOM 5321 C CA . LEU D 4 92 ? -20.771 -71.041 -53.822 1.00 53.55 ? 90 LEU D CA 1 ATOM 5322 C C . LEU D 4 92 ? -21.107 -72.512 -53.661 1.00 53.10 ? 90 LEU D C 1 ATOM 5323 O O . LEU D 4 92 ? -20.751 -73.139 -52.668 1.00 53.21 ? 90 LEU D O 1 ATOM 5324 C CB . LEU D 4 92 ? -19.397 -70.866 -54.469 1.00 53.36 ? 90 LEU D CB 1 ATOM 5325 C CG . LEU D 4 92 ? -19.040 -69.451 -54.930 1.00 52.64 ? 90 LEU D CG 1 ATOM 5326 C CD1 . LEU D 4 92 ? -17.546 -69.201 -54.818 1.00 52.51 ? 90 LEU D CD1 1 ATOM 5327 C CD2 . LEU D 4 92 ? -19.522 -69.204 -56.345 1.00 52.52 ? 90 LEU D CD2 1 ATOM 5328 N N . CYS D 4 93 ? -21.792 -73.052 -54.658 1.00 52.41 ? 91 CYS D N 1 ATOM 5329 C CA . CYS D 4 93 ? -22.264 -74.416 -54.628 1.00 51.66 ? 91 CYS D CA 1 ATOM 5330 C C . CYS D 4 93 ? -21.686 -75.168 -55.809 1.00 50.62 ? 91 CYS D C 1 ATOM 5331 O O . CYS D 4 93 ? -21.637 -74.645 -56.917 1.00 50.58 ? 91 CYS D O 1 ATOM 5332 C CB . CYS D 4 93 ? -23.784 -74.426 -54.709 1.00 51.88 ? 91 CYS D CB 1 ATOM 5333 S SG . CYS D 4 93 ? -24.479 -76.039 -54.468 1.00 54.04 ? 91 CYS D SG 1 ATOM 5334 N N . ALA D 4 94 ? -21.251 -76.396 -55.563 1.00 49.54 ? 92 ALA D N 1 ATOM 5335 C CA . ALA D 4 94 ? -20.670 -77.235 -56.598 1.00 48.56 ? 92 ALA D CA 1 ATOM 5336 C C . ALA D 4 94 ? -21.158 -78.659 -56.453 1.00 47.95 ? 92 ALA D C 1 ATOM 5337 O O . ALA D 4 94 ? -21.326 -79.136 -55.336 1.00 47.88 ? 92 ALA D O 1 ATOM 5338 C CB . ALA D 4 94 ? -19.164 -77.193 -56.521 1.00 48.62 ? 92 ALA D CB 1 ATOM 5339 N N . SER D 4 95 ? -21.382 -79.329 -57.579 1.00 47.18 ? 93 SER D N 1 ATOM 5340 C CA . SER D 4 95 ? -21.777 -80.726 -57.579 1.00 46.99 ? 93 SER D CA 1 ATOM 5341 C C . SER D 4 95 ? -20.718 -81.525 -58.306 1.00 46.74 ? 93 SER D C 1 ATOM 5342 O O . SER D 4 95 ? -19.953 -80.948 -59.070 1.00 47.16 ? 93 SER D O 1 ATOM 5343 C CB . SER D 4 95 ? -23.106 -80.896 -58.287 1.00 47.11 ? 93 SER D CB 1 ATOM 5344 O OG . SER D 4 95 ? -22.910 -81.136 -59.671 1.00 47.98 ? 93 SER D OG 1 ATOM 5345 N N . GLY D 4 96 ? -20.681 -82.841 -58.097 1.00 46.35 ? 94 GLY D N 1 ATOM 5346 C CA . GLY D 4 96 ? -19.622 -83.673 -58.676 1.00 45.74 ? 94 GLY D CA 1 ATOM 5347 C C . GLY D 4 96 ? -19.956 -85.130 -58.899 1.00 45.27 ? 94 GLY D C 1 ATOM 5348 O O . GLY D 4 96 ? -20.691 -85.733 -58.121 1.00 45.31 ? 94 GLY D O 1 ATOM 5349 N N . SER D 4 97 ? -19.416 -85.692 -59.976 1.00 44.80 ? 95 SER D N 1 ATOM 5350 C CA . SER D 4 97 ? -19.551 -87.115 -60.241 1.00 44.41 ? 95 SER D CA 1 ATOM 5351 C C . SER D 4 97 ? -18.730 -87.897 -59.227 1.00 44.21 ? 95 SER D C 1 ATOM 5352 O O . SER D 4 97 ? -17.704 -87.421 -58.730 1.00 44.00 ? 95 SER D O 1 ATOM 5353 C CB . SER D 4 97 ? -19.099 -87.455 -61.662 1.00 44.45 ? 95 SER D CB 1 ATOM 5354 O OG . SER D 4 97 ? -19.351 -88.818 -61.979 1.00 44.53 ? 95 SER D OG 1 ATOM 5355 N N . LEU D 4 98 ? -19.179 -89.095 -58.921 1.00 43.97 ? 96 LEU D N 1 ATOM 5356 C CA . LEU D 4 98 ? -18.463 -89.969 -58.033 1.00 43.65 ? 96 LEU D CA 1 ATOM 5357 C C . LEU D 4 98 ? -17.497 -90.814 -58.822 1.00 43.40 ? 96 LEU D C 1 ATOM 5358 O O . LEU D 4 98 ? -16.614 -91.417 -58.268 1.00 43.58 ? 96 LEU D O 1 ATOM 5359 C CB . LEU D 4 98 ? -19.457 -90.861 -57.314 1.00 43.68 ? 96 LEU D CB 1 ATOM 5360 C CG . LEU D 4 98 ? -19.448 -91.075 -55.804 1.00 43.75 ? 96 LEU D CG 1 ATOM 5361 C CD1 . LEU D 4 98 ? -18.958 -89.923 -55.051 1.00 43.16 ? 96 LEU D CD1 1 ATOM 5362 C CD2 . LEU D 4 98 ? -20.790 -91.407 -55.327 1.00 44.33 ? 96 LEU D CD2 1 ATOM 5363 N N . LEU D 4 99 ? -17.653 -90.845 -60.130 1.00 42.92 ? 97 LEU D N 1 ATOM 5364 C CA . LEU D 4 99 ? -16.761 -91.622 -60.967 1.00 42.40 ? 97 LEU D CA 1 ATOM 5365 C C . LEU D 4 99 ? -15.802 -90.803 -61.770 1.00 42.01 ? 97 LEU D C 1 ATOM 5366 O O . LEU D 4 99 ? -15.186 -91.314 -62.661 1.00 41.88 ? 97 LEU D O 1 ATOM 5367 C CB . LEU D 4 99 ? -17.553 -92.504 -61.894 1.00 42.39 ? 97 LEU D CB 1 ATOM 5368 C CG . LEU D 4 99 ? -18.615 -93.128 -61.037 1.00 42.15 ? 97 LEU D CG 1 ATOM 5369 C CD1 . LEU D 4 99 ? -18.814 -94.512 -61.431 1.00 41.94 ? 97 LEU D CD1 1 ATOM 5370 C CD2 . LEU D 4 99 ? -18.037 -93.063 -59.690 1.00 42.51 ? 97 LEU D CD2 1 ATOM 5371 N N . ASP D 4 100 ? -15.732 -89.521 -61.473 1.00 41.54 ? 98 ASP D N 1 ATOM 5372 C CA . ASP D 4 100 ? -14.835 -88.617 -62.122 1.00 41.24 ? 98 ASP D CA 1 ATOM 5373 C C . ASP D 4 100 ? -14.381 -87.571 -61.174 1.00 40.92 ? 98 ASP D C 1 ATOM 5374 O O . ASP D 4 100 ? -14.975 -86.555 -61.096 1.00 40.78 ? 98 ASP D O 1 ATOM 5375 C CB . ASP D 4 100 ? -15.593 -87.898 -63.199 1.00 41.57 ? 98 ASP D CB 1 ATOM 5376 C CG . ASP D 4 100 ? -14.724 -87.443 -64.280 1.00 41.53 ? 98 ASP D CG 1 ATOM 5377 O OD1 . ASP D 4 100 ? -15.226 -87.271 -65.384 1.00 41.15 ? 98 ASP D OD1 1 ATOM 5378 O OD2 . ASP D 4 100 ? -13.535 -87.269 -64.026 1.00 40.72 ? 98 ASP D OD2 1 ATOM 5379 N N . VAL D 4 101 ? -13.292 -87.746 -60.476 1.00 40.76 ? 99 VAL D N 1 ATOM 5380 C CA . VAL D 4 101 ? -12.949 -86.652 -59.579 1.00 40.82 ? 99 VAL D CA 1 ATOM 5381 C C . VAL D 4 101 ? -13.172 -85.279 -60.210 1.00 40.96 ? 99 VAL D C 1 ATOM 5382 O O . VAL D 4 101 ? -13.626 -84.350 -59.543 1.00 41.21 ? 99 VAL D O 1 ATOM 5383 C CB . VAL D 4 101 ? -11.486 -86.752 -59.105 1.00 40.83 ? 99 VAL D CB 1 ATOM 5384 C CG1 . VAL D 4 101 ? -10.599 -87.268 -60.228 1.00 40.66 ? 99 VAL D CG1 1 ATOM 5385 C CG2 . VAL D 4 101 ? -10.996 -85.400 -58.608 1.00 41.13 ? 99 VAL D CG2 1 ATOM 5386 N N . ARG D 4 102 ? -12.838 -85.151 -61.491 1.00 41.02 ? 100 ARG D N 1 ATOM 5387 C CA . ARG D 4 102 ? -12.820 -83.849 -62.139 1.00 40.95 ? 100 ARG D CA 1 ATOM 5388 C C . ARG D 4 102 ? -14.228 -83.300 -62.317 1.00 40.87 ? 100 ARG D C 1 ATOM 5389 O O . ARG D 4 102 ? -14.461 -82.103 -62.147 1.00 40.97 ? 100 ARG D O 1 ATOM 5390 C CB . ARG D 4 102 ? -12.115 -83.936 -63.494 1.00 40.97 ? 100 ARG D CB 1 ATOM 5391 C CG . ARG D 4 102 ? -10.674 -84.414 -63.415 1.00 41.15 ? 100 ARG D CG 1 ATOM 5392 C CD . ARG D 4 102 ? -10.385 -85.475 -64.465 1.00 42.94 ? 100 ARG D CD 1 ATOM 5393 N NE . ARG D 4 102 ? -9.047 -86.040 -64.318 1.00 44.05 ? 100 ARG D NE 1 ATOM 5394 C CZ . ARG D 4 102 ? -8.523 -86.942 -65.141 1.00 44.70 ? 100 ARG D CZ 1 ATOM 5395 N NH1 . ARG D 4 102 ? -9.225 -87.386 -66.175 1.00 44.98 ? 100 ARG D NH1 1 ATOM 5396 N NH2 . ARG D 4 102 ? -7.297 -87.401 -64.931 1.00 45.08 ? 100 ARG D NH2 1 ATOM 5397 N N . GLU D 4 103 ? -15.165 -84.174 -62.671 1.00 40.17 ? 105 GLU D N 1 ATOM 5398 C CA . GLU D 4 103 ? -16.521 -83.728 -62.970 1.00 40.42 ? 105 GLU D CA 1 ATOM 5399 C C . GLU D 4 103 ? -17.116 -82.895 -61.841 1.00 40.82 ? 105 GLU D C 1 ATOM 5400 O O . GLU D 4 103 ? -17.995 -83.356 -61.113 1.00 41.10 ? 105 GLU D O 1 ATOM 5401 C CB . GLU D 4 103 ? -17.423 -84.927 -63.269 1.00 40.28 ? 105 GLU D CB 1 ATOM 5402 C CG . GLU D 4 103 ? -18.802 -84.552 -63.787 1.00 39.60 ? 105 GLU D CG 1 ATOM 5403 C CD . GLU D 4 103 ? -19.205 -85.357 -65.007 1.00 39.92 ? 105 GLU D CD 1 ATOM 5404 O OE1 . GLU D 4 103 ? -18.337 -85.604 -65.871 1.00 41.52 ? 105 GLU D OE1 1 ATOM 5405 O OE2 . GLU D 4 103 ? -20.388 -85.744 -65.102 1.00 39.16 ? 105 GLU D OE2 1 ATOM 5406 N N . VAL D 4 104 ? -16.636 -81.664 -61.705 1.00 41.24 ? 106 VAL D N 1 ATOM 5407 C CA . VAL D 4 104 ? -17.177 -80.735 -60.723 1.00 41.51 ? 106 VAL D CA 1 ATOM 5408 C C . VAL D 4 104 ? -17.703 -79.497 -61.436 1.00 42.02 ? 106 VAL D C 1 ATOM 5409 O O . VAL D 4 104 ? -17.004 -78.906 -62.258 1.00 42.32 ? 106 VAL D O 1 ATOM 5410 C CB . VAL D 4 104 ? -16.114 -80.316 -59.694 1.00 41.26 ? 106 VAL D CB 1 ATOM 5411 C CG1 . VAL D 4 104 ? -16.704 -79.336 -58.691 1.00 41.41 ? 106 VAL D CG1 1 ATOM 5412 C CG2 . VAL D 4 104 ? -15.549 -81.538 -58.986 1.00 40.79 ? 106 VAL D CG2 1 ATOM 5413 N N . PHE D 4 105 ? -18.934 -79.105 -61.125 1.00 42.54 ? 107 PHE D N 1 ATOM 5414 C CA . PHE D 4 105 ? -19.515 -77.960 -61.760 1.00 43.25 ? 107 PHE D CA 1 ATOM 5415 C C . PHE D 4 105 ? -20.005 -77.035 -60.720 1.00 43.82 ? 107 PHE D C 1 ATOM 5416 O O . PHE D 4 105 ? -20.610 -77.477 -59.804 1.00 44.18 ? 107 PHE D O 1 ATOM 5417 C CB . PHE D 4 105 ? -20.684 -78.397 -62.581 1.00 43.17 ? 107 PHE D CB 1 ATOM 5418 C CG . PHE D 4 105 ? -20.308 -79.166 -63.772 1.00 43.32 ? 107 PHE D CG 1 ATOM 5419 C CD1 . PHE D 4 105 ? -19.521 -78.631 -64.717 1.00 43.20 ? 107 PHE D CD1 1 ATOM 5420 C CD2 . PHE D 4 105 ? -20.747 -80.415 -63.947 1.00 43.34 ? 107 PHE D CD2 1 ATOM 5421 C CE1 . PHE D 4 105 ? -19.192 -79.336 -65.780 1.00 43.95 ? 107 PHE D CE1 1 ATOM 5422 C CE2 . PHE D 4 105 ? -20.416 -81.091 -65.015 1.00 43.68 ? 107 PHE D CE2 1 ATOM 5423 C CZ . PHE D 4 105 ? -19.637 -80.562 -65.923 1.00 44.42 ? 107 PHE D CZ 1 ATOM 5424 N N . PHE D 4 106 ? -19.761 -75.744 -60.872 1.00 44.46 ? 108 PHE D N 1 ATOM 5425 C CA . PHE D 4 106 ? -20.155 -74.747 -59.875 1.00 44.80 ? 108 PHE D CA 1 ATOM 5426 C C . PHE D 4 106 ? -21.383 -73.989 -60.330 1.00 45.73 ? 108 PHE D C 1 ATOM 5427 O O . PHE D 4 106 ? -21.710 -73.979 -61.516 1.00 45.70 ? 108 PHE D O 1 ATOM 5428 C CB . PHE D 4 106 ? -19.031 -73.744 -59.630 1.00 44.41 ? 108 PHE D CB 1 ATOM 5429 C CG . PHE D 4 106 ? -17.878 -74.298 -58.858 1.00 43.50 ? 108 PHE D CG 1 ATOM 5430 C CD1 . PHE D 4 106 ? -16.911 -75.071 -59.481 1.00 43.34 ? 108 PHE D CD1 1 ATOM 5431 C CD2 . PHE D 4 106 ? -17.741 -74.027 -57.514 1.00 43.25 ? 108 PHE D CD2 1 ATOM 5432 C CE1 . PHE D 4 106 ? -15.837 -75.579 -58.775 1.00 42.54 ? 108 PHE D CE1 1 ATOM 5433 C CE2 . PHE D 4 106 ? -16.664 -74.535 -56.796 1.00 43.01 ? 108 PHE D CE2 1 ATOM 5434 C CZ . PHE D 4 106 ? -15.713 -75.312 -57.432 1.00 42.69 ? 108 PHE D CZ 1 ATOM 5435 N N . GLY D 4 107 ? -22.054 -73.352 -59.375 1.00 46.96 ? 109 GLY D N 1 ATOM 5436 C CA . GLY D 4 107 ? -23.195 -72.486 -59.657 1.00 48.46 ? 109 GLY D CA 1 ATOM 5437 C C . GLY D 4 107 ? -22.747 -71.044 -59.816 1.00 49.60 ? 109 GLY D C 1 ATOM 5438 O O . GLY D 4 107 ? -21.545 -70.763 -59.847 1.00 49.89 ? 109 GLY D O 1 ATOM 5439 N N . LYS D 4 108 ? -23.708 -70.127 -59.899 1.00 50.43 ? 110 LYS D N 1 ATOM 5440 C CA . LYS D 4 108 ? -23.402 -68.717 -60.141 1.00 51.18 ? 110 LYS D CA 1 ATOM 5441 C C . LYS D 4 108 ? -23.230 -67.877 -58.862 1.00 51.60 ? 110 LYS D C 1 ATOM 5442 O O . LYS D 4 108 ? -23.193 -66.644 -58.921 1.00 51.83 ? 110 LYS D O 1 ATOM 5443 C CB . LYS D 4 108 ? -24.445 -68.085 -61.077 1.00 51.31 ? 110 LYS D CB 1 ATOM 5444 C CG . LYS D 4 108 ? -24.518 -68.709 -62.470 1.00 51.70 ? 110 LYS D CG 1 ATOM 5445 C CD . LYS D 4 108 ? -24.395 -67.634 -63.540 1.00 52.44 ? 110 LYS D CD 1 ATOM 5446 C CE . LYS D 4 108 ? -25.086 -68.027 -64.835 1.00 52.86 ? 110 LYS D CE 1 ATOM 5447 N NZ . LYS D 4 108 ? -26.492 -67.530 -64.845 1.00 52.72 ? 110 LYS D NZ 1 ATOM 5448 N N . GLY D 4 109 ? -23.125 -68.535 -57.713 1.00 52.05 ? 111 GLY D N 1 ATOM 5449 C CA . GLY D 4 109 ? -22.871 -67.839 -56.448 1.00 52.72 ? 111 GLY D CA 1 ATOM 5450 C C . GLY D 4 109 ? -24.060 -67.169 -55.775 1.00 53.19 ? 111 GLY D C 1 ATOM 5451 O O . GLY D 4 109 ? -25.059 -66.853 -56.425 1.00 53.01 ? 111 GLY D O 1 ATOM 5452 N N . THR D 4 110 ? -23.935 -66.959 -54.461 1.00 53.83 ? 112 THR D N 1 ATOM 5453 C CA . THR D 4 110 ? -24.953 -66.286 -53.635 1.00 54.47 ? 112 THR D CA 1 ATOM 5454 C C . THR D 4 110 ? -24.319 -65.174 -52.790 1.00 55.14 ? 112 THR D C 1 ATOM 5455 O O . THR D 4 110 ? -23.439 -65.438 -51.972 1.00 54.96 ? 112 THR D O 1 ATOM 5456 C CB . THR D 4 110 ? -25.681 -67.287 -52.701 1.00 54.32 ? 112 THR D CB 1 ATOM 5457 O OG1 . THR D 4 110 ? -26.458 -68.204 -53.480 1.00 54.05 ? 112 THR D OG1 1 ATOM 5458 C CG2 . THR D 4 110 ? -26.594 -66.562 -51.720 1.00 54.13 ? 112 THR D CG2 1 ATOM 5459 N N . ARG D 4 111 ? -24.806 -63.962 -52.938 1.00 56.24 ? 113 ARG D N 1 ATOM 5460 C CA . ARG D 4 111 ? -24.216 -62.877 -52.205 1.00 57.62 ? 113 ARG D CA 1 ATOM 5461 C C . ARG D 4 111 ? -25.071 -62.435 -51.053 1.00 58.65 ? 113 ARG D C 1 ATOM 5462 O O . ARG D 4 111 ? -26.169 -61.975 -51.222 1.00 58.50 ? 113 ARG D O 1 ATOM 5463 C CB . ARG D 4 111 ? -23.933 -61.706 -53.128 1.00 57.60 ? 113 ARG D CB 1 ATOM 5464 C CG . ARG D 4 111 ? -22.556 -61.703 -53.737 1.00 57.64 ? 113 ARG D CG 1 ATOM 5465 C CD . ARG D 4 111 ? -22.525 -62.309 -55.137 1.00 57.45 ? 113 ARG D CD 1 ATOM 5466 N NE . ARG D 4 111 ? -21.161 -62.685 -55.521 0.00 66.54 ? 113 ARG D NE 1 ATOM 5467 C CZ . ARG D 4 111 ? -20.842 -63.466 -56.540 0.00 66.46 ? 113 ARG D CZ 1 ATOM 5468 N NH1 . ARG D 4 111 ? -21.791 -63.959 -57.299 1.00 34.55 ? 113 ARG D NH1 1 ATOM 5469 N NH2 . ARG D 4 111 ? -19.580 -63.732 -56.801 1.00 53.99 ? 113 ARG D NH2 1 ATOM 5470 N N . LEU D 4 112 ? -24.502 -62.556 -49.869 1.00 60.14 ? 114 LEU D N 1 ATOM 5471 C CA . LEU D 4 112 ? -25.171 -62.250 -48.606 1.00 61.54 ? 114 LEU D CA 1 ATOM 5472 C C . LEU D 4 112 ? -24.705 -60.914 -48.043 1.00 62.65 ? 114 LEU D C 1 ATOM 5473 O O . LEU D 4 112 ? -23.498 -60.680 -47.893 1.00 62.85 ? 114 LEU D O 1 ATOM 5474 C CB . LEU D 4 112 ? -24.904 -63.349 -47.575 1.00 61.51 ? 114 LEU D CB 1 ATOM 5475 C CG . LEU D 4 112 ? -25.107 -62.985 -46.100 1.00 61.50 ? 114 LEU D CG 1 ATOM 5476 C CD1 . LEU D 4 112 ? -26.547 -63.242 -45.670 1.00 61.69 ? 114 LEU D CD1 1 ATOM 5477 C CD2 . LEU D 4 112 ? -24.118 -63.735 -45.210 1.00 61.03 ? 114 LEU D CD2 1 ATOM 5478 N N . THR D 4 113 ? -25.674 -60.050 -47.739 1.00 63.97 ? 115 THR D N 1 ATOM 5479 C CA . THR D 4 113 ? -25.426 -58.788 -47.040 1.00 65.02 ? 115 THR D CA 1 ATOM 5480 C C . THR D 4 113 ? -26.287 -58.756 -45.794 1.00 65.83 ? 115 THR D C 1 ATOM 5481 O O . THR D 4 113 ? -27.493 -59.009 -45.853 1.00 65.85 ? 115 THR D O 1 ATOM 5482 C CB . THR D 4 113 ? -25.731 -57.552 -47.913 1.00 64.90 ? 115 THR D CB 1 ATOM 5483 O OG1 . THR D 4 113 ? -24.983 -57.628 -49.135 1.00 65.00 ? 115 THR D OG1 1 ATOM 5484 C CG2 . THR D 4 113 ? -25.351 -56.272 -47.175 1.00 64.77 ? 115 THR D CG2 1 ATOM 5485 N N . VAL D 4 114 ? -25.650 -58.460 -44.666 1.00 67.04 ? 116 VAL D N 1 ATOM 5486 C CA . VAL D 4 114 ? -26.337 -58.375 -43.386 1.00 68.17 ? 116 VAL D CA 1 ATOM 5487 C C . VAL D 4 114 ? -26.594 -56.914 -43.048 1.00 69.22 ? 116 VAL D C 1 ATOM 5488 O O . VAL D 4 114 ? -25.663 -56.188 -42.685 1.00 69.39 ? 116 VAL D O 1 ATOM 5489 C CB . VAL D 4 114 ? -25.537 -59.062 -42.251 1.00 68.00 ? 116 VAL D CB 1 ATOM 5490 C CG1 . VAL D 4 114 ? -26.262 -58.922 -40.923 1.00 67.85 ? 116 VAL D CG1 1 ATOM 5491 C CG2 . VAL D 4 114 ? -25.329 -60.526 -42.568 1.00 67.88 ? 116 VAL D CG2 1 ATOM 5492 N N . VAL D 4 115 ? -27.853 -56.490 -43.183 1.00 70.55 ? 117 VAL D N 1 ATOM 5493 C CA . VAL D 4 115 ? -28.277 -55.124 -42.813 1.00 71.92 ? 117 VAL D CA 1 ATOM 5494 C C . VAL D 4 115 ? -28.594 -55.001 -41.310 1.00 72.84 ? 117 VAL D C 1 ATOM 5495 O O . VAL D 4 115 ? -28.766 -56.012 -40.612 1.00 73.03 ? 117 VAL D O 1 ATOM 5496 C CB . VAL D 4 115 ? -29.451 -54.596 -43.678 1.00 71.87 ? 117 VAL D CB 1 ATOM 5497 C CG1 . VAL D 4 115 ? -29.142 -54.779 -45.158 1.00 72.23 ? 117 VAL D CG1 1 ATOM 5498 C CG2 . VAL D 4 115 ? -30.767 -55.279 -43.300 1.00 71.84 ? 117 VAL D CG2 1 ATOM 5499 N N . GLU D 4 116 ? -28.700 -53.765 -40.823 1.00 73.85 ? 118 GLU D N 1 ATOM 5500 C CA . GLU D 4 116 ? -28.375 -53.510 -39.429 1.00 74.86 ? 118 GLU D CA 1 ATOM 5501 C C . GLU D 4 116 ? -29.038 -52.278 -38.774 1.00 75.36 ? 118 GLU D C 1 ATOM 5502 O O . GLU D 4 116 ? -28.374 -51.629 -37.944 1.00 75.67 ? 118 GLU D O 1 ATOM 5503 C CB . GLU D 4 116 ? -26.845 -53.305 -39.386 1.00 74.95 ? 118 GLU D CB 1 ATOM 5504 C CG . GLU D 4 116 ? -26.130 -53.705 -38.094 1.00 75.77 ? 118 GLU D CG 1 ATOM 5505 C CD . GLU D 4 116 ? -24.825 -52.931 -37.893 1.00 76.26 ? 118 GLU D CD 1 ATOM 5506 O OE1 . GLU D 4 116 ? -24.874 -51.678 -37.866 1.00 76.30 ? 118 GLU D OE1 1 ATOM 5507 O OE2 . GLU D 4 116 ? -23.757 -53.573 -37.755 1.00 76.10 ? 118 GLU D OE2 1 ATOM 5508 N N . ASP D 4 117 ? -30.321 -51.962 -39.015 1.00 75.81 ? 119 ASP D N 1 ATOM 5509 C CA . ASP D 4 117 ? -31.426 -52.887 -39.265 1.00 76.17 ? 119 ASP D CA 1 ATOM 5510 C C . ASP D 4 117 ? -32.002 -52.777 -40.664 1.00 76.19 ? 119 ASP D C 1 ATOM 5511 O O . ASP D 4 117 ? -31.469 -52.095 -41.535 1.00 76.28 ? 119 ASP D O 1 ATOM 5512 C CB . ASP D 4 117 ? -32.604 -52.578 -38.304 1.00 76.50 ? 119 ASP D CB 1 ATOM 5513 C CG . ASP D 4 117 ? -32.157 -52.000 -36.961 1.00 77.20 ? 119 ASP D CG 1 ATOM 5514 O OD1 . ASP D 4 117 ? -31.911 -52.803 -36.031 1.00 77.40 ? 119 ASP D OD1 1 ATOM 5515 O OD2 . ASP D 4 117 ? -32.086 -50.749 -36.829 1.00 77.59 ? 119 ASP D OD2 1 ATOM 5516 N N . LEU D 4 118 ? -33.147 -53.433 -40.817 1.00 76.30 ? 120 LEU D N 1 ATOM 5517 C CA . LEU D 4 118 ? -33.929 -53.508 -42.039 1.00 76.42 ? 120 LEU D CA 1 ATOM 5518 C C . LEU D 4 118 ? -34.298 -52.148 -42.618 1.00 76.59 ? 120 LEU D C 1 ATOM 5519 O O . LEU D 4 118 ? -34.248 -51.960 -43.830 1.00 76.75 ? 120 LEU D O 1 ATOM 5520 C CB . LEU D 4 118 ? -35.201 -54.312 -41.740 1.00 76.42 ? 120 LEU D CB 1 ATOM 5521 C CG . LEU D 4 118 ? -35.996 -55.101 -42.787 1.00 76.06 ? 120 LEU D CG 1 ATOM 5522 C CD1 . LEU D 4 118 ? -36.728 -54.169 -43.731 1.00 76.03 ? 120 LEU D CD1 1 ATOM 5523 C CD2 . LEU D 4 118 ? -35.122 -56.093 -43.551 1.00 75.75 ? 120 LEU D CD2 1 ATOM 5524 N N . LYS D 4 119 ? -34.664 -51.209 -41.753 1.00 76.91 ? 121 LYS D N 1 ATOM 5525 C CA . LYS D 4 119 ? -35.110 -49.872 -42.167 1.00 77.28 ? 121 LYS D CA 1 ATOM 5526 C C . LYS D 4 119 ? -34.274 -49.227 -43.274 1.00 77.16 ? 121 LYS D C 1 ATOM 5527 O O . LYS D 4 119 ? -34.764 -48.381 -44.024 1.00 77.02 ? 121 LYS D O 1 ATOM 5528 C CB . LYS D 4 119 ? -35.106 -48.933 -40.966 1.00 77.52 ? 121 LYS D CB 1 ATOM 5529 C CG . LYS D 4 119 ? -36.258 -49.119 -39.999 1.00 78.63 ? 121 LYS D CG 1 ATOM 5530 C CD . LYS D 4 119 ? -36.522 -47.796 -39.288 1.00 80.16 ? 121 LYS D CD 1 ATOM 5531 C CE . LYS D 4 119 ? -37.390 -47.954 -38.053 1.00 80.71 ? 121 LYS D CE 1 ATOM 5532 N NZ . LYS D 4 119 ? -37.251 -46.747 -37.189 1.00 80.90 ? 121 LYS D NZ 1 ATOM 5533 N N . ASN D 4 120 ? -33.014 -49.642 -43.361 1.00 77.11 ? 122 ASN D N 1 ATOM 5534 C CA . ASN D 4 120 ? -32.018 -48.994 -44.208 1.00 77.08 ? 122 ASN D CA 1 ATOM 5535 C C . ASN D 4 120 ? -32.094 -49.365 -45.695 1.00 76.99 ? 122 ASN D C 1 ATOM 5536 O O . ASN D 4 120 ? -31.348 -48.817 -46.509 1.00 77.01 ? 122 ASN D O 1 ATOM 5537 C CB . ASN D 4 120 ? -30.608 -49.280 -43.658 1.00 77.09 ? 122 ASN D CB 1 ATOM 5538 C CG . ASN D 4 120 ? -30.504 -49.074 -42.138 1.00 77.14 ? 122 ASN D CG 1 ATOM 5539 O OD1 . ASN D 4 120 ? -29.684 -49.713 -41.472 1.00 76.78 ? 122 ASN D OD1 1 ATOM 5540 N ND2 . ASN D 4 120 ? -31.330 -48.181 -41.590 1.00 77.15 ? 122 ASN D ND2 1 ATOM 5541 N N . VAL D 4 121 ? -33.005 -50.275 -46.039 1.00 76.81 ? 123 VAL D N 1 ATOM 5542 C CA . VAL D 4 121 ? -33.069 -50.870 -47.375 1.00 76.74 ? 123 VAL D CA 1 ATOM 5543 C C . VAL D 4 121 ? -33.852 -50.015 -48.365 1.00 76.96 ? 123 VAL D C 1 ATOM 5544 O O . VAL D 4 121 ? -35.043 -49.777 -48.183 1.00 76.92 ? 123 VAL D O 1 ATOM 5545 C CB . VAL D 4 121 ? -33.671 -52.289 -47.315 1.00 76.65 ? 123 VAL D CB 1 ATOM 5546 C CG1 . VAL D 4 121 ? -33.924 -52.834 -48.709 1.00 76.66 ? 123 VAL D CG1 1 ATOM 5547 C CG2 . VAL D 4 121 ? -32.751 -53.223 -46.544 1.00 76.53 ? 123 VAL D CG2 1 ATOM 5548 N N . PHE D 4 122 ? -33.178 -49.573 -49.425 1.00 77.40 ? 124 PHE D N 1 ATOM 5549 C CA . PHE D 4 122 ? -33.804 -48.711 -50.428 1.00 77.86 ? 124 PHE D CA 1 ATOM 5550 C C . PHE D 4 122 ? -33.536 -49.133 -51.868 1.00 77.92 ? 124 PHE D C 1 ATOM 5551 O O . PHE D 4 122 ? -32.446 -49.614 -52.173 1.00 77.88 ? 124 PHE D O 1 ATOM 5552 C CB . PHE D 4 122 ? -33.397 -47.251 -50.209 1.00 78.08 ? 124 PHE D CB 1 ATOM 5553 C CG . PHE D 4 122 ? -33.957 -46.665 -48.950 1.00 79.06 ? 124 PHE D CG 1 ATOM 5554 C CD1 . PHE D 4 122 ? -35.277 -46.214 -48.904 1.00 79.91 ? 124 PHE D CD1 1 ATOM 5555 C CD2 . PHE D 4 122 ? -33.179 -46.593 -47.797 1.00 80.01 ? 124 PHE D CD2 1 ATOM 5556 C CE1 . PHE D 4 122 ? -35.812 -45.689 -47.729 1.00 80.69 ? 124 PHE D CE1 1 ATOM 5557 C CE2 . PHE D 4 122 ? -33.699 -46.067 -46.615 1.00 80.67 ? 124 PHE D CE2 1 ATOM 5558 C CZ . PHE D 4 122 ? -35.022 -45.614 -46.580 1.00 80.93 ? 124 PHE D CZ 1 ATOM 5559 N N . PRO D 4 123 ? -34.549 -48.969 -52.746 1.00 78.12 ? 125 PRO D N 1 ATOM 5560 C CA . PRO D 4 123 ? -34.477 -49.172 -54.192 1.00 78.43 ? 125 PRO D CA 1 ATOM 5561 C C . PRO D 4 123 ? -33.685 -48.064 -54.887 1.00 78.85 ? 125 PRO D C 1 ATOM 5562 O O . PRO D 4 123 ? -33.480 -47.007 -54.295 1.00 78.89 ? 125 PRO D O 1 ATOM 5563 C CB . PRO D 4 123 ? -35.948 -49.096 -54.628 1.00 78.34 ? 125 PRO D CB 1 ATOM 5564 C CG . PRO D 4 123 ? -36.735 -49.333 -53.410 1.00 78.13 ? 125 PRO D CG 1 ATOM 5565 C CD . PRO D 4 123 ? -35.935 -48.709 -52.323 1.00 78.16 ? 125 PRO D CD 1 ATOM 5566 N N . PRO D 4 124 ? -33.243 -48.300 -56.138 1.00 79.31 ? 126 PRO D N 1 ATOM 5567 C CA . PRO D 4 124 ? -32.532 -47.266 -56.876 1.00 79.77 ? 126 PRO D CA 1 ATOM 5568 C C . PRO D 4 124 ? -33.468 -46.309 -57.593 1.00 80.33 ? 126 PRO D C 1 ATOM 5569 O O . PRO D 4 124 ? -34.578 -46.686 -57.967 1.00 80.28 ? 126 PRO D O 1 ATOM 5570 C CB . PRO D 4 124 ? -31.742 -48.068 -57.907 1.00 79.73 ? 126 PRO D CB 1 ATOM 5571 C CG . PRO D 4 124 ? -32.585 -49.247 -58.181 1.00 79.47 ? 126 PRO D CG 1 ATOM 5572 C CD . PRO D 4 124 ? -33.300 -49.565 -56.896 1.00 79.37 ? 126 PRO D CD 1 ATOM 5573 N N . GLU D 4 125 ? -33.012 -45.078 -57.785 1.00 81.20 ? 127 GLU D N 1 ATOM 5574 C CA . GLU D 4 125 ? -33.721 -44.128 -58.627 1.00 82.25 ? 127 GLU D CA 1 ATOM 5575 C C . GLU D 4 125 ? -32.981 -43.951 -59.953 1.00 82.86 ? 127 GLU D C 1 ATOM 5576 O O . GLU D 4 125 ? -31.845 -43.467 -59.994 1.00 82.98 ? 127 GLU D O 1 ATOM 5577 C CB . GLU D 4 125 ? -33.898 -42.791 -57.912 1.00 82.35 ? 127 GLU D CB 1 ATOM 5578 C CG . GLU D 4 125 ? -35.058 -42.752 -56.938 1.00 82.79 ? 127 GLU D CG 1 ATOM 5579 C CD . GLU D 4 125 ? -35.462 -41.331 -56.605 1.00 83.67 ? 127 GLU D CD 1 ATOM 5580 O OE1 . GLU D 4 125 ? -34.947 -40.786 -55.606 1.00 84.04 ? 127 GLU D OE1 1 ATOM 5581 O OE2 . GLU D 4 125 ? -36.274 -40.746 -57.356 1.00 84.04 ? 127 GLU D OE2 1 ATOM 5582 N N . VAL D 4 126 ? -33.642 -44.345 -61.035 1.00 83.63 ? 128 VAL D N 1 ATOM 5583 C CA . VAL D 4 126 ? -33.001 -44.423 -62.340 1.00 84.41 ? 128 VAL D CA 1 ATOM 5584 C C . VAL D 4 126 ? -33.369 -43.231 -63.218 1.00 85.04 ? 128 VAL D C 1 ATOM 5585 O O . VAL D 4 126 ? -34.546 -43.000 -63.514 1.00 85.04 ? 128 VAL D O 1 ATOM 5586 C CB . VAL D 4 126 ? -33.344 -45.758 -63.043 1.00 84.34 ? 128 VAL D CB 1 ATOM 5587 C CG1 . VAL D 4 126 ? -32.627 -45.874 -64.372 1.00 84.25 ? 128 VAL D CG1 1 ATOM 5588 C CG2 . VAL D 4 126 ? -32.971 -46.924 -62.147 1.00 84.36 ? 128 VAL D CG2 1 ATOM 5589 N N . ALA D 4 127 ? -32.345 -42.477 -63.616 1.00 85.88 ? 129 ALA D N 1 ATOM 5590 C CA . ALA D 4 127 ? -32.503 -41.354 -64.542 1.00 86.68 ? 129 ALA D CA 1 ATOM 5591 C C . ALA D 4 127 ? -31.552 -41.456 -65.746 1.00 87.15 ? 129 ALA D C 1 ATOM 5592 O O . ALA D 4 127 ? -30.328 -41.423 -65.596 1.00 87.07 ? 129 ALA D O 1 ATOM 5593 C CB . ALA D 4 127 ? -32.326 -40.021 -63.807 1.00 86.68 ? 129 ALA D CB 1 ATOM 5594 N N . VAL D 4 128 ? -32.136 -41.586 -66.934 1.00 87.86 ? 130 VAL D N 1 ATOM 5595 C CA . VAL D 4 128 ? -31.378 -41.704 -68.176 1.00 88.50 ? 130 VAL D CA 1 ATOM 5596 C C . VAL D 4 128 ? -31.032 -40.316 -68.723 1.00 88.99 ? 130 VAL D C 1 ATOM 5597 O O . VAL D 4 128 ? -31.919 -39.488 -68.928 1.00 89.11 ? 130 VAL D O 1 ATOM 5598 C CB . VAL D 4 128 ? -32.150 -42.556 -69.230 1.00 88.46 ? 130 VAL D CB 1 ATOM 5599 C CG1 . VAL D 4 128 ? -33.500 -41.910 -69.608 1.00 88.57 ? 130 VAL D CG1 1 ATOM 5600 C CG2 . VAL D 4 128 ? -31.291 -42.815 -70.461 1.00 88.44 ? 130 VAL D CG2 1 ATOM 5601 N N . PHE D 4 129 ? -29.742 -40.072 -68.949 1.00 89.65 ? 131 PHE D N 1 ATOM 5602 C CA . PHE D 4 129 ? -29.261 -38.787 -69.478 1.00 90.31 ? 131 PHE D CA 1 ATOM 5603 C C . PHE D 4 129 ? -29.004 -38.829 -70.994 1.00 90.92 ? 131 PHE D C 1 ATOM 5604 O O . PHE D 4 129 ? -28.558 -39.848 -71.527 1.00 90.96 ? 131 PHE D O 1 ATOM 5605 C CB . PHE D 4 129 ? -27.987 -38.348 -68.749 1.00 90.15 ? 131 PHE D CB 1 ATOM 5606 C CG . PHE D 4 129 ? -28.147 -38.212 -67.257 1.00 89.98 ? 131 PHE D CG 1 ATOM 5607 C CD1 . PHE D 4 129 ? -27.848 -39.271 -66.410 1.00 89.94 ? 131 PHE D CD1 1 ATOM 5608 C CD2 . PHE D 4 129 ? -28.580 -37.023 -66.694 1.00 89.76 ? 131 PHE D CD2 1 ATOM 5609 C CE1 . PHE D 4 129 ? -27.989 -39.144 -65.026 1.00 89.38 ? 131 PHE D CE1 1 ATOM 5610 C CE2 . PHE D 4 129 ? -28.719 -36.888 -65.314 1.00 89.34 ? 131 PHE D CE2 1 ATOM 5611 C CZ . PHE D 4 129 ? -28.423 -37.951 -64.482 1.00 89.05 ? 131 PHE D CZ 1 ATOM 5612 N N . GLU D 4 130 ? -29.282 -37.717 -71.675 1.00 91.71 ? 132 GLU D N 1 ATOM 5613 C CA . GLU D 4 130 ? -29.123 -37.626 -73.132 1.00 92.46 ? 132 GLU D CA 1 ATOM 5614 C C . GLU D 4 130 ? -27.737 -37.111 -73.539 1.00 92.76 ? 132 GLU D C 1 ATOM 5615 O O . GLU D 4 130 ? -27.070 -36.424 -72.751 1.00 92.62 ? 132 GLU D O 1 ATOM 5616 C CB . GLU D 4 130 ? -30.249 -36.788 -73.756 1.00 92.58 ? 132 GLU D CB 1 ATOM 5617 C CG . GLU D 4 130 ? -31.559 -37.566 -73.911 1.00 93.57 ? 132 GLU D CG 1 ATOM 5618 C CD . GLU D 4 130 ? -32.640 -36.808 -74.674 1.00 94.91 ? 132 GLU D CD 1 ATOM 5619 O OE1 . GLU D 4 130 ? -33.820 -36.883 -74.253 1.00 95.31 ? 132 GLU D OE1 1 ATOM 5620 O OE2 . GLU D 4 130 ? -32.319 -36.152 -75.696 1.00 95.53 ? 132 GLU D OE2 1 ATOM 5621 N N . PRO D 4 131 ? -27.295 -37.453 -74.767 1.00 93.23 ? 133 PRO D N 1 ATOM 5622 C CA . PRO D 4 131 ? -25.942 -37.098 -75.215 1.00 93.72 ? 133 PRO D CA 1 ATOM 5623 C C . PRO D 4 131 ? -25.765 -35.601 -75.501 1.00 94.21 ? 133 PRO D C 1 ATOM 5624 O O . PRO D 4 131 ? -26.659 -34.974 -76.084 1.00 94.34 ? 133 PRO D O 1 ATOM 5625 C CB . PRO D 4 131 ? -25.770 -37.922 -76.497 1.00 93.73 ? 133 PRO D CB 1 ATOM 5626 C CG . PRO D 4 131 ? -27.154 -38.148 -76.991 1.00 93.50 ? 133 PRO D CG 1 ATOM 5627 C CD . PRO D 4 131 ? -28.030 -38.232 -75.783 1.00 93.18 ? 133 PRO D CD 1 ATOM 5628 N N . SER D 4 132 ? -24.622 -35.048 -75.083 1.00 94.60 ? 134 SER D N 1 ATOM 5629 C CA . SER D 4 132 ? -24.292 -33.634 -75.297 1.00 94.98 ? 134 SER D CA 1 ATOM 5630 C C . SER D 4 132 ? -24.003 -33.354 -76.774 1.00 95.23 ? 134 SER D C 1 ATOM 5631 O O . SER D 4 132 ? -23.169 -34.031 -77.385 1.00 95.23 ? 134 SER D O 1 ATOM 5632 C CB . SER D 4 132 ? -23.096 -33.232 -74.438 1.00 94.91 ? 134 SER D CB 1 ATOM 5633 O OG . SER D 4 132 ? -22.807 -31.851 -74.560 1.00 95.07 ? 134 SER D OG 1 ATOM 5634 N N . GLU D 4 133 ? -24.687 -32.348 -77.329 1.00 95.49 ? 135 GLU D N 1 ATOM 5635 C CA . GLU D 4 133 ? -24.689 -32.096 -78.777 1.00 95.68 ? 135 GLU D CA 1 ATOM 5636 C C . GLU D 4 133 ? -23.304 -31.770 -79.329 1.00 95.63 ? 135 GLU D C 1 ATOM 5637 O O . GLU D 4 133 ? -23.033 -31.989 -80.514 1.00 95.56 ? 135 GLU D O 1 ATOM 5638 C CB . GLU D 4 133 ? -25.688 -30.999 -79.156 1.00 95.75 ? 135 GLU D CB 1 ATOM 5639 C CG . GLU D 4 133 ? -26.369 -31.252 -80.499 1.00 96.37 ? 135 GLU D CG 1 ATOM 5640 C CD . GLU D 4 133 ? -26.465 -30.006 -81.365 1.00 97.40 ? 135 GLU D CD 1 ATOM 5641 O OE1 . GLU D 4 133 ? -25.409 -29.426 -81.710 1.00 97.91 ? 135 GLU D OE1 1 ATOM 5642 O OE2 . GLU D 4 133 ? -27.599 -29.617 -81.717 1.00 97.50 ? 135 GLU D OE2 1 ATOM 5643 N N . ALA D 4 134 ? -22.443 -31.250 -78.454 1.00 95.67 ? 136 ALA D N 1 ATOM 5644 C CA . ALA D 4 134 ? -21.050 -30.953 -78.779 1.00 95.74 ? 136 ALA D CA 1 ATOM 5645 C C . ALA D 4 134 ? -20.284 -32.214 -79.197 1.00 95.73 ? 136 ALA D C 1 ATOM 5646 O O . ALA D 4 134 ? -19.338 -32.142 -79.989 1.00 95.75 ? 136 ALA D O 1 ATOM 5647 C CB . ALA D 4 134 ? -20.367 -30.274 -77.595 1.00 95.74 ? 136 ALA D CB 1 ATOM 5648 N N . GLU D 4 135 ? -20.713 -33.357 -78.662 1.00 95.65 ? 137 GLU D N 1 ATOM 5649 C CA . GLU D 4 135 ? -20.124 -34.657 -78.970 1.00 95.51 ? 137 GLU D CA 1 ATOM 5650 C C . GLU D 4 135 ? -20.414 -35.066 -80.413 1.00 95.39 ? 137 GLU D C 1 ATOM 5651 O O . GLU D 4 135 ? -19.552 -35.627 -81.086 1.00 95.44 ? 137 GLU D O 1 ATOM 5652 C CB . GLU D 4 135 ? -20.648 -35.713 -77.988 1.00 95.49 ? 137 GLU D CB 1 ATOM 5653 C CG . GLU D 4 135 ? -19.865 -37.023 -77.961 1.00 95.75 ? 137 GLU D CG 1 ATOM 5654 C CD . GLU D 4 135 ? -20.591 -38.152 -77.226 1.00 96.02 ? 137 GLU D CD 1 ATOM 5655 O OE1 . GLU D 4 135 ? -20.062 -39.284 -77.206 1.00 96.03 ? 137 GLU D OE1 1 ATOM 5656 O OE2 . GLU D 4 135 ? -21.689 -37.921 -76.671 1.00 96.11 ? 137 GLU D OE2 1 ATOM 5657 N N . ILE D 4 136 ? -21.623 -34.759 -80.878 1.00 95.21 ? 138 ILE D N 1 ATOM 5658 C CA . ILE D 4 136 ? -22.108 -35.195 -82.194 1.00 95.11 ? 138 ILE D CA 1 ATOM 5659 C C . ILE D 4 136 ? -21.308 -34.594 -83.364 1.00 94.95 ? 138 ILE D C 1 ATOM 5660 O O . ILE D 4 136 ? -20.879 -35.316 -84.269 1.00 94.91 ? 138 ILE D O 1 ATOM 5661 C CB . ILE D 4 136 ? -23.645 -34.938 -82.350 1.00 95.18 ? 138 ILE D CB 1 ATOM 5662 C CG1 . ILE D 4 136 ? -24.456 -35.938 -81.511 1.00 94.96 ? 138 ILE D CG1 1 ATOM 5663 C CG2 . ILE D 4 136 ? -24.086 -35.020 -83.815 1.00 95.34 ? 138 ILE D CG2 1 ATOM 5664 C CD1 . ILE D 4 136 ? -24.677 -35.536 -80.061 1.00 94.39 ? 138 ILE D CD1 1 ATOM 5665 N N . SER D 4 137 ? -21.112 -33.278 -83.332 1.00 94.69 ? 139 SER D N 1 ATOM 5666 C CA . SER D 4 137 ? -20.310 -32.584 -84.336 1.00 94.42 ? 139 SER D CA 1 ATOM 5667 C C . SER D 4 137 ? -18.837 -32.965 -84.202 1.00 94.23 ? 139 SER D C 1 ATOM 5668 O O . SER D 4 137 ? -18.134 -33.125 -85.202 1.00 94.29 ? 139 SER D O 1 ATOM 5669 C CB . SER D 4 137 ? -20.460 -31.069 -84.185 1.00 94.45 ? 139 SER D CB 1 ATOM 5670 O OG . SER D 4 137 ? -21.796 -30.715 -83.880 1.00 94.56 ? 139 SER D OG 1 ATOM 5671 N N . HIS D 4 138 ? -18.391 -33.116 -82.954 1.00 93.86 ? 140 HIS D N 1 ATOM 5672 C CA . HIS D 4 138 ? -16.994 -33.399 -82.627 1.00 93.42 ? 140 HIS D CA 1 ATOM 5673 C C . HIS D 4 138 ? -16.575 -34.835 -82.960 1.00 93.13 ? 140 HIS D C 1 ATOM 5674 O O . HIS D 4 138 ? -15.588 -35.052 -83.671 1.00 93.13 ? 140 HIS D O 1 ATOM 5675 C CB . HIS D 4 138 ? -16.744 -33.120 -81.142 1.00 93.31 ? 140 HIS D CB 1 ATOM 5676 C CG . HIS D 4 138 ? -15.297 -33.082 -80.766 1.00 93.37 ? 140 HIS D CG 1 ATOM 5677 N ND1 . HIS D 4 138 ? -14.719 -31.993 -80.149 1.00 93.41 ? 140 HIS D ND1 1 ATOM 5678 C CD2 . HIS D 4 138 ? -14.309 -33.997 -80.917 1.00 93.48 ? 140 HIS D CD2 1 ATOM 5679 C CE1 . HIS D 4 138 ? -13.439 -32.240 -79.935 1.00 93.35 ? 140 HIS D CE1 1 ATOM 5680 N NE2 . HIS D 4 138 ? -13.164 -33.448 -80.393 1.00 93.44 ? 140 HIS D NE2 1 ATOM 5681 N N . THR D 4 139 ? -17.280 -35.817 -82.395 1.00 92.67 ? 141 THR D N 1 ATOM 5682 C CA . THR D 4 139 ? -16.908 -37.229 -82.560 1.00 92.08 ? 141 THR D CA 1 ATOM 5683 C C . THR D 4 139 ? -17.795 -38.083 -83.483 1.00 91.78 ? 141 THR D C 1 ATOM 5684 O O . THR D 4 139 ? -17.398 -39.174 -83.893 1.00 91.78 ? 141 THR D O 1 ATOM 5685 C CB . THR D 4 139 ? -16.802 -37.939 -81.193 1.00 92.07 ? 141 THR D CB 1 ATOM 5686 O OG1 . THR D 4 139 ? -18.115 -38.232 -80.701 1.00 91.73 ? 141 THR D OG1 1 ATOM 5687 C CG2 . THR D 4 139 ? -16.073 -37.058 -80.191 1.00 91.83 ? 141 THR D CG2 1 ATOM 5688 N N . GLN D 4 140 ? -18.986 -37.588 -83.802 1.00 91.28 ? 142 GLN D N 1 ATOM 5689 C CA . GLN D 4 140 ? -19.950 -38.309 -84.660 1.00 90.84 ? 142 GLN D CA 1 ATOM 5690 C C . GLN D 4 140 ? -20.554 -39.544 -83.978 1.00 90.29 ? 142 GLN D C 1 ATOM 5691 O O . GLN D 4 140 ? -21.241 -40.351 -84.615 1.00 90.16 ? 142 GLN D O 1 ATOM 5692 C CB . GLN D 4 140 ? -19.359 -38.655 -86.042 1.00 91.03 ? 142 GLN D CB 1 ATOM 5693 C CG . GLN D 4 140 ? -19.347 -37.493 -87.036 1.00 91.39 ? 142 GLN D CG 1 ATOM 5694 C CD . GLN D 4 140 ? -20.738 -36.919 -87.307 1.00 92.21 ? 142 GLN D CD 1 ATOM 5695 O OE1 . GLN D 4 140 ? -20.915 -35.700 -87.335 1.00 92.68 ? 142 GLN D OE1 1 ATOM 5696 N NE2 . GLN D 4 140 ? -21.729 -37.793 -87.500 1.00 92.13 ? 142 GLN D NE2 1 ATOM 5697 N N . LYS D 4 141 ? -20.299 -39.662 -82.676 1.00 89.66 ? 143 LYS D N 1 ATOM 5698 C CA . LYS D 4 141 ? -20.800 -40.756 -81.843 1.00 89.02 ? 143 LYS D CA 1 ATOM 5699 C C . LYS D 4 141 ? -21.599 -40.172 -80.679 1.00 88.25 ? 143 LYS D C 1 ATOM 5700 O O . LYS D 4 141 ? -21.345 -39.044 -80.255 1.00 88.13 ? 143 LYS D O 1 ATOM 5701 C CB . LYS D 4 141 ? -19.633 -41.602 -81.304 1.00 89.22 ? 143 LYS D CB 1 ATOM 5702 C CG . LYS D 4 141 ? -18.871 -42.419 -82.360 1.00 89.69 ? 143 LYS D CG 1 ATOM 5703 C CD . LYS D 4 141 ? -17.543 -42.954 -81.810 1.00 90.35 ? 143 LYS D CD 1 ATOM 5704 C CE . LYS D 4 141 ? -16.612 -43.452 -82.919 1.00 90.54 ? 143 LYS D CE 1 ATOM 5705 N NZ . LYS D 4 141 ? -17.137 -44.671 -83.606 1.00 90.83 ? 143 LYS D NZ 1 ATOM 5706 N N . ALA D 4 142 ? -22.549 -40.947 -80.159 1.00 87.32 ? 144 ALA D N 1 ATOM 5707 C CA . ALA D 4 142 ? -23.423 -40.482 -79.081 1.00 86.45 ? 144 ALA D CA 1 ATOM 5708 C C . ALA D 4 142 ? -23.439 -41.395 -77.855 1.00 85.79 ? 144 ALA D C 1 ATOM 5709 O O . ALA D 4 142 ? -23.876 -42.546 -77.932 1.00 85.59 ? 144 ALA D O 1 ATOM 5710 C CB . ALA D 4 142 ? -24.835 -40.276 -79.606 1.00 86.58 ? 144 ALA D CB 1 ATOM 5711 N N . THR D 4 143 ? -22.969 -40.861 -76.729 1.00 85.00 ? 145 THR D N 1 ATOM 5712 C CA . THR D 4 143 ? -22.965 -41.574 -75.447 1.00 84.28 ? 145 THR D CA 1 ATOM 5713 C C . THR D 4 143 ? -24.193 -41.228 -74.619 1.00 83.63 ? 145 THR D C 1 ATOM 5714 O O . THR D 4 143 ? -24.409 -40.063 -74.290 1.00 83.62 ? 145 THR D O 1 ATOM 5715 C CB . THR D 4 143 ? -21.747 -41.187 -74.570 1.00 84.34 ? 145 THR D CB 1 ATOM 5716 O OG1 . THR D 4 143 ? -21.485 -39.787 -74.711 1.00 84.52 ? 145 THR D OG1 1 ATOM 5717 C CG2 . THR D 4 143 ? -20.504 -41.967 -74.941 1.00 84.28 ? 145 THR D CG2 1 ATOM 5718 N N . LEU D 4 144 ? -24.992 -42.235 -74.282 1.00 82.76 ? 146 LEU D N 1 ATOM 5719 C CA . LEU D 4 144 ? -26.005 -42.084 -73.245 1.00 81.94 ? 146 LEU D CA 1 ATOM 5720 C C . LEU D 4 144 ? -25.355 -42.423 -71.909 1.00 81.53 ? 146 LEU D C 1 ATOM 5721 O O . LEU D 4 144 ? -24.423 -43.228 -71.860 1.00 81.59 ? 146 LEU D O 1 ATOM 5722 C CB . LEU D 4 144 ? -27.204 -43.004 -73.492 1.00 81.88 ? 146 LEU D CB 1 ATOM 5723 C CG . LEU D 4 144 ? -28.241 -42.653 -74.566 1.00 81.83 ? 146 LEU D CG 1 ATOM 5724 C CD1 . LEU D 4 144 ? -27.938 -43.378 -75.862 1.00 81.89 ? 146 LEU D CD1 1 ATOM 5725 C CD2 . LEU D 4 144 ? -29.649 -43.005 -74.104 1.00 81.79 ? 146 LEU D CD2 1 ATOM 5726 N N . VAL D 4 145 ? -25.832 -41.801 -70.832 1.00 80.90 ? 147 VAL D N 1 ATOM 5727 C CA . VAL D 4 145 ? -25.365 -42.120 -69.481 1.00 80.31 ? 147 VAL D CA 1 ATOM 5728 C C . VAL D 4 145 ? -26.546 -42.451 -68.563 1.00 80.18 ? 147 VAL D C 1 ATOM 5729 O O . VAL D 4 145 ? -27.512 -41.692 -68.492 1.00 80.14 ? 147 VAL D O 1 ATOM 5730 C CB . VAL D 4 145 ? -24.536 -40.971 -68.876 1.00 80.19 ? 147 VAL D CB 1 ATOM 5731 C CG1 . VAL D 4 145 ? -23.999 -41.350 -67.501 1.00 80.02 ? 147 VAL D CG1 1 ATOM 5732 C CG2 . VAL D 4 145 ? -23.394 -40.598 -69.799 1.00 80.12 ? 147 VAL D CG2 1 ATOM 5733 N N . CYS D 4 146 ? -26.466 -43.592 -67.878 1.00 79.97 ? 148 CYS D N 1 ATOM 5734 C CA . CYS D 4 146 ? -27.486 -43.997 -66.911 1.00 79.73 ? 148 CYS D CA 1 ATOM 5735 C C . CYS D 4 146 ? -26.997 -43.846 -65.479 1.00 79.27 ? 148 CYS D C 1 ATOM 5736 O O . CYS D 4 146 ? -25.804 -43.966 -65.203 1.00 79.25 ? 148 CYS D O 1 ATOM 5737 C CB . CYS D 4 146 ? -27.911 -45.442 -67.139 1.00 79.96 ? 148 CYS D CB 1 ATOM 5738 S SG . CYS D 4 146 ? -29.373 -45.926 -66.224 1.00 81.03 ? 148 CYS D SG 1 ATOM 5739 N N . LEU D 4 147 ? -27.936 -43.592 -64.573 1.00 78.78 ? 149 LEU D N 1 ATOM 5740 C CA . LEU D 4 147 ? -27.628 -43.428 -63.159 1.00 78.30 ? 149 LEU D CA 1 ATOM 5741 C C . LEU D 4 147 ? -28.711 -43.972 -62.251 1.00 77.96 ? 149 LEU D C 1 ATOM 5742 O O . LEU D 4 147 ? -29.808 -43.412 -62.155 1.00 77.97 ? 149 LEU D O 1 ATOM 5743 C CB . LEU D 4 147 ? -27.366 -41.961 -62.810 1.00 78.33 ? 149 LEU D CB 1 ATOM 5744 C CG . LEU D 4 147 ? -25.992 -41.613 -62.230 1.00 78.61 ? 149 LEU D CG 1 ATOM 5745 C CD1 . LEU D 4 147 ? -25.879 -40.120 -61.968 1.00 78.87 ? 149 LEU D CD1 1 ATOM 5746 C CD2 . LEU D 4 147 ? -25.737 -42.384 -60.944 1.00 78.89 ? 149 LEU D CD2 1 ATOM 5747 N N . ALA D 4 148 ? -28.385 -45.078 -61.596 1.00 77.55 ? 150 ALA D N 1 ATOM 5748 C CA . ALA D 4 148 ? -29.173 -45.584 -60.489 1.00 77.08 ? 150 ALA D CA 1 ATOM 5749 C C . ALA D 4 148 ? -28.536 -45.038 -59.226 1.00 76.75 ? 150 ALA D C 1 ATOM 5750 O O . ALA D 4 148 ? -27.314 -45.100 -59.048 1.00 76.52 ? 150 ALA D O 1 ATOM 5751 C CB . ALA D 4 148 ? -29.185 -47.096 -60.478 1.00 77.17 ? 150 ALA D CB 1 ATOM 5752 N N . THR D 4 149 ? -29.373 -44.486 -58.358 1.00 76.49 ? 151 THR D N 1 ATOM 5753 C CA . THR D 4 149 ? -28.885 -43.774 -57.189 1.00 76.28 ? 151 THR D CA 1 ATOM 5754 C C . THR D 4 149 ? -29.766 -43.968 -55.954 1.00 76.04 ? 151 THR D C 1 ATOM 5755 O O . THR D 4 149 ? -30.993 -44.091 -56.060 1.00 75.98 ? 151 THR D O 1 ATOM 5756 C CB . THR D 4 149 ? -28.669 -42.263 -57.496 1.00 76.33 ? 151 THR D CB 1 ATOM 5757 O OG1 . THR D 4 149 ? -28.280 -41.578 -56.299 1.00 76.46 ? 151 THR D OG1 1 ATOM 5758 C CG2 . THR D 4 149 ? -29.935 -41.615 -58.089 1.00 76.14 ? 151 THR D CG2 1 ATOM 5759 N N . GLY D 4 150 ? -29.110 -44.015 -54.794 1.00 75.75 ? 152 GLY D N 1 ATOM 5760 C CA . GLY D 4 150 ? -29.775 -44.119 -53.497 1.00 75.43 ? 152 GLY D CA 1 ATOM 5761 C C . GLY D 4 150 ? -30.333 -45.493 -53.181 1.00 75.15 ? 152 GLY D C 1 ATOM 5762 O O . GLY D 4 150 ? -31.476 -45.618 -52.738 1.00 75.14 ? 152 GLY D O 1 ATOM 5763 N N . PHE D 4 151 ? -29.525 -46.527 -53.395 1.00 74.81 ? 153 PHE D N 1 ATOM 5764 C CA . PHE D 4 151 ? -29.957 -47.895 -53.119 1.00 74.50 ? 153 PHE D CA 1 ATOM 5765 C C . PHE D 4 151 ? -29.056 -48.584 -52.104 1.00 74.30 ? 153 PHE D C 1 ATOM 5766 O O . PHE D 4 151 ? -27.855 -48.317 -52.051 1.00 74.34 ? 153 PHE D O 1 ATOM 5767 C CB . PHE D 4 151 ? -30.039 -48.720 -54.411 1.00 74.47 ? 153 PHE D CB 1 ATOM 5768 C CG . PHE D 4 151 ? -28.786 -48.684 -55.240 1.00 74.31 ? 153 PHE D CG 1 ATOM 5769 C CD1 . PHE D 4 151 ? -27.777 -49.620 -55.040 1.00 74.45 ? 153 PHE D CD1 1 ATOM 5770 C CD2 . PHE D 4 151 ? -28.617 -47.716 -56.223 1.00 73.98 ? 153 PHE D CD2 1 ATOM 5771 C CE1 . PHE D 4 151 ? -26.619 -49.591 -55.799 1.00 74.34 ? 153 PHE D CE1 1 ATOM 5772 C CE2 . PHE D 4 151 ? -27.470 -47.678 -56.987 1.00 74.06 ? 153 PHE D CE2 1 ATOM 5773 C CZ . PHE D 4 151 ? -26.465 -48.617 -56.775 1.00 74.56 ? 153 PHE D CZ 1 ATOM 5774 N N . TYR D 4 152 ? -29.647 -49.464 -51.298 1.00 73.97 ? 154 TYR D N 1 ATOM 5775 C CA . TYR D 4 152 ? -28.891 -50.287 -50.353 1.00 73.69 ? 154 TYR D CA 1 ATOM 5776 C C . TYR D 4 152 ? -29.638 -51.596 -50.112 1.00 73.43 ? 154 TYR D C 1 ATOM 5777 O O . TYR D 4 152 ? -30.856 -51.568 -49.929 1.00 73.41 ? 154 TYR D O 1 ATOM 5778 C CB . TYR D 4 152 ? -28.662 -49.537 -49.036 1.00 73.64 ? 154 TYR D CB 1 ATOM 5779 C CG . TYR D 4 152 ? -28.020 -50.364 -47.949 1.00 73.52 ? 154 TYR D CG 1 ATOM 5780 C CD1 . TYR D 4 152 ? -26.659 -50.636 -47.967 1.00 73.89 ? 154 TYR D CD1 1 ATOM 5781 C CD2 . TYR D 4 152 ? -28.777 -50.867 -46.897 1.00 73.77 ? 154 TYR D CD2 1 ATOM 5782 C CE1 . TYR D 4 152 ? -26.068 -51.403 -46.969 1.00 74.30 ? 154 TYR D CE1 1 ATOM 5783 C CE2 . TYR D 4 152 ? -28.201 -51.624 -45.893 1.00 73.97 ? 154 TYR D CE2 1 ATOM 5784 C CZ . TYR D 4 152 ? -26.850 -51.892 -45.935 1.00 74.31 ? 154 TYR D CZ 1 ATOM 5785 O OH . TYR D 4 152 ? -26.287 -52.647 -44.933 1.00 74.88 ? 154 TYR D OH 1 ATOM 5786 N N . PRO D 4 153 ? -28.923 -52.746 -50.135 1.00 73.16 ? 155 PRO D N 1 ATOM 5787 C CA . PRO D 4 153 ? -27.486 -52.928 -50.399 1.00 72.94 ? 155 PRO D CA 1 ATOM 5788 C C . PRO D 4 153 ? -27.164 -53.032 -51.892 1.00 72.64 ? 155 PRO D C 1 ATOM 5789 O O . PRO D 4 153 ? -28.088 -53.057 -52.708 1.00 72.59 ? 155 PRO D O 1 ATOM 5790 C CB . PRO D 4 153 ? -27.179 -54.250 -49.698 1.00 73.07 ? 155 PRO D CB 1 ATOM 5791 C CG . PRO D 4 153 ? -28.469 -55.028 -49.778 1.00 73.11 ? 155 PRO D CG 1 ATOM 5792 C CD . PRO D 4 153 ? -29.600 -54.038 -49.899 1.00 73.07 ? 155 PRO D CD 1 ATOM 5793 N N . ASP D 4 154 ? -25.878 -53.106 -52.245 1.00 72.35 ? 156 ASP D N 1 ATOM 5794 C CA . ASP D 4 154 ? -25.469 -53.154 -53.657 1.00 72.10 ? 156 ASP D CA 1 ATOM 5795 C C . ASP D 4 154 ? -25.875 -54.465 -54.328 1.00 71.71 ? 156 ASP D C 1 ATOM 5796 O O . ASP D 4 154 ? -25.043 -55.204 -54.856 1.00 71.78 ? 156 ASP D O 1 ATOM 5797 C CB . ASP D 4 154 ? -23.972 -52.839 -53.839 1.00 72.32 ? 156 ASP D CB 1 ATOM 5798 C CG . ASP D 4 154 ? -23.060 -53.980 -53.412 1.00 73.09 ? 156 ASP D CG 1 ATOM 5799 O OD1 . ASP D 4 154 ? -23.231 -54.527 -52.299 1.00 73.89 ? 156 ASP D OD1 1 ATOM 5800 O OD2 . ASP D 4 154 ? -22.157 -54.321 -54.207 1.00 74.34 ? 156 ASP D OD2 1 ATOM 5801 N N . HIS D 4 155 ? -27.178 -54.730 -54.294 1.00 71.20 ? 157 HIS D N 1 ATOM 5802 C CA . HIS D 4 155 ? -27.772 -55.924 -54.870 1.00 70.75 ? 157 HIS D CA 1 ATOM 5803 C C . HIS D 4 155 ? -28.562 -55.518 -56.105 1.00 70.53 ? 157 HIS D C 1 ATOM 5804 O O . HIS D 4 155 ? -29.792 -55.412 -56.070 1.00 70.65 ? 157 HIS D O 1 ATOM 5805 C CB . HIS D 4 155 ? -28.657 -56.613 -53.832 1.00 70.67 ? 157 HIS D CB 1 ATOM 5806 C CG . HIS D 4 155 ? -27.887 -57.257 -52.719 1.00 70.64 ? 157 HIS D CG 1 ATOM 5807 N ND1 . HIS D 4 155 ? -28.450 -58.174 -51.860 1.00 70.79 ? 157 HIS D ND1 1 ATOM 5808 C CD2 . HIS D 4 155 ? -26.593 -57.132 -52.339 1.00 70.35 ? 157 HIS D CD2 1 ATOM 5809 C CE1 . HIS D 4 155 ? -27.539 -58.580 -50.992 1.00 70.44 ? 157 HIS D CE1 1 ATOM 5810 N NE2 . HIS D 4 155 ? -26.403 -57.965 -51.263 1.00 70.29 ? 157 HIS D NE2 1 ATOM 5811 N N . VAL D 4 156 ? -27.832 -55.292 -57.197 1.00 70.16 ? 158 VAL D N 1 ATOM 5812 C CA . VAL D 4 156 ? -28.373 -54.655 -58.396 1.00 69.58 ? 158 VAL D CA 1 ATOM 5813 C C . VAL D 4 156 ? -27.871 -55.284 -59.686 1.00 69.27 ? 158 VAL D C 1 ATOM 5814 O O . VAL D 4 156 ? -26.752 -55.795 -59.746 1.00 69.20 ? 158 VAL D O 1 ATOM 5815 C CB . VAL D 4 156 ? -28.010 -53.161 -58.432 1.00 69.62 ? 158 VAL D CB 1 ATOM 5816 C CG1 . VAL D 4 156 ? -29.052 -52.341 -57.692 1.00 69.37 ? 158 VAL D CG1 1 ATOM 5817 C CG2 . VAL D 4 156 ? -26.599 -52.934 -57.866 1.00 69.36 ? 158 VAL D CG2 1 ATOM 5818 N N . GLU D 4 157 ? -28.713 -55.225 -60.714 1.00 68.92 ? 159 GLU D N 1 ATOM 5819 C CA . GLU D 4 157 ? -28.377 -55.709 -62.044 1.00 68.65 ? 159 GLU D CA 1 ATOM 5820 C C . GLU D 4 157 ? -28.865 -54.724 -63.102 1.00 68.76 ? 159 GLU D C 1 ATOM 5821 O O . GLU D 4 157 ? -30.045 -54.725 -63.469 1.00 68.69 ? 159 GLU D O 1 ATOM 5822 C CB . GLU D 4 157 ? -28.984 -57.091 -62.285 1.00 68.47 ? 159 GLU D CB 1 ATOM 5823 C CG . GLU D 4 157 ? -28.324 -58.215 -61.505 1.00 67.94 ? 159 GLU D CG 1 ATOM 5824 C CD . GLU D 4 157 ? -29.056 -59.533 -61.642 1.00 67.57 ? 159 GLU D CD 1 ATOM 5825 O OE1 . GLU D 4 157 ? -30.116 -59.569 -62.302 1.00 67.22 ? 159 GLU D OE1 1 ATOM 5826 O OE2 . GLU D 4 157 ? -28.574 -60.539 -61.081 1.00 67.69 ? 159 GLU D OE2 1 ATOM 5827 N N . LEU D 4 158 ? -27.945 -53.889 -63.583 1.00 68.90 ? 160 LEU D N 1 ATOM 5828 C CA . LEU D 4 158 ? -28.224 -52.904 -64.631 1.00 69.02 ? 160 LEU D CA 1 ATOM 5829 C C . LEU D 4 158 ? -28.056 -53.504 -66.032 1.00 69.23 ? 160 LEU D C 1 ATOM 5830 O O . LEU D 4 158 ? -27.107 -54.241 -66.282 1.00 69.10 ? 160 LEU D O 1 ATOM 5831 C CB . LEU D 4 158 ? -27.278 -51.712 -64.466 1.00 68.91 ? 160 LEU D CB 1 ATOM 5832 C CG . LEU D 4 158 ? -27.609 -50.334 -65.053 1.00 68.79 ? 160 LEU D CG 1 ATOM 5833 C CD1 . LEU D 4 158 ? -26.798 -49.267 -64.335 1.00 68.50 ? 160 LEU D CD1 1 ATOM 5834 C CD2 . LEU D 4 158 ? -27.381 -50.244 -66.556 1.00 68.37 ? 160 LEU D CD2 1 ATOM 5835 N N . SER D 4 159 ? -28.972 -53.179 -66.939 1.00 69.65 ? 161 SER D N 1 ATOM 5836 C CA . SER D 4 159 ? -28.853 -53.579 -68.345 1.00 70.28 ? 161 SER D CA 1 ATOM 5837 C C . SER D 4 159 ? -29.387 -52.479 -69.270 1.00 70.85 ? 161 SER D C 1 ATOM 5838 O O . SER D 4 159 ? -30.249 -51.698 -68.862 1.00 71.15 ? 161 SER D O 1 ATOM 5839 C CB . SER D 4 159 ? -29.601 -54.890 -68.592 1.00 70.13 ? 161 SER D CB 1 ATOM 5840 O OG . SER D 4 159 ? -30.984 -54.748 -68.328 1.00 69.94 ? 161 SER D OG 1 ATOM 5841 N N . TRP D 4 160 ? -28.879 -52.407 -70.502 1.00 71.35 ? 162 TRP D N 1 ATOM 5842 C CA . TRP D 4 160 ? -29.395 -51.441 -71.488 1.00 71.85 ? 162 TRP D CA 1 ATOM 5843 C C . TRP D 4 160 ? -30.256 -52.108 -72.562 1.00 72.42 ? 162 TRP D C 1 ATOM 5844 O O . TRP D 4 160 ? -29.911 -53.174 -73.074 1.00 72.33 ? 162 TRP D O 1 ATOM 5845 C CB . TRP D 4 160 ? -28.261 -50.666 -72.155 1.00 71.68 ? 162 TRP D CB 1 ATOM 5846 C CG . TRP D 4 160 ? -27.531 -49.687 -71.271 1.00 71.13 ? 162 TRP D CG 1 ATOM 5847 C CD1 . TRP D 4 160 ? -26.447 -49.947 -70.480 1.00 70.98 ? 162 TRP D CD1 1 ATOM 5848 C CD2 . TRP D 4 160 ? -27.802 -48.289 -71.125 1.00 70.39 ? 162 TRP D CD2 1 ATOM 5849 N NE1 . TRP D 4 160 ? -26.038 -48.803 -69.839 1.00 70.21 ? 162 TRP D NE1 1 ATOM 5850 C CE2 . TRP D 4 160 ? -26.852 -47.770 -70.217 1.00 70.04 ? 162 TRP D CE2 1 ATOM 5851 C CE3 . TRP D 4 160 ? -28.762 -47.425 -71.663 1.00 70.26 ? 162 TRP D CE3 1 ATOM 5852 C CZ2 . TRP D 4 160 ? -26.830 -46.429 -69.841 1.00 69.73 ? 162 TRP D CZ2 1 ATOM 5853 C CZ3 . TRP D 4 160 ? -28.741 -46.089 -71.284 1.00 70.05 ? 162 TRP D CZ3 1 ATOM 5854 C CH2 . TRP D 4 160 ? -27.781 -45.606 -70.383 1.00 69.79 ? 162 TRP D CH2 1 ATOM 5855 N N . TRP D 4 161 ? -31.365 -51.458 -72.908 1.00 73.28 ? 163 TRP D N 1 ATOM 5856 C CA . TRP D 4 161 ? -32.345 -52.017 -73.835 1.00 74.23 ? 163 TRP D CA 1 ATOM 5857 C C . TRP D 4 161 ? -32.678 -51.041 -74.957 1.00 74.92 ? 163 TRP D C 1 ATOM 5858 O O . TRP D 4 161 ? -33.133 -49.928 -74.698 1.00 75.01 ? 163 TRP D O 1 ATOM 5859 C CB . TRP D 4 161 ? -33.630 -52.394 -73.087 1.00 74.16 ? 163 TRP D CB 1 ATOM 5860 C CG . TRP D 4 161 ? -33.462 -53.506 -72.091 1.00 74.09 ? 163 TRP D CG 1 ATOM 5861 C CD1 . TRP D 4 161 ? -32.890 -53.421 -70.853 1.00 73.62 ? 163 TRP D CD1 1 ATOM 5862 C CD2 . TRP D 4 161 ? -33.884 -54.869 -72.245 1.00 73.98 ? 163 TRP D CD2 1 ATOM 5863 N NE1 . TRP D 4 161 ? -32.919 -54.645 -70.232 1.00 73.51 ? 163 TRP D NE1 1 ATOM 5864 C CE2 . TRP D 4 161 ? -33.525 -55.552 -71.062 1.00 73.57 ? 163 TRP D CE2 1 ATOM 5865 C CE3 . TRP D 4 161 ? -34.523 -55.581 -73.268 1.00 74.15 ? 163 TRP D CE3 1 ATOM 5866 C CZ2 . TRP D 4 161 ? -33.782 -56.911 -70.874 1.00 73.22 ? 163 TRP D CZ2 1 ATOM 5867 C CZ3 . TRP D 4 161 ? -34.776 -56.935 -73.080 1.00 73.96 ? 163 TRP D CZ3 1 ATOM 5868 C CH2 . TRP D 4 161 ? -34.402 -57.583 -71.891 1.00 73.61 ? 163 TRP D CH2 1 ATOM 5869 N N . VAL D 4 162 ? -32.449 -51.459 -76.199 1.00 75.95 ? 164 VAL D N 1 ATOM 5870 C CA . VAL D 4 162 ? -32.841 -50.657 -77.364 1.00 76.92 ? 164 VAL D CA 1 ATOM 5871 C C . VAL D 4 162 ? -33.845 -51.406 -78.230 1.00 77.61 ? 164 VAL D C 1 ATOM 5872 O O . VAL D 4 162 ? -33.683 -52.604 -78.490 1.00 77.62 ? 164 VAL D O 1 ATOM 5873 C CB . VAL D 4 162 ? -31.628 -50.166 -78.229 1.00 76.89 ? 164 VAL D CB 1 ATOM 5874 C CG1 . VAL D 4 162 ? -30.557 -49.502 -77.358 1.00 76.77 ? 164 VAL D CG1 1 ATOM 5875 C CG2 . VAL D 4 162 ? -31.031 -51.296 -79.076 1.00 76.97 ? 164 VAL D CG2 1 ATOM 5876 N N . ASN D 4 163 ? -34.881 -50.693 -78.666 1.00 78.55 ? 165 ASN D N 1 ATOM 5877 C CA . ASN D 4 163 ? -35.962 -51.288 -79.456 1.00 79.57 ? 165 ASN D CA 1 ATOM 5878 C C . ASN D 4 163 ? -36.468 -52.598 -78.848 1.00 80.00 ? 165 ASN D C 1 ATOM 5879 O O . ASN D 4 163 ? -36.753 -53.561 -79.571 1.00 80.25 ? 165 ASN D O 1 ATOM 5880 C CB . ASN D 4 163 ? -35.528 -51.514 -80.916 1.00 79.74 ? 165 ASN D CB 1 ATOM 5881 C CG . ASN D 4 163 ? -35.335 -50.215 -81.687 1.00 80.40 ? 165 ASN D CG 1 ATOM 5882 O OD1 . ASN D 4 163 ? -36.187 -49.316 -81.669 1.00 80.88 ? 165 ASN D OD1 1 ATOM 5883 N ND2 . ASN D 4 163 ? -34.210 -50.121 -82.386 1.00 81.05 ? 165 ASN D ND2 1 ATOM 5884 N N . GLY D 4 164 ? -36.552 -52.630 -77.517 1.00 80.40 ? 166 GLY D N 1 ATOM 5885 C CA . GLY D 4 164 ? -37.043 -53.800 -76.786 1.00 80.69 ? 166 GLY D CA 1 ATOM 5886 C C . GLY D 4 164 ? -36.113 -55.008 -76.717 1.00 80.94 ? 166 GLY D C 1 ATOM 5887 O O . GLY D 4 164 ? -36.529 -56.079 -76.255 1.00 81.14 ? 166 GLY D O 1 ATOM 5888 N N . LYS D 4 165 ? -34.870 -54.854 -77.180 1.00 80.93 ? 167 LYS D N 1 ATOM 5889 C CA . LYS D 4 165 ? -33.862 -55.905 -77.034 1.00 80.88 ? 167 LYS D CA 1 ATOM 5890 C C . LYS D 4 165 ? -32.682 -55.414 -76.205 1.00 80.88 ? 167 LYS D C 1 ATOM 5891 O O . LYS D 4 165 ? -32.319 -54.240 -76.257 1.00 80.61 ? 167 LYS D O 1 ATOM 5892 C CB . LYS D 4 165 ? -33.383 -56.423 -78.391 1.00 80.84 ? 167 LYS D CB 1 ATOM 5893 C CG . LYS D 4 165 ? -32.754 -57.814 -78.322 1.00 80.96 ? 167 LYS D CG 1 ATOM 5894 C CD . LYS D 4 165 ? -31.845 -58.112 -79.509 1.00 81.09 ? 167 LYS D CD 1 ATOM 5895 C CE . LYS D 4 165 ? -30.459 -57.509 -79.317 1.00 81.11 ? 167 LYS D CE 1 ATOM 5896 N NZ . LYS D 4 165 ? -29.526 -57.907 -80.404 1.00 81.50 ? 167 LYS D NZ 1 ATOM 5897 N N . GLU D 4 166 ? -32.101 -56.323 -75.432 1.00 81.11 ? 168 GLU D N 1 ATOM 5898 C CA . GLU D 4 166 ? -30.958 -56.005 -74.594 1.00 81.41 ? 168 GLU D CA 1 ATOM 5899 C C . GLU D 4 166 ? -29.683 -56.024 -75.434 1.00 81.74 ? 168 GLU D C 1 ATOM 5900 O O . GLU D 4 166 ? -29.468 -56.942 -76.233 1.00 81.71 ? 168 GLU D O 1 ATOM 5901 C CB . GLU D 4 166 ? -30.860 -56.992 -73.425 1.00 81.36 ? 168 GLU D CB 1 ATOM 5902 C CG . GLU D 4 166 ? -29.961 -56.533 -72.270 1.00 81.07 ? 168 GLU D CG 1 ATOM 5903 C CD . GLU D 4 166 ? -29.618 -57.650 -71.285 1.00 80.87 ? 168 GLU D CD 1 ATOM 5904 O OE1 . GLU D 4 166 ? -28.688 -57.453 -70.471 1.00 80.34 ? 168 GLU D OE1 1 ATOM 5905 O OE2 . GLU D 4 166 ? -30.265 -58.723 -71.321 1.00 81.02 ? 168 GLU D OE2 1 ATOM 5906 N N . VAL D 4 167 ? -28.853 -54.997 -75.252 1.00 82.11 ? 169 VAL D N 1 ATOM 5907 C CA . VAL D 4 167 ? -27.577 -54.869 -75.965 1.00 82.38 ? 169 VAL D CA 1 ATOM 5908 C C . VAL D 4 167 ? -26.393 -54.866 -75.008 1.00 82.55 ? 169 VAL D C 1 ATOM 5909 O O . VAL D 4 167 ? -26.521 -54.484 -73.846 1.00 82.50 ? 169 VAL D O 1 ATOM 5910 C CB . VAL D 4 167 ? -27.509 -53.583 -76.834 1.00 82.36 ? 169 VAL D CB 1 ATOM 5911 C CG1 . VAL D 4 167 ? -28.302 -53.756 -78.128 1.00 82.27 ? 169 VAL D CG1 1 ATOM 5912 C CG2 . VAL D 4 167 ? -27.981 -52.362 -76.043 1.00 82.17 ? 169 VAL D CG2 1 ATOM 5913 N N . HIS D 4 168 ? -25.238 -55.286 -75.513 1.00 82.83 ? 170 HIS D N 1 ATOM 5914 C CA . HIS D 4 168 ? -24.019 -55.302 -74.717 1.00 83.18 ? 170 HIS D CA 1 ATOM 5915 C C . HIS D 4 168 ? -22.874 -54.558 -75.401 1.00 83.28 ? 170 HIS D C 1 ATOM 5916 O O . HIS D 4 168 ? -21.971 -54.051 -74.726 1.00 83.32 ? 170 HIS D O 1 ATOM 5917 C CB . HIS D 4 168 ? -23.603 -56.738 -74.398 1.00 83.37 ? 170 HIS D CB 1 ATOM 5918 C CG . HIS D 4 168 ? -24.697 -57.567 -73.801 1.00 83.69 ? 170 HIS D CG 1 ATOM 5919 N ND1 . HIS D 4 168 ? -25.555 -58.329 -74.566 1.00 84.04 ? 170 HIS D ND1 1 ATOM 5920 C CD2 . HIS D 4 168 ? -25.071 -57.755 -72.514 1.00 83.49 ? 170 HIS D CD2 1 ATOM 5921 C CE1 . HIS D 4 168 ? -26.409 -58.953 -73.776 1.00 84.10 ? 170 HIS D CE1 1 ATOM 5922 N NE2 . HIS D 4 168 ? -26.136 -58.622 -72.525 1.00 83.95 ? 170 HIS D NE2 1 ATOM 5923 N N . SER D 4 169 ? -22.908 -54.503 -76.734 1.00 83.39 ? 171 SER D N 1 ATOM 5924 C CA . SER D 4 169 ? -21.911 -53.751 -77.500 1.00 83.35 ? 171 SER D CA 1 ATOM 5925 C C . SER D 4 169 ? -22.164 -52.254 -77.372 1.00 83.30 ? 171 SER D C 1 ATOM 5926 O O . SER D 4 169 ? -23.287 -51.779 -77.560 1.00 83.08 ? 171 SER D O 1 ATOM 5927 C CB . SER D 4 169 ? -21.897 -54.179 -78.968 1.00 83.32 ? 171 SER D CB 1 ATOM 5928 O OG . SER D 4 169 ? -23.192 -54.088 -79.524 1.00 83.34 ? 171 SER D OG 1 ATOM 5929 N N . GLY D 4 170 ? -21.105 -51.525 -77.037 1.00 83.39 ? 172 GLY D N 1 ATOM 5930 C CA . GLY D 4 170 ? -21.192 -50.097 -76.774 1.00 83.52 ? 172 GLY D CA 1 ATOM 5931 C C . GLY D 4 170 ? -21.773 -49.823 -75.406 1.00 83.65 ? 172 GLY D C 1 ATOM 5932 O O . GLY D 4 170 ? -22.512 -48.866 -75.231 1.00 83.69 ? 172 GLY D O 1 ATOM 5933 N N . VAL D 4 171 ? -21.440 -50.674 -74.438 1.00 83.96 ? 173 VAL D N 1 ATOM 5934 C CA . VAL D 4 171 ? -21.919 -50.535 -73.057 1.00 84.25 ? 173 VAL D CA 1 ATOM 5935 C C . VAL D 4 171 ? -20.754 -50.538 -72.075 1.00 84.43 ? 173 VAL D C 1 ATOM 5936 O O . VAL D 4 171 ? -19.761 -51.231 -72.285 1.00 84.68 ? 173 VAL D O 1 ATOM 5937 C CB . VAL D 4 171 ? -22.885 -51.685 -72.659 1.00 84.23 ? 173 VAL D CB 1 ATOM 5938 C CG1 . VAL D 4 171 ? -23.239 -51.619 -71.178 1.00 84.14 ? 173 VAL D CG1 1 ATOM 5939 C CG2 . VAL D 4 171 ? -24.151 -51.660 -73.506 1.00 84.42 ? 173 VAL D CG2 1 ATOM 5940 N N . CYS D 4 172 ? -20.875 -49.757 -71.007 1.00 84.60 ? 174 CYS D N 1 ATOM 5941 C CA . CYS D 4 172 ? -19.953 -49.862 -69.892 1.00 85.06 ? 174 CYS D CA 1 ATOM 5942 C C . CYS D 4 172 ? -20.660 -49.621 -68.578 1.00 85.18 ? 174 CYS D C 1 ATOM 5943 O O . CYS D 4 172 ? -21.523 -48.754 -68.484 1.00 85.34 ? 174 CYS D O 1 ATOM 5944 C CB . CYS D 4 172 ? -18.800 -48.882 -70.024 1.00 85.17 ? 174 CYS D CB 1 ATOM 5945 S SG . CYS D 4 172 ? -17.292 -49.540 -69.305 1.00 86.46 ? 174 CYS D SG 1 ATOM 5946 N N . THR D 4 173 ? -20.281 -50.390 -67.563 1.00 85.30 ? 175 THR D N 1 ATOM 5947 C CA . THR D 4 173 ? -20.861 -50.262 -66.235 1.00 85.35 ? 175 THR D CA 1 ATOM 5948 C C . THR D 4 173 ? -19.752 -50.341 -65.202 1.00 85.61 ? 175 THR D C 1 ATOM 5949 O O . THR D 4 173 ? -18.844 -51.162 -65.327 1.00 85.52 ? 175 THR D O 1 ATOM 5950 C CB . THR D 4 173 ? -21.902 -51.367 -65.968 1.00 85.24 ? 175 THR D CB 1 ATOM 5951 O OG1 . THR D 4 173 ? -22.761 -51.504 -67.104 1.00 85.03 ? 175 THR D OG1 1 ATOM 5952 C CG2 . THR D 4 173 ? -22.746 -51.027 -64.760 1.00 85.20 ? 175 THR D CG2 1 ATOM 5953 N N . ASP D 4 174 ? -19.821 -49.479 -64.192 1.00 86.13 ? 176 ASP D N 1 ATOM 5954 C CA . ASP D 4 174 ? -18.837 -49.481 -63.117 1.00 86.81 ? 176 ASP D CA 1 ATOM 5955 C C . ASP D 4 174 ? -18.813 -50.837 -62.435 1.00 87.25 ? 176 ASP D C 1 ATOM 5956 O O . ASP D 4 174 ? -19.855 -51.338 -62.008 1.00 87.16 ? 176 ASP D O 1 ATOM 5957 C CB . ASP D 4 174 ? -19.138 -48.406 -62.070 1.00 86.89 ? 176 ASP D CB 1 ATOM 5958 C CG . ASP D 4 174 ? -19.120 -47.003 -62.639 1.00 87.06 ? 176 ASP D CG 1 ATOM 5959 O OD1 . ASP D 4 174 ? -18.227 -46.684 -63.458 1.00 87.17 ? 176 ASP D OD1 1 ATOM 5960 O OD2 . ASP D 4 174 ? -20.001 -46.214 -62.241 1.00 87.13 ? 176 ASP D OD2 1 ATOM 5961 N N . PRO D 4 175 ? -17.622 -51.446 -62.346 1.00 87.83 ? 177 PRO D N 1 ATOM 5962 C CA . PRO D 4 175 ? -17.490 -52.690 -61.597 1.00 88.39 ? 177 PRO D CA 1 ATOM 5963 C C . PRO D 4 175 ? -17.687 -52.442 -60.104 1.00 89.01 ? 177 PRO D C 1 ATOM 5964 O O . PRO D 4 175 ? -18.089 -53.354 -59.375 1.00 89.03 ? 177 PRO D O 1 ATOM 5965 C CB . PRO D 4 175 ? -16.052 -53.130 -61.890 1.00 88.36 ? 177 PRO D CB 1 ATOM 5966 C CG . PRO D 4 175 ? -15.339 -51.881 -62.298 1.00 88.17 ? 177 PRO D CG 1 ATOM 5967 C CD . PRO D 4 175 ? -16.359 -51.037 -62.985 1.00 87.86 ? 177 PRO D CD 1 ATOM 5968 N N . GLN D 4 176 ? -17.415 -51.209 -59.670 1.00 89.76 ? 178 GLN D N 1 ATOM 5969 C CA . GLN D 4 176 ? -17.550 -50.811 -58.264 1.00 90.40 ? 178 GLN D CA 1 ATOM 5970 C C . GLN D 4 176 ? -18.655 -49.781 -58.037 1.00 90.86 ? 178 GLN D C 1 ATOM 5971 O O . GLN D 4 176 ? -18.657 -48.723 -58.680 1.00 90.96 ? 178 GLN D O 1 ATOM 5972 C CB . GLN D 4 176 ? -16.217 -50.291 -57.704 1.00 90.32 ? 178 GLN D CB 1 ATOM 5973 C CG . GLN D 4 176 ? -15.237 -51.392 -57.325 1.00 90.44 ? 178 GLN D CG 1 ATOM 5974 C CD . GLN D 4 176 ? -15.890 -52.492 -56.499 1.00 90.64 ? 178 GLN D CD 1 ATOM 5975 O OE1 . GLN D 4 176 ? -16.306 -52.270 -55.361 1.00 90.85 ? 178 GLN D OE1 1 ATOM 5976 N NE2 . GLN D 4 176 ? -15.988 -53.684 -57.077 1.00 90.52 ? 178 GLN D NE2 1 ATOM 5977 N N . PRO D 4 177 ? -19.610 -50.097 -57.134 1.00 91.30 ? 179 PRO D N 1 ATOM 5978 C CA . PRO D 4 177 ? -20.603 -49.115 -56.694 1.00 91.65 ? 179 PRO D CA 1 ATOM 5979 C C . PRO D 4 177 ? -19.975 -48.064 -55.780 1.00 92.03 ? 179 PRO D C 1 ATOM 5980 O O . PRO D 4 177 ? -18.956 -48.329 -55.135 1.00 92.06 ? 179 PRO D O 1 ATOM 5981 C CB . PRO D 4 177 ? -21.626 -49.959 -55.925 1.00 91.60 ? 179 PRO D CB 1 ATOM 5982 C CG . PRO D 4 177 ? -20.888 -51.176 -55.504 1.00 91.44 ? 179 PRO D CG 1 ATOM 5983 C CD . PRO D 4 177 ? -19.889 -51.441 -56.590 1.00 91.37 ? 179 PRO D CD 1 ATOM 5984 N N . LEU D 4 178 ? -20.580 -46.881 -55.738 1.00 92.44 ? 180 LEU D N 1 ATOM 5985 C CA . LEU D 4 178 ? -20.039 -45.773 -54.964 1.00 92.91 ? 180 LEU D CA 1 ATOM 5986 C C . LEU D 4 178 ? -20.932 -45.439 -53.782 1.00 93.14 ? 180 LEU D C 1 ATOM 5987 O O . LEU D 4 178 ? -22.108 -45.106 -53.959 1.00 93.20 ? 180 LEU D O 1 ATOM 5988 C CB . LEU D 4 178 ? -19.859 -44.536 -55.846 1.00 92.99 ? 180 LEU D CB 1 ATOM 5989 C CG . LEU D 4 178 ? -18.601 -44.435 -56.715 1.00 93.42 ? 180 LEU D CG 1 ATOM 5990 C CD1 . LEU D 4 178 ? -18.644 -45.361 -57.945 1.00 93.64 ? 180 LEU D CD1 1 ATOM 5991 C CD2 . LEU D 4 178 ? -18.409 -42.986 -57.140 1.00 93.78 ? 180 LEU D CD2 1 ATOM 5992 N N . LYS D 4 179 ? -20.361 -45.535 -52.581 1.00 93.35 ? 181 LYS D N 1 ATOM 5993 C CA . LYS D 4 179 ? -21.052 -45.174 -51.345 1.00 93.52 ? 181 LYS D CA 1 ATOM 5994 C C . LYS D 4 179 ? -21.428 -43.699 -51.375 1.00 93.83 ? 181 LYS D C 1 ATOM 5995 O O . LYS D 4 179 ? -20.572 -42.848 -51.617 1.00 93.96 ? 181 LYS D O 1 ATOM 5996 C CB . LYS D 4 179 ? -20.159 -45.447 -50.131 1.00 93.38 ? 181 LYS D CB 1 ATOM 5997 C CG . LYS D 4 179 ? -19.849 -46.910 -49.898 1.00 93.12 ? 181 LYS D CG 1 ATOM 5998 C CD . LYS D 4 179 ? -19.201 -47.141 -48.543 1.00 92.53 ? 181 LYS D CD 1 ATOM 5999 C CE . LYS D 4 179 ? -19.296 -48.607 -48.140 1.00 91.77 ? 181 LYS D CE 1 ATOM 6000 N NZ . LYS D 4 179 ? -18.535 -48.889 -46.899 1.00 91.05 ? 181 LYS D NZ 1 ATOM 6001 N N . GLU D 4 180 ? -22.706 -43.400 -51.146 1.00 94.23 ? 182 GLU D N 1 ATOM 6002 C CA . GLU D 4 180 ? -23.173 -42.008 -51.097 1.00 94.60 ? 182 GLU D CA 1 ATOM 6003 C C . GLU D 4 180 ? -22.688 -41.296 -49.824 1.00 94.78 ? 182 GLU D C 1 ATOM 6004 O O . GLU D 4 180 ? -22.327 -40.116 -49.859 1.00 94.86 ? 182 GLU D O 1 ATOM 6005 C CB . GLU D 4 180 ? -24.694 -41.928 -51.260 1.00 94.50 ? 182 GLU D CB 1 ATOM 6006 C CG . GLU D 4 180 ? -25.164 -42.373 -52.645 1.00 95.02 ? 182 GLU D CG 1 ATOM 6007 C CD . GLU D 4 180 ? -26.598 -41.972 -52.968 1.00 95.95 ? 182 GLU D CD 1 ATOM 6008 O OE1 . GLU D 4 180 ? -27.023 -42.185 -54.123 1.00 95.96 ? 182 GLU D OE1 1 ATOM 6009 O OE2 . GLU D 4 180 ? -27.302 -41.446 -52.079 1.00 96.68 ? 182 GLU D OE2 1 ATOM 6010 N N . GLN D 4 181 ? -22.669 -42.028 -48.712 1.00 94.92 ? 183 GLN D N 1 ATOM 6011 C CA . GLN D 4 181 ? -22.035 -41.561 -47.483 1.00 94.97 ? 183 GLN D CA 1 ATOM 6012 C C . GLN D 4 181 ? -20.896 -42.523 -47.148 1.00 94.90 ? 183 GLN D C 1 ATOM 6013 O O . GLN D 4 181 ? -21.111 -43.515 -46.449 1.00 94.87 ? 183 GLN D O 1 ATOM 6014 C CB . GLN D 4 181 ? -23.032 -41.498 -46.318 1.00 95.03 ? 183 GLN D CB 1 ATOM 6015 C CG . GLN D 4 181 ? -24.304 -40.685 -46.575 1.00 95.64 ? 183 GLN D CG 1 ATOM 6016 C CD . GLN D 4 181 ? -25.447 -41.503 -47.187 1.00 96.42 ? 183 GLN D CD 1 ATOM 6017 O OE1 . GLN D 4 181 ? -25.245 -42.605 -47.708 1.00 96.80 ? 183 GLN D OE1 1 ATOM 6018 N NE2 . GLN D 4 181 ? -26.656 -40.953 -47.128 1.00 96.28 ? 183 GLN D NE2 1 ATOM 6019 N N . PRO D 4 182 ? -19.674 -42.237 -47.647 1.00 94.84 ? 184 PRO D N 1 ATOM 6020 C CA . PRO D 4 182 ? -18.515 -43.104 -47.382 1.00 94.73 ? 184 PRO D CA 1 ATOM 6021 C C . PRO D 4 182 ? -18.300 -43.379 -45.889 1.00 94.62 ? 184 PRO D C 1 ATOM 6022 O O . PRO D 4 182 ? -17.619 -44.340 -45.531 1.00 94.74 ? 184 PRO D O 1 ATOM 6023 C CB . PRO D 4 182 ? -17.333 -42.294 -47.934 1.00 94.69 ? 184 PRO D CB 1 ATOM 6024 C CG . PRO D 4 182 ? -17.923 -41.379 -48.939 1.00 94.71 ? 184 PRO D CG 1 ATOM 6025 C CD . PRO D 4 182 ? -19.308 -41.057 -48.456 1.00 94.84 ? 184 PRO D CD 1 ATOM 6026 N N . ALA D 4 183 ? -18.889 -42.541 -45.038 1.00 94.41 ? 185 ALA D N 1 ATOM 6027 C CA . ALA D 4 183 ? -18.680 -42.600 -43.595 1.00 94.05 ? 185 ALA D CA 1 ATOM 6028 C C . ALA D 4 183 ? -19.466 -43.721 -42.915 1.00 93.83 ? 185 ALA D C 1 ATOM 6029 O O . ALA D 4 183 ? -18.878 -44.716 -42.481 1.00 93.78 ? 185 ALA D O 1 ATOM 6030 C CB . ALA D 4 183 ? -19.003 -41.248 -42.964 1.00 94.06 ? 185 ALA D CB 1 ATOM 6031 N N . LEU D 4 184 ? -20.789 -43.555 -42.843 1.00 93.55 ? 186 LEU D N 1 ATOM 6032 C CA . LEU D 4 184 ? -21.682 -44.433 -42.064 1.00 93.25 ? 186 LEU D CA 1 ATOM 6033 C C . LEU D 4 184 ? -21.862 -45.841 -42.655 1.00 93.06 ? 186 LEU D C 1 ATOM 6034 O O . LEU D 4 184 ? -22.560 -46.019 -43.660 1.00 93.07 ? 186 LEU D O 1 ATOM 6035 C CB . LEU D 4 184 ? -23.041 -43.740 -41.845 1.00 93.21 ? 186 LEU D CB 1 ATOM 6036 C CG . LEU D 4 184 ? -23.840 -43.212 -43.051 1.00 93.09 ? 186 LEU D CG 1 ATOM 6037 C CD1 . LEU D 4 184 ? -25.102 -44.039 -43.272 1.00 93.05 ? 186 LEU D CD1 1 ATOM 6038 C CD2 . LEU D 4 184 ? -24.207 -41.751 -42.869 1.00 92.65 ? 186 LEU D CD2 1 ATOM 6039 N N . ASN D 4 185 ? -21.332 -46.860 -41.995 1.00 92.66 ? 187 ASN D N 1 ATOM 6040 C CA . ASN D 4 185 ? -21.380 -48.185 -42.593 1.00 92.29 ? 187 ASN D CA 1 ATOM 6041 C C . ASN D 4 185 ? -22.827 -48.560 -42.898 1.00 91.79 ? 187 ASN D C 1 ATOM 6042 O O . ASN D 4 185 ? -23.730 -48.300 -42.103 1.00 91.74 ? 187 ASN D O 1 ATOM 6043 C CB . ASN D 4 185 ? -20.749 -49.220 -41.662 1.00 92.47 ? 187 ASN D CB 1 ATOM 6044 C CG . ASN D 4 185 ? -19.257 -49.373 -41.886 1.00 92.99 ? 187 ASN D CG 1 ATOM 6045 O OD1 . ASN D 4 185 ? -18.700 -48.815 -42.832 1.00 93.20 ? 187 ASN D OD1 1 ATOM 6046 N ND2 . ASN D 4 185 ? -18.602 -50.131 -41.014 1.00 93.09 ? 187 ASN D ND2 1 ATOM 6047 N N . ASP D 4 186 ? -23.035 -49.164 -44.065 1.00 91.13 ? 188 ASP D N 1 ATOM 6048 C CA . ASP D 4 186 ? -24.375 -49.457 -44.567 1.00 90.46 ? 188 ASP D CA 1 ATOM 6049 C C . ASP D 4 186 ? -24.987 -48.314 -45.389 1.00 89.49 ? 188 ASP D C 1 ATOM 6050 O O . ASP D 4 186 ? -26.142 -48.397 -45.806 1.00 89.27 ? 188 ASP D O 1 ATOM 6051 C CB . ASP D 4 186 ? -25.308 -49.824 -43.411 1.00 90.78 ? 188 ASP D CB 1 ATOM 6052 C CG . ASP D 4 186 ? -25.925 -48.607 -42.750 1.00 91.85 ? 188 ASP D CG 1 ATOM 6053 O OD1 . ASP D 4 186 ? -25.847 -47.507 -43.336 1.00 92.53 ? 188 ASP D OD1 1 ATOM 6054 O OD2 . ASP D 4 186 ? -26.489 -48.751 -41.645 1.00 93.29 ? 188 ASP D OD2 1 ATOM 6055 N N . SER D 4 187 ? -24.214 -47.256 -45.627 1.00 88.37 ? 189 SER D N 1 ATOM 6056 C CA . SER D 4 187 ? -24.662 -46.154 -46.473 1.00 87.29 ? 189 SER D CA 1 ATOM 6057 C C . SER D 4 187 ? -25.175 -46.649 -47.819 1.00 86.42 ? 189 SER D C 1 ATOM 6058 O O . SER D 4 187 ? -24.734 -47.683 -48.317 1.00 86.34 ? 189 SER D O 1 ATOM 6059 C CB . SER D 4 187 ? -23.512 -45.182 -46.714 1.00 87.39 ? 189 SER D CB 1 ATOM 6060 O OG . SER D 4 187 ? -22.484 -45.787 -47.485 1.00 87.43 ? 189 SER D OG 1 ATOM 6061 N N . ARG D 4 188 ? -26.096 -45.897 -48.406 1.00 85.30 ? 190 ARG D N 1 ATOM 6062 C CA . ARG D 4 188 ? -26.650 -46.235 -49.710 1.00 84.29 ? 190 ARG D CA 1 ATOM 6063 C C . ARG D 4 188 ? -25.601 -46.073 -50.816 1.00 83.60 ? 190 ARG D C 1 ATOM 6064 O O . ARG D 4 188 ? -24.592 -45.390 -50.624 1.00 83.61 ? 190 ARG D O 1 ATOM 6065 C CB . ARG D 4 188 ? -27.900 -45.397 -49.980 1.00 84.33 ? 190 ARG D CB 1 ATOM 6066 C CG . ARG D 4 188 ? -29.016 -45.655 -48.967 1.00 84.15 ? 190 ARG D CG 1 ATOM 6067 C CD . ARG D 4 188 ? -30.023 -44.523 -48.894 1.00 83.68 ? 190 ARG D CD 1 ATOM 6068 N NE . ARG D 4 188 ? -30.780 -44.365 -50.133 1.00 83.35 ? 190 ARG D NE 1 ATOM 6069 C CZ . ARG D 4 188 ? -31.875 -43.620 -50.254 1.00 83.40 ? 190 ARG D CZ 1 ATOM 6070 N NH1 . ARG D 4 188 ? -32.361 -42.960 -49.211 1.00 83.27 ? 190 ARG D NH1 1 ATOM 6071 N NH2 . ARG D 4 188 ? -32.490 -43.535 -51.424 1.00 83.49 ? 190 ARG D NH2 1 ATOM 6072 N N . TYR D 4 189 ? -25.839 -46.712 -51.960 1.00 82.59 ? 191 TYR D N 1 ATOM 6073 C CA . TYR D 4 189 ? -24.861 -46.759 -53.042 1.00 81.50 ? 191 TYR D CA 1 ATOM 6074 C C . TYR D 4 189 ? -25.331 -46.030 -54.304 1.00 80.97 ? 191 TYR D C 1 ATOM 6075 O O . TYR D 4 189 ? -26.537 -45.901 -54.541 1.00 80.80 ? 191 TYR D O 1 ATOM 6076 C CB . TYR D 4 189 ? -24.527 -48.211 -53.390 1.00 81.40 ? 191 TYR D CB 1 ATOM 6077 C CG . TYR D 4 189 ? -23.815 -49.005 -52.310 1.00 80.96 ? 191 TYR D CG 1 ATOM 6078 C CD1 . TYR D 4 189 ? -22.451 -48.823 -52.057 1.00 80.45 ? 191 TYR D CD1 1 ATOM 6079 C CD2 . TYR D 4 189 ? -24.494 -49.975 -51.565 1.00 80.76 ? 191 TYR D CD2 1 ATOM 6080 C CE1 . TYR D 4 189 ? -21.787 -49.574 -51.072 1.00 79.77 ? 191 TYR D CE1 1 ATOM 6081 C CE2 . TYR D 4 189 ? -23.835 -50.731 -50.579 1.00 80.02 ? 191 TYR D CE2 1 ATOM 6082 C CZ . TYR D 4 189 ? -22.486 -50.521 -50.342 1.00 79.49 ? 191 TYR D CZ 1 ATOM 6083 O OH . TYR D 4 189 ? -21.840 -51.254 -49.378 1.00 79.03 ? 191 TYR D OH 1 ATOM 6084 N N . ALA D 4 190 ? -24.361 -45.569 -55.100 1.00 80.27 ? 192 ALA D N 1 ATOM 6085 C CA . ALA D 4 190 ? -24.597 -44.932 -56.402 1.00 79.58 ? 192 ALA D CA 1 ATOM 6086 C C . ALA D 4 190 ? -23.779 -45.618 -57.501 1.00 79.13 ? 192 ALA D C 1 ATOM 6087 O O . ALA D 4 190 ? -22.641 -46.033 -57.261 1.00 78.96 ? 192 ALA D O 1 ATOM 6088 C CB . ALA D 4 190 ? -24.255 -43.462 -56.333 1.00 79.65 ? 192 ALA D CB 1 ATOM 6089 N N . LEU D 4 191 ? -24.361 -45.722 -58.698 1.00 78.55 ? 193 LEU D N 1 ATOM 6090 C CA . LEU D 4 191 ? -23.784 -46.511 -59.795 1.00 77.99 ? 193 LEU D CA 1 ATOM 6091 C C . LEU D 4 191 ? -24.016 -45.878 -61.169 1.00 77.67 ? 193 LEU D C 1 ATOM 6092 O O . LEU D 4 191 ? -25.131 -45.445 -61.472 1.00 77.73 ? 193 LEU D O 1 ATOM 6093 C CB . LEU D 4 191 ? -24.392 -47.913 -59.786 1.00 77.93 ? 193 LEU D CB 1 ATOM 6094 C CG . LEU D 4 191 ? -23.703 -49.012 -60.594 1.00 78.00 ? 193 LEU D CG 1 ATOM 6095 C CD1 . LEU D 4 191 ? -22.686 -49.764 -59.733 1.00 77.80 ? 193 LEU D CD1 1 ATOM 6096 C CD2 . LEU D 4 191 ? -24.739 -49.971 -61.165 1.00 77.63 ? 193 LEU D CD2 1 ATOM 6097 N N . SER D 4 192 ? -22.975 -45.846 -62.005 1.00 77.15 ? 194 SER D N 1 ATOM 6098 C CA . SER D 4 192 ? -23.083 -45.241 -63.338 1.00 76.58 ? 194 SER D CA 1 ATOM 6099 C C . SER D 4 192 ? -22.787 -46.219 -64.473 1.00 76.28 ? 194 SER D C 1 ATOM 6100 O O . SER D 4 192 ? -21.932 -47.093 -64.347 1.00 76.05 ? 194 SER D O 1 ATOM 6101 C CB . SER D 4 192 ? -22.199 -43.995 -63.454 1.00 76.54 ? 194 SER D CB 1 ATOM 6102 O OG . SER D 4 192 ? -20.837 -44.336 -63.611 1.00 76.17 ? 194 SER D OG 1 ATOM 6103 N N . SER D 4 193 ? -23.509 -46.043 -65.575 1.00 76.07 ? 195 SER D N 1 ATOM 6104 C CA . SER D 4 193 ? -23.401 -46.902 -66.742 1.00 76.06 ? 195 SER D CA 1 ATOM 6105 C C . SER D 4 193 ? -23.607 -46.088 -68.013 1.00 76.11 ? 195 SER D C 1 ATOM 6106 O O . SER D 4 193 ? -24.392 -45.143 -68.022 1.00 76.05 ? 195 SER D O 1 ATOM 6107 C CB . SER D 4 193 ? -24.438 -48.020 -66.666 1.00 76.06 ? 195 SER D CB 1 ATOM 6108 O OG . SER D 4 193 ? -24.283 -48.950 -67.724 1.00 76.07 ? 195 SER D OG 1 ATOM 6109 N N . ARG D 4 194 ? -22.912 -46.473 -69.084 1.00 76.20 ? 196 ARG D N 1 ATOM 6110 C CA . ARG D 4 194 ? -22.906 -45.716 -70.336 1.00 76.23 ? 196 ARG D CA 1 ATOM 6111 C C . ARG D 4 194 ? -23.309 -46.557 -71.532 1.00 76.54 ? 196 ARG D C 1 ATOM 6112 O O . ARG D 4 194 ? -23.091 -47.760 -71.553 1.00 76.57 ? 196 ARG D O 1 ATOM 6113 C CB . ARG D 4 194 ? -21.520 -45.137 -70.578 1.00 76.02 ? 196 ARG D CB 1 ATOM 6114 C CG . ARG D 4 194 ? -21.015 -44.319 -69.423 1.00 75.56 ? 196 ARG D CG 1 ATOM 6115 C CD . ARG D 4 194 ? -19.544 -44.530 -69.250 1.00 75.65 ? 196 ARG D CD 1 ATOM 6116 N NE . ARG D 4 194 ? -19.130 -44.385 -67.857 1.00 75.90 ? 196 ARG D NE 1 ATOM 6117 C CZ . ARG D 4 194 ? -19.223 -45.345 -66.939 1.00 76.11 ? 196 ARG D CZ 1 ATOM 6118 N NH1 . ARG D 4 194 ? -18.806 -45.115 -65.700 1.00 76.00 ? 196 ARG D NH1 1 ATOM 6119 N NH2 . ARG D 4 194 ? -19.732 -46.533 -67.250 1.00 76.18 ? 196 ARG D NH2 1 ATOM 6120 N N . LEU D 4 195 ? -23.899 -45.910 -72.526 1.00 77.16 ? 197 LEU D N 1 ATOM 6121 C CA . LEU D 4 195 ? -24.226 -46.571 -73.779 1.00 77.99 ? 197 LEU D CA 1 ATOM 6122 C C . LEU D 4 195 ? -23.862 -45.670 -74.954 1.00 78.71 ? 197 LEU D C 1 ATOM 6123 O O . LEU D 4 195 ? -24.431 -44.593 -75.120 1.00 78.75 ? 197 LEU D O 1 ATOM 6124 C CB . LEU D 4 195 ? -25.704 -46.967 -73.820 1.00 77.86 ? 197 LEU D CB 1 ATOM 6125 C CG . LEU D 4 195 ? -26.268 -47.528 -75.131 1.00 77.79 ? 197 LEU D CG 1 ATOM 6126 C CD1 . LEU D 4 195 ? -25.729 -48.912 -75.444 1.00 77.77 ? 197 LEU D CD1 1 ATOM 6127 C CD2 . LEU D 4 195 ? -27.780 -47.554 -75.093 1.00 77.88 ? 197 LEU D CD2 1 ATOM 6128 N N . ARG D 4 196 ? -22.908 -46.119 -75.762 1.00 79.75 ? 198 ARG D N 1 ATOM 6129 C CA . ARG D 4 196 ? -22.417 -45.332 -76.881 1.00 80.87 ? 198 ARG D CA 1 ATOM 6130 C C . ARG D 4 196 ? -22.865 -45.927 -78.211 1.00 81.69 ? 198 ARG D C 1 ATOM 6131 O O . ARG D 4 196 ? -22.526 -47.064 -78.541 1.00 81.76 ? 198 ARG D O 1 ATOM 6132 C CB . ARG D 4 196 ? -20.892 -45.214 -76.822 1.00 80.87 ? 198 ARG D CB 1 ATOM 6133 C CG . ARG D 4 196 ? -20.320 -44.047 -77.618 1.00 81.31 ? 198 ARG D CG 1 ATOM 6134 C CD . ARG D 4 196 ? -18.846 -43.823 -77.299 1.00 82.18 ? 198 ARG D CD 1 ATOM 6135 N NE . ARG D 4 196 ? -18.398 -42.479 -77.672 1.00 82.76 ? 198 ARG D NE 1 ATOM 6136 C CZ . ARG D 4 196 ? -17.231 -41.940 -77.316 1.00 82.79 ? 198 ARG D CZ 1 ATOM 6137 N NH1 . ARG D 4 196 ? -16.921 -40.712 -77.707 1.00 82.54 ? 198 ARG D NH1 1 ATOM 6138 N NH2 . ARG D 4 196 ? -16.370 -42.619 -76.568 1.00 82.87 ? 198 ARG D NH2 1 ATOM 6139 N N . VAL D 4 197 ? -23.643 -45.151 -78.960 1.00 82.84 ? 199 VAL D N 1 ATOM 6140 C CA . VAL D 4 197 ? -24.070 -45.538 -80.303 1.00 84.03 ? 199 VAL D CA 1 ATOM 6141 C C . VAL D 4 197 ? -23.701 -44.469 -81.324 1.00 84.96 ? 199 VAL D C 1 ATOM 6142 O O . VAL D 4 197 ? -23.209 -43.397 -80.966 1.00 85.01 ? 199 VAL D O 1 ATOM 6143 C CB . VAL D 4 197 ? -25.591 -45.806 -80.382 1.00 83.95 ? 199 VAL D CB 1 ATOM 6144 C CG1 . VAL D 4 197 ? -25.915 -47.206 -79.884 1.00 84.02 ? 199 VAL D CG1 1 ATOM 6145 C CG2 . VAL D 4 197 ? -26.371 -44.743 -79.621 1.00 83.93 ? 199 VAL D CG2 1 ATOM 6146 N N . SER D 4 198 ? -23.940 -44.776 -82.596 1.00 86.19 ? 200 SER D N 1 ATOM 6147 C CA . SER D 4 198 ? -23.739 -43.824 -83.683 1.00 87.30 ? 200 SER D CA 1 ATOM 6148 C C . SER D 4 198 ? -24.648 -42.609 -83.508 1.00 87.95 ? 200 SER D C 1 ATOM 6149 O O . SER D 4 198 ? -25.820 -42.754 -83.137 1.00 88.06 ? 200 SER D O 1 ATOM 6150 C CB . SER D 4 198 ? -24.022 -44.497 -85.030 1.00 87.28 ? 200 SER D CB 1 ATOM 6151 O OG . SER D 4 198 ? -23.061 -45.499 -85.320 1.00 87.84 ? 200 SER D OG 1 ATOM 6152 N N . ALA D 4 199 ? -24.101 -41.418 -83.759 1.00 88.75 ? 201 ALA D N 1 ATOM 6153 C CA . ALA D 4 199 ? -24.898 -40.192 -83.785 1.00 89.44 ? 201 ALA D CA 1 ATOM 6154 C C . ALA D 4 199 ? -26.038 -40.340 -84.790 1.00 90.03 ? 201 ALA D C 1 ATOM 6155 O O . ALA D 4 199 ? -27.155 -39.889 -84.540 1.00 90.03 ? 201 ALA D O 1 ATOM 6156 C CB . ALA D 4 199 ? -24.034 -38.996 -84.129 1.00 89.38 ? 201 ALA D CB 1 ATOM 6157 N N . THR D 4 200 ? -25.740 -40.994 -85.915 1.00 90.83 ? 202 THR D N 1 ATOM 6158 C CA . THR D 4 200 ? -26.739 -41.335 -86.935 1.00 91.64 ? 202 THR D CA 1 ATOM 6159 C C . THR D 4 200 ? -27.842 -42.269 -86.410 1.00 92.19 ? 202 THR D C 1 ATOM 6160 O O . THR D 4 200 ? -29.020 -42.104 -86.750 1.00 92.39 ? 202 THR D O 1 ATOM 6161 C CB . THR D 4 200 ? -26.085 -41.915 -88.231 1.00 91.60 ? 202 THR D CB 1 ATOM 6162 O OG1 . THR D 4 200 ? -27.060 -42.652 -88.982 1.00 91.86 ? 202 THR D OG1 1 ATOM 6163 C CG2 . THR D 4 200 ? -24.906 -42.827 -87.910 1.00 91.43 ? 202 THR D CG2 1 ATOM 6164 N N . PHE D 4 201 ? -27.452 -43.240 -85.585 1.00 92.77 ? 203 PHE D N 1 ATOM 6165 C CA . PHE D 4 201 ? -28.398 -44.157 -84.947 1.00 93.35 ? 203 PHE D CA 1 ATOM 6166 C C . PHE D 4 201 ? -29.267 -43.419 -83.919 1.00 93.73 ? 203 PHE D C 1 ATOM 6167 O O . PHE D 4 201 ? -30.465 -43.686 -83.811 1.00 93.69 ? 203 PHE D O 1 ATOM 6168 C CB . PHE D 4 201 ? -27.646 -45.325 -84.284 1.00 93.38 ? 203 PHE D CB 1 ATOM 6169 C CG . PHE D 4 201 ? -28.526 -46.497 -83.905 1.00 93.26 ? 203 PHE D CG 1 ATOM 6170 C CD1 . PHE D 4 201 ? -29.173 -46.534 -82.668 1.00 92.90 ? 203 PHE D CD1 1 ATOM 6171 C CD2 . PHE D 4 201 ? -28.682 -47.575 -84.774 1.00 92.98 ? 203 PHE D CD2 1 ATOM 6172 C CE1 . PHE D 4 201 ? -29.977 -47.615 -82.314 1.00 92.60 ? 203 PHE D CE1 1 ATOM 6173 C CE2 . PHE D 4 201 ? -29.481 -48.660 -84.427 1.00 92.85 ? 203 PHE D CE2 1 ATOM 6174 C CZ . PHE D 4 201 ? -30.131 -48.679 -83.194 1.00 92.67 ? 203 PHE D CZ 1 ATOM 6175 N N . TRP D 4 202 ? -28.657 -42.491 -83.180 1.00 94.20 ? 204 TRP D N 1 ATOM 6176 C CA . TRP D 4 202 ? -29.350 -41.761 -82.113 1.00 94.70 ? 204 TRP D CA 1 ATOM 6177 C C . TRP D 4 202 ? -30.266 -40.644 -82.625 1.00 94.81 ? 204 TRP D C 1 ATOM 6178 O O . TRP D 4 202 ? -31.337 -40.411 -82.059 1.00 94.89 ? 204 TRP D O 1 ATOM 6179 C CB . TRP D 4 202 ? -28.353 -41.220 -81.075 1.00 94.79 ? 204 TRP D CB 1 ATOM 6180 C CG . TRP D 4 202 ? -28.817 -39.965 -80.377 1.00 95.86 ? 204 TRP D CG 1 ATOM 6181 C CD1 . TRP D 4 202 ? -28.346 -38.699 -80.577 1.00 96.69 ? 204 TRP D CD1 1 ATOM 6182 C CD2 . TRP D 4 202 ? -29.856 -39.853 -79.388 1.00 97.01 ? 204 TRP D CD2 1 ATOM 6183 N NE1 . TRP D 4 202 ? -29.017 -37.807 -79.773 1.00 97.22 ? 204 TRP D NE1 1 ATOM 6184 C CE2 . TRP D 4 202 ? -29.951 -38.486 -79.035 1.00 97.24 ? 204 TRP D CE2 1 ATOM 6185 C CE3 . TRP D 4 202 ? -30.716 -40.772 -78.768 1.00 97.49 ? 204 TRP D CE3 1 ATOM 6186 C CZ2 . TRP D 4 202 ? -30.867 -38.014 -78.084 1.00 97.37 ? 204 TRP D CZ2 1 ATOM 6187 C CZ3 . TRP D 4 202 ? -31.631 -40.301 -77.820 1.00 97.53 ? 204 TRP D CZ3 1 ATOM 6188 C CH2 . TRP D 4 202 ? -31.696 -38.934 -77.490 1.00 97.55 ? 204 TRP D CH2 1 ATOM 6189 N N . GLN D 4 203 ? -29.848 -39.956 -83.684 1.00 94.96 ? 205 GLN D N 1 ATOM 6190 C CA . GLN D 4 203 ? -30.622 -38.834 -84.216 1.00 95.12 ? 205 GLN D CA 1 ATOM 6191 C C . GLN D 4 203 ? -32.021 -39.245 -84.671 1.00 95.11 ? 205 GLN D C 1 ATOM 6192 O O . GLN D 4 203 ? -32.964 -38.455 -84.573 1.00 95.18 ? 205 GLN D O 1 ATOM 6193 C CB . GLN D 4 203 ? -29.861 -38.131 -85.337 1.00 95.25 ? 205 GLN D CB 1 ATOM 6194 C CG . GLN D 4 203 ? -28.839 -37.124 -84.822 1.00 95.64 ? 205 GLN D CG 1 ATOM 6195 C CD . GLN D 4 203 ? -27.865 -36.663 -85.889 1.00 96.08 ? 205 GLN D CD 1 ATOM 6196 O OE1 . GLN D 4 203 ? -27.936 -37.084 -87.049 1.00 96.22 ? 205 GLN D OE1 1 ATOM 6197 N NE2 . GLN D 4 203 ? -26.943 -35.789 -85.498 1.00 95.89 ? 205 GLN D NE2 1 ATOM 6198 N N . ASN D 4 204 ? -32.138 -40.480 -85.159 1.00 95.01 ? 206 ASN D N 1 ATOM 6199 C CA . ASN D 4 204 ? -33.426 -41.101 -85.452 1.00 94.99 ? 206 ASN D CA 1 ATOM 6200 C C . ASN D 4 204 ? -34.207 -41.307 -84.146 1.00 94.99 ? 206 ASN D C 1 ATOM 6201 O O . ASN D 4 204 ? -33.703 -41.944 -83.220 1.00 95.04 ? 206 ASN D O 1 ATOM 6202 C CB . ASN D 4 204 ? -33.204 -42.446 -86.169 1.00 94.95 ? 206 ASN D CB 1 ATOM 6203 C CG . ASN D 4 204 ? -34.432 -42.930 -86.941 1.00 94.77 ? 206 ASN D CG 1 ATOM 6204 O OD1 . ASN D 4 204 ? -35.572 -42.600 -86.612 1.00 94.51 ? 206 ASN D OD1 1 ATOM 6205 N ND2 . ASN D 4 204 ? -34.194 -43.729 -87.973 1.00 94.68 ? 206 ASN D ND2 1 ATOM 6206 N N . PRO D 4 205 ? -35.423 -40.740 -84.045 1.00 94.98 ? 207 PRO D N 1 ATOM 6207 C CA . PRO D 4 205 ? -36.196 -40.997 -82.833 1.00 95.00 ? 207 PRO D CA 1 ATOM 6208 C C . PRO D 4 205 ? -37.269 -42.079 -83.039 1.00 95.01 ? 207 PRO D C 1 ATOM 6209 O O . PRO D 4 205 ? -38.318 -42.051 -82.393 1.00 94.98 ? 207 PRO D O 1 ATOM 6210 C CB . PRO D 4 205 ? -36.812 -39.626 -82.515 1.00 95.00 ? 207 PRO D CB 1 ATOM 6211 C CG . PRO D 4 205 ? -36.611 -38.775 -83.787 1.00 95.01 ? 207 PRO D CG 1 ATOM 6212 C CD . PRO D 4 205 ? -36.041 -39.675 -84.847 1.00 94.92 ? 207 PRO D CD 1 ATOM 6213 N N . ARG D 4 206 ? -36.995 -43.009 -83.954 1.00 95.02 ? 208 ARG D N 1 ATOM 6214 C CA . ARG D 4 206 ? -37.724 -44.277 -84.058 1.00 95.00 ? 208 ARG D CA 1 ATOM 6215 C C . ARG D 4 206 ? -37.023 -45.309 -83.155 1.00 94.69 ? 208 ARG D C 1 ATOM 6216 O O . ARG D 4 206 ? -37.661 -46.221 -82.608 1.00 94.67 ? 208 ARG D O 1 ATOM 6217 C CB . ARG D 4 206 ? -37.775 -44.753 -85.523 1.00 95.19 ? 208 ARG D CB 1 ATOM 6218 C CG . ARG D 4 206 ? -38.281 -46.191 -85.740 1.00 95.91 ? 208 ARG D CG 1 ATOM 6219 C CD . ARG D 4 206 ? -38.396 -46.563 -87.222 0.67 96.68 ? 208 ARG D CD 1 ATOM 6220 N NE . ARG D 4 206 ? -39.658 -46.116 -87.816 1.00 97.37 ? 208 ARG D NE 1 ATOM 6221 C CZ . ARG D 4 206 ? -39.806 -45.000 -88.527 0.36 97.71 ? 208 ARG D CZ 1 ATOM 6222 N NH1 . ARG D 4 206 ? -38.767 -44.201 -88.749 1.00 98.28 ? 208 ARG D NH1 1 ATOM 6223 N NH2 . ARG D 4 206 ? -40.998 -44.685 -89.020 1.00 97.66 ? 208 ARG D NH2 1 ATOM 6224 N N . ASN D 4 207 ? -35.708 -45.143 -83.005 1.00 94.21 ? 209 ASN D N 1 ATOM 6225 C CA . ASN D 4 207 ? -34.897 -45.970 -82.114 1.00 93.66 ? 209 ASN D CA 1 ATOM 6226 C C . ASN D 4 207 ? -35.193 -45.672 -80.646 1.00 93.21 ? 209 ASN D C 1 ATOM 6227 O O . ASN D 4 207 ? -35.108 -44.520 -80.197 1.00 93.10 ? 209 ASN D O 1 ATOM 6228 C CB . ASN D 4 207 ? -33.403 -45.806 -82.424 1.00 93.68 ? 209 ASN D CB 1 ATOM 6229 C CG . ASN D 4 207 ? -33.025 -46.350 -83.799 1.00 93.85 ? 209 ASN D CG 1 ATOM 6230 O OD1 . ASN D 4 207 ? -33.719 -47.203 -84.357 1.00 93.97 ? 209 ASN D OD1 1 ATOM 6231 N ND2 . ASN D 4 207 ? -31.921 -45.854 -84.352 1.00 93.96 ? 209 ASN D ND2 1 ATOM 6232 N N . HIS D 4 208 ? -35.545 -46.723 -79.913 1.00 92.59 ? 210 HIS D N 1 ATOM 6233 C CA . HIS D 4 208 ? -36.045 -46.583 -78.557 1.00 92.04 ? 210 HIS D CA 1 ATOM 6234 C C . HIS D 4 208 ? -35.046 -47.038 -77.505 1.00 91.40 ? 210 HIS D C 1 ATOM 6235 O O . HIS D 4 208 ? -34.645 -48.200 -77.492 1.00 91.21 ? 210 HIS D O 1 ATOM 6236 C CB . HIS D 4 208 ? -37.356 -47.349 -78.407 1.00 92.27 ? 210 HIS D CB 1 ATOM 6237 C CG . HIS D 4 208 ? -37.874 -47.371 -77.007 1.00 93.02 ? 210 HIS D CG 1 ATOM 6238 N ND1 . HIS D 4 208 ? -38.317 -48.523 -76.392 1.00 94.04 ? 210 HIS D ND1 1 ATOM 6239 C CD2 . HIS D 4 208 ? -37.990 -46.383 -76.088 1.00 93.40 ? 210 HIS D CD2 1 ATOM 6240 C CE1 . HIS D 4 208 ? -38.700 -48.240 -75.160 1.00 94.08 ? 210 HIS D CE1 1 ATOM 6241 N NE2 . HIS D 4 208 ? -38.509 -46.949 -74.950 1.00 93.87 ? 210 HIS D NE2 1 ATOM 6242 N N . PHE D 4 209 ? -34.685 -46.123 -76.607 1.00 90.78 ? 211 PHE D N 1 ATOM 6243 C CA . PHE D 4 209 ? -33.637 -46.363 -75.603 1.00 90.34 ? 211 PHE D CA 1 ATOM 6244 C C . PHE D 4 209 ? -34.168 -46.459 -74.166 1.00 89.81 ? 211 PHE D C 1 ATOM 6245 O O . PHE D 4 209 ? -34.892 -45.575 -73.702 1.00 89.78 ? 211 PHE D O 1 ATOM 6246 C CB . PHE D 4 209 ? -32.561 -45.269 -75.686 1.00 90.45 ? 211 PHE D CB 1 ATOM 6247 C CG . PHE D 4 209 ? -31.869 -45.199 -77.019 1.00 91.08 ? 211 PHE D CG 1 ATOM 6248 C CD1 . PHE D 4 209 ? -30.680 -45.892 -77.237 1.00 91.55 ? 211 PHE D CD1 1 ATOM 6249 C CD2 . PHE D 4 209 ? -32.407 -44.445 -78.060 1.00 91.71 ? 211 PHE D CD2 1 ATOM 6250 C CE1 . PHE D 4 209 ? -30.033 -45.841 -78.476 1.00 91.70 ? 211 PHE D CE1 1 ATOM 6251 C CE2 . PHE D 4 209 ? -31.769 -44.386 -79.303 1.00 92.12 ? 211 PHE D CE2 1 ATOM 6252 C CZ . PHE D 4 209 ? -30.577 -45.085 -79.509 1.00 91.98 ? 211 PHE D CZ 1 ATOM 6253 N N . ARG D 4 210 ? -33.797 -47.530 -73.463 1.00 89.12 ? 212 ARG D N 1 ATOM 6254 C CA . ARG D 4 210 ? -34.216 -47.728 -72.066 1.00 88.50 ? 212 ARG D CA 1 ATOM 6255 C C . ARG D 4 210 ? -33.115 -48.328 -71.176 1.00 87.87 ? 212 ARG D C 1 ATOM 6256 O O . ARG D 4 210 ? -32.418 -49.266 -71.577 1.00 87.78 ? 212 ARG D O 1 ATOM 6257 C CB . ARG D 4 210 ? -35.497 -48.575 -71.983 1.00 88.62 ? 212 ARG D CB 1 ATOM 6258 C CG . ARG D 4 210 ? -36.371 -48.247 -70.772 1.00 88.95 ? 212 ARG D CG 1 ATOM 6259 C CD . ARG D 4 210 ? -37.556 -49.191 -70.623 1.00 89.69 ? 212 ARG D CD 1 ATOM 6260 N NE . ARG D 4 210 ? -37.186 -50.431 -69.942 1.00 90.22 ? 212 ARG D NE 1 ATOM 6261 C CZ . ARG D 4 210 ? -37.211 -51.637 -70.502 1.00 90.49 ? 212 ARG D CZ 1 ATOM 6262 N NH1 . ARG D 4 210 ? -36.852 -52.702 -69.794 1.00 90.46 ? 212 ARG D NH1 1 ATOM 6263 N NH2 . ARG D 4 210 ? -37.600 -51.782 -71.766 1.00 90.63 ? 212 ARG D NH2 1 ATOM 6264 N N . CYS D 4 211 ? -32.972 -47.772 -69.970 1.00 87.04 ? 213 CYS D N 1 ATOM 6265 C CA . CYS D 4 211 ? -31.998 -48.248 -68.986 1.00 86.14 ? 213 CYS D CA 1 ATOM 6266 C C . CYS D 4 211 ? -32.678 -48.963 -67.817 1.00 86.13 ? 213 CYS D C 1 ATOM 6267 O O . CYS D 4 211 ? -33.108 -48.320 -66.859 1.00 86.17 ? 213 CYS D O 1 ATOM 6268 C CB . CYS D 4 211 ? -31.132 -47.095 -68.455 1.00 85.77 ? 213 CYS D CB 1 ATOM 6269 S SG . CYS D 4 211 ? -29.989 -47.627 -67.144 1.00 83.76 ? 213 CYS D SG 1 ATOM 6270 N N . GLN D 4 212 ? -32.754 -50.292 -67.900 1.00 85.91 ? 214 GLN D N 1 ATOM 6271 C CA . GLN D 4 212 ? -33.365 -51.126 -66.856 1.00 85.59 ? 214 GLN D CA 1 ATOM 6272 C C . GLN D 4 212 ? -32.386 -51.499 -65.739 1.00 85.28 ? 214 GLN D C 1 ATOM 6273 O O . GLN D 4 212 ? -31.228 -51.834 -65.996 1.00 85.22 ? 214 GLN D O 1 ATOM 6274 C CB . GLN D 4 212 ? -33.994 -52.386 -67.472 1.00 85.61 ? 214 GLN D CB 1 ATOM 6275 C CG . GLN D 4 212 ? -34.002 -53.614 -66.554 1.00 85.79 ? 214 GLN D CG 1 ATOM 6276 C CD . GLN D 4 212 ? -34.799 -54.782 -67.111 1.00 86.34 ? 214 GLN D CD 1 ATOM 6277 O OE1 . GLN D 4 212 ? -35.862 -54.600 -67.715 1.00 86.68 ? 214 GLN D OE1 1 ATOM 6278 N NE2 . GLN D 4 212 ? -34.297 -55.997 -66.889 1.00 86.01 ? 214 GLN D NE2 1 ATOM 6279 N N . VAL D 4 213 ? -32.870 -51.430 -64.500 1.00 85.03 ? 215 VAL D N 1 ATOM 6280 C CA . VAL D 4 213 ? -32.110 -51.867 -63.322 1.00 84.74 ? 215 VAL D CA 1 ATOM 6281 C C . VAL D 4 213 ? -32.916 -52.871 -62.485 1.00 84.58 ? 215 VAL D C 1 ATOM 6282 O O . VAL D 4 213 ? -33.967 -52.531 -61.931 1.00 84.61 ? 215 VAL D O 1 ATOM 6283 C CB . VAL D 4 213 ? -31.689 -50.674 -62.425 1.00 84.66 ? 215 VAL D CB 1 ATOM 6284 C CG1 . VAL D 4 213 ? -30.904 -51.163 -61.208 1.00 84.44 ? 215 VAL D CG1 1 ATOM 6285 C CG2 . VAL D 4 213 ? -30.872 -49.670 -63.217 1.00 84.61 ? 215 VAL D CG2 1 ATOM 6286 N N . GLN D 4 214 ? -32.423 -54.106 -62.408 1.00 84.25 ? 216 GLN D N 1 ATOM 6287 C CA . GLN D 4 214 ? -33.036 -55.117 -61.558 1.00 83.81 ? 216 GLN D CA 1 ATOM 6288 C C . GLN D 4 214 ? -32.492 -54.961 -60.148 1.00 83.85 ? 216 GLN D C 1 ATOM 6289 O O . GLN D 4 214 ? -31.283 -55.019 -59.926 1.00 83.75 ? 216 GLN D O 1 ATOM 6290 C CB . GLN D 4 214 ? -32.772 -56.524 -62.097 1.00 83.64 ? 216 GLN D CB 1 ATOM 6291 C CG . GLN D 4 214 ? -33.304 -57.639 -61.208 1.00 82.69 ? 216 GLN D CG 1 ATOM 6292 C CD . GLN D 4 214 ? -34.781 -57.915 -61.403 1.00 81.21 ? 216 GLN D CD 1 ATOM 6293 O OE1 . GLN D 4 214 ? -35.587 -57.701 -60.498 1.00 80.01 ? 216 GLN D OE1 1 ATOM 6294 N NE2 . GLN D 4 214 ? -35.140 -58.404 -62.584 1.00 80.65 ? 216 GLN D NE2 1 ATOM 6295 N N . PHE D 4 215 ? -33.394 -54.736 -59.201 1.00 83.99 ? 217 PHE D N 1 ATOM 6296 C CA . PHE D 4 215 ? -33.010 -54.586 -57.809 1.00 84.22 ? 217 PHE D CA 1 ATOM 6297 C C . PHE D 4 215 ? -33.534 -55.747 -56.989 1.00 84.74 ? 217 PHE D C 1 ATOM 6298 O O . PHE D 4 215 ? -34.684 -56.157 -57.144 1.00 84.73 ? 217 PHE D O 1 ATOM 6299 C CB . PHE D 4 215 ? -33.521 -53.265 -57.243 1.00 84.00 ? 217 PHE D CB 1 ATOM 6300 C CG . PHE D 4 215 ? -33.457 -53.182 -55.744 1.00 83.28 ? 217 PHE D CG 1 ATOM 6301 C CD1 . PHE D 4 215 ? -32.234 -53.188 -55.082 1.00 82.49 ? 217 PHE D CD1 1 ATOM 6302 C CD2 . PHE D 4 215 ? -34.621 -53.094 -54.994 1.00 82.64 ? 217 PHE D CD2 1 ATOM 6303 C CE1 . PHE D 4 215 ? -32.175 -53.114 -53.698 1.00 82.08 ? 217 PHE D CE1 1 ATOM 6304 C CE2 . PHE D 4 215 ? -34.570 -53.017 -53.608 1.00 82.20 ? 217 PHE D CE2 1 ATOM 6305 C CZ . PHE D 4 215 ? -33.345 -53.025 -52.960 1.00 81.94 ? 217 PHE D CZ 1 ATOM 6306 N N . TYR D 4 216 ? -32.675 -56.266 -56.115 1.00 85.43 ? 218 TYR D N 1 ATOM 6307 C CA . TYR D 4 216 ? -32.996 -57.420 -55.282 1.00 86.10 ? 218 TYR D CA 1 ATOM 6308 C C . TYR D 4 216 ? -33.088 -57.018 -53.816 1.00 86.56 ? 218 TYR D C 1 ATOM 6309 O O . TYR D 4 216 ? -32.073 -56.788 -53.150 1.00 86.52 ? 218 TYR D O 1 ATOM 6310 C CB . TYR D 4 216 ? -31.973 -58.546 -55.496 1.00 86.12 ? 218 TYR D CB 1 ATOM 6311 C CG . TYR D 4 216 ? -32.106 -59.237 -56.840 1.00 86.17 ? 218 TYR D CG 1 ATOM 6312 C CD1 . TYR D 4 216 ? -31.279 -58.896 -57.907 1.00 86.18 ? 218 TYR D CD1 1 ATOM 6313 C CD2 . TYR D 4 216 ? -33.073 -60.223 -57.046 1.00 86.36 ? 218 TYR D CD2 1 ATOM 6314 C CE1 . TYR D 4 216 ? -31.403 -59.525 -59.139 1.00 86.48 ? 218 TYR D CE1 1 ATOM 6315 C CE2 . TYR D 4 216 ? -33.210 -60.853 -58.276 1.00 86.48 ? 218 TYR D CE2 1 ATOM 6316 C CZ . TYR D 4 216 ? -32.372 -60.500 -59.316 1.00 86.65 ? 218 TYR D CZ 1 ATOM 6317 O OH . TYR D 4 216 ? -32.507 -61.129 -60.532 1.00 87.12 ? 218 TYR D OH 1 ATOM 6318 N N . GLY D 4 217 ? -34.320 -56.929 -53.328 1.00 87.18 ? 219 GLY D N 1 ATOM 6319 C CA . GLY D 4 217 ? -34.576 -56.430 -51.988 1.00 88.08 ? 219 GLY D CA 1 ATOM 6320 C C . GLY D 4 217 ? -35.351 -57.381 -51.103 1.00 88.75 ? 219 GLY D C 1 ATOM 6321 O O . GLY D 4 217 ? -34.930 -58.514 -50.865 1.00 88.72 ? 219 GLY D O 1 ATOM 6322 N N . LEU D 4 218 ? -36.489 -56.903 -50.613 1.00 89.52 ? 220 LEU D N 1 ATOM 6323 C CA . LEU D 4 218 ? -37.316 -57.658 -49.687 1.00 90.35 ? 220 LEU D CA 1 ATOM 6324 C C . LEU D 4 218 ? -38.354 -58.506 -50.393 1.00 91.12 ? 220 LEU D C 1 ATOM 6325 O O . LEU D 4 218 ? -38.891 -58.129 -51.437 1.00 91.18 ? 220 LEU D O 1 ATOM 6326 C CB . LEU D 4 218 ? -38.016 -56.713 -48.714 1.00 90.28 ? 220 LEU D CB 1 ATOM 6327 C CG . LEU D 4 218 ? -37.441 -56.489 -47.316 1.00 90.04 ? 220 LEU D CG 1 ATOM 6328 C CD1 . LEU D 4 218 ? -35.955 -56.168 -47.318 1.00 89.68 ? 220 LEU D CD1 1 ATOM 6329 C CD2 . LEU D 4 218 ? -38.227 -55.382 -46.659 1.00 89.93 ? 220 LEU D CD2 1 ATOM 6330 N N . SER D 4 219 ? -38.637 -59.657 -49.801 1.00 92.11 ? 221 SER D N 1 ATOM 6331 C CA . SER D 4 219 ? -39.665 -60.549 -50.309 1.00 93.10 ? 221 SER D CA 1 ATOM 6332 C C . SER D 4 219 ? -41.012 -60.253 -49.648 1.00 93.71 ? 221 SER D C 1 ATOM 6333 O O . SER D 4 219 ? -41.081 -59.523 -48.650 1.00 93.59 ? 221 SER D O 1 ATOM 6334 C CB . SER D 4 219 ? -39.252 -62.008 -50.084 1.00 93.10 ? 221 SER D CB 1 ATOM 6335 O OG . SER D 4 219 ? -38.612 -62.166 -48.827 1.00 93.20 ? 221 SER D OG 1 ATOM 6336 N N . GLU D 4 220 ? -42.077 -60.810 -50.230 1.00 94.61 ? 222 GLU D N 1 ATOM 6337 C CA . GLU D 4 220 ? -43.413 -60.814 -49.618 1.00 95.43 ? 222 GLU D CA 1 ATOM 6338 C C . GLU D 4 220 ? -43.402 -61.701 -48.365 1.00 96.01 ? 222 GLU D C 1 ATOM 6339 O O . GLU D 4 220 ? -44.206 -61.503 -47.444 1.00 96.06 ? 222 GLU D O 1 ATOM 6340 C CB . GLU D 4 220 ? -44.472 -61.318 -50.612 1.00 95.41 ? 222 GLU D CB 1 ATOM 6341 C CG . GLU D 4 220 ? -44.610 -60.487 -51.893 1.00 95.15 ? 222 GLU D CG 1 ATOM 6342 C CD . GLU D 4 220 ? -45.516 -61.136 -52.929 1.00 94.74 ? 222 GLU D CD 1 ATOM 6343 O OE1 . GLU D 4 220 ? -45.478 -62.377 -53.080 1.00 94.63 ? 222 GLU D OE1 1 ATOM 6344 O OE2 . GLU D 4 220 ? -46.264 -60.399 -53.602 1.00 94.39 ? 222 GLU D OE2 1 ATOM 6345 N N . ASN D 4 221 ? -42.451 -62.640 -48.309 1.00 96.68 ? 223 ASN D N 1 ATOM 6346 C CA . ASN D 4 221 ? -42.293 -63.560 -47.166 1.00 97.24 ? 223 ASN D CA 1 ATOM 6347 C C . ASN D 4 221 ? -41.926 -62.963 -45.790 1.00 97.41 ? 223 ASN D C 1 ATOM 6348 O O . ASN D 4 221 ? -42.542 -63.319 -44.785 1.00 97.39 ? 223 ASN D O 1 ATOM 6349 C CB . ASN D 4 221 ? -41.303 -64.674 -47.522 1.00 97.36 ? 223 ASN D CB 1 ATOM 6350 C CG . ASN D 4 221 ? -40.778 -65.399 -46.298 1.00 97.87 ? 223 ASN D CG 1 ATOM 6351 O OD1 . ASN D 4 221 ? -41.436 -66.289 -45.760 1.00 98.52 ? 223 ASN D OD1 1 ATOM 6352 N ND2 . ASN D 4 221 ? -39.586 -65.020 -45.852 1.00 97.92 ? 223 ASN D ND2 1 ATOM 6353 N N . ASP D 4 222 ? -40.956 -62.049 -45.740 1.00 97.60 ? 224 ASP D N 1 ATOM 6354 C CA . ASP D 4 222 ? -40.781 -61.189 -44.568 1.00 97.74 ? 224 ASP D CA 1 ATOM 6355 C C . ASP D 4 222 ? -41.615 -59.908 -44.682 1.00 97.66 ? 224 ASP D C 1 ATOM 6356 O O . ASP D 4 222 ? -41.380 -59.069 -45.557 1.00 97.66 ? 224 ASP D O 1 ATOM 6357 C CB . ASP D 4 222 ? -39.290 -60.894 -44.272 1.00 97.82 ? 224 ASP D CB 1 ATOM 6358 C CG . ASP D 4 222 ? -38.483 -60.466 -45.514 1.00 98.17 ? 224 ASP D CG 1 ATOM 6359 O OD1 . ASP D 4 222 ? -39.064 -60.247 -46.604 1.00 98.68 ? 224 ASP D OD1 1 ATOM 6360 O OD2 . ASP D 4 222 ? -37.241 -60.347 -45.389 1.00 97.78 ? 224 ASP D OD2 1 ATOM 6361 N N . GLU D 4 223 ? -42.607 -59.786 -43.802 1.00 97.61 ? 225 GLU D N 1 ATOM 6362 C CA . GLU D 4 223 ? -43.475 -58.603 -43.748 1.00 97.47 ? 225 GLU D CA 1 ATOM 6363 C C . GLU D 4 223 ? -42.714 -57.370 -43.212 1.00 97.32 ? 225 GLU D C 1 ATOM 6364 O O . GLU D 4 223 ? -41.661 -57.500 -42.578 1.00 97.20 ? 225 GLU D O 1 ATOM 6365 C CB . GLU D 4 223 ? -44.767 -58.899 -42.949 1.00 97.51 ? 225 GLU D CB 1 ATOM 6366 C CG . GLU D 4 223 ? -45.709 -59.938 -43.617 1.00 97.14 ? 225 GLU D CG 1 ATOM 6367 C CD . GLU D 4 223 ? -46.913 -60.351 -42.758 1.00 96.45 ? 225 GLU D CD 1 ATOM 6368 O OE1 . GLU D 4 223 ? -48.011 -60.546 -43.324 1.00 96.22 ? 225 GLU D OE1 1 ATOM 6369 O OE2 . GLU D 4 223 ? -46.771 -60.495 -41.526 1.00 95.90 ? 225 GLU D OE2 1 ATOM 6370 N N . TRP D 4 224 ? -43.257 -56.184 -43.481 1.00 97.13 ? 226 TRP D N 1 ATOM 6371 C CA . TRP D 4 224 ? -42.559 -54.915 -43.277 1.00 96.98 ? 226 TRP D CA 1 ATOM 6372 C C . TRP D 4 224 ? -43.537 -53.876 -42.731 1.00 96.97 ? 226 TRP D C 1 ATOM 6373 O O . TRP D 4 224 ? -44.613 -53.674 -43.299 1.00 96.90 ? 226 TRP D O 1 ATOM 6374 C CB . TRP D 4 224 ? -41.987 -54.464 -44.624 1.00 97.00 ? 226 TRP D CB 1 ATOM 6375 C CG . TRP D 4 224 ? -41.117 -53.216 -44.654 1.00 96.91 ? 226 TRP D CG 1 ATOM 6376 C CD1 . TRP D 4 224 ? -39.838 -53.083 -44.180 1.00 96.87 ? 226 TRP D CD1 1 ATOM 6377 C CD2 . TRP D 4 224 ? -41.446 -51.961 -45.260 1.00 96.51 ? 226 TRP D CD2 1 ATOM 6378 N NE1 . TRP D 4 224 ? -39.363 -51.814 -44.429 1.00 96.11 ? 226 TRP D NE1 1 ATOM 6379 C CE2 . TRP D 4 224 ? -40.330 -51.106 -45.091 1.00 96.15 ? 226 TRP D CE2 1 ATOM 6380 C CE3 . TRP D 4 224 ? -42.584 -51.468 -45.910 1.00 96.51 ? 226 TRP D CE3 1 ATOM 6381 C CZ2 . TRP D 4 224 ? -40.319 -49.790 -45.552 1.00 96.16 ? 226 TRP D CZ2 1 ATOM 6382 C CZ3 . TRP D 4 224 ? -42.572 -50.161 -46.367 1.00 96.63 ? 226 TRP D CZ3 1 ATOM 6383 C CH2 . TRP D 4 224 ? -41.445 -49.336 -46.187 1.00 96.50 ? 226 TRP D CH2 1 ATOM 6384 N N . THR D 4 225 ? -43.158 -53.220 -41.632 1.00 97.02 ? 227 THR D N 1 ATOM 6385 C CA . THR D 4 225 ? -44.057 -52.297 -40.908 1.00 96.99 ? 227 THR D CA 1 ATOM 6386 C C . THR D 4 225 ? -43.529 -50.855 -40.797 1.00 96.70 ? 227 THR D C 1 ATOM 6387 O O . THR D 4 225 ? -43.387 -50.311 -39.693 1.00 96.61 ? 227 THR D O 1 ATOM 6388 C CB . THR D 4 225 ? -44.399 -52.830 -39.482 1.00 97.13 ? 227 THR D CB 1 ATOM 6389 O OG1 . THR D 4 225 ? -44.581 -54.254 -39.521 1.00 97.24 ? 227 THR D OG1 1 ATOM 6390 C CG2 . THR D 4 225 ? -45.673 -52.153 -38.930 1.00 97.29 ? 227 THR D CG2 1 ATOM 6391 N N . GLN D 4 226 ? -43.236 -50.249 -41.944 1.00 96.38 ? 228 GLN D N 1 ATOM 6392 C CA . GLN D 4 226 ? -42.878 -48.831 -42.000 1.00 96.06 ? 228 GLN D CA 1 ATOM 6393 C C . GLN D 4 226 ? -43.819 -48.092 -42.950 1.00 95.74 ? 228 GLN D C 1 ATOM 6394 O O . GLN D 4 226 ? -44.763 -48.681 -43.484 1.00 95.65 ? 228 GLN D O 1 ATOM 6395 C CB . GLN D 4 226 ? -41.399 -48.624 -42.370 1.00 96.13 ? 228 GLN D CB 1 ATOM 6396 C CG . GLN D 4 226 ? -40.415 -48.745 -41.194 1.00 96.26 ? 228 GLN D CG 1 ATOM 6397 C CD . GLN D 4 226 ? -40.082 -50.191 -40.824 0.84 96.38 ? 228 GLN D CD 1 ATOM 6398 O OE1 . GLN D 4 226 ? -39.467 -50.924 -41.603 1.00 96.51 ? 228 GLN D OE1 1 ATOM 6399 N NE2 . GLN D 4 226 ? -40.473 -50.598 -39.620 1.00 96.07 ? 228 GLN D NE2 1 ATOM 6400 N N . ASP D 4 227 ? -43.557 -46.807 -43.161 1.00 95.38 ? 229 ASP D N 1 ATOM 6401 C CA . ASP D 4 227 ? -44.555 -45.932 -43.754 1.00 95.07 ? 229 ASP D CA 1 ATOM 6402 C C . ASP D 4 227 ? -44.646 -45.985 -45.274 1.00 94.70 ? 229 ASP D C 1 ATOM 6403 O O . ASP D 4 227 ? -45.683 -46.374 -45.813 1.00 94.66 ? 229 ASP D O 1 ATOM 6404 C CB . ASP D 4 227 ? -44.396 -44.498 -43.235 1.00 95.27 ? 229 ASP D CB 1 ATOM 6405 C CG . ASP D 4 227 ? -44.967 -44.319 -41.828 1.00 95.50 ? 229 ASP D CG 1 ATOM 6406 O OD1 . ASP D 4 227 ? -46.071 -44.842 -41.558 1.00 95.81 ? 229 ASP D OD1 1 ATOM 6407 O OD2 . ASP D 4 227 ? -44.318 -43.652 -40.991 1.00 95.48 ? 229 ASP D OD2 1 ATOM 6408 N N . ARG D 4 228 ? -43.575 -45.609 -45.966 1.00 94.24 ? 230 ARG D N 1 ATOM 6409 C CA . ARG D 4 228 ? -43.649 -45.489 -47.427 1.00 93.84 ? 230 ARG D CA 1 ATOM 6410 C C . ARG D 4 228 ? -43.518 -46.834 -48.156 1.00 93.41 ? 230 ARG D C 1 ATOM 6411 O O . ARG D 4 228 ? -43.735 -47.883 -47.551 1.00 93.40 ? 230 ARG D O 1 ATOM 6412 C CB . ARG D 4 228 ? -42.671 -44.432 -47.951 1.00 93.84 ? 230 ARG D CB 1 ATOM 6413 C CG . ARG D 4 228 ? -42.937 -43.005 -47.441 1.00 94.11 ? 230 ARG D CG 1 ATOM 6414 C CD . ARG D 4 228 ? -44.432 -42.632 -47.395 1.00 94.40 ? 230 ARG D CD 1 ATOM 6415 N NE . ARG D 4 228 ? -44.964 -42.583 -46.026 1.00 94.28 ? 230 ARG D NE 1 ATOM 6416 C CZ . ARG D 4 228 ? -45.307 -41.465 -45.380 1.00 93.76 ? 230 ARG D CZ 1 ATOM 6417 N NH1 . ARG D 4 228 ? -45.189 -40.281 -45.970 1.00 93.21 ? 230 ARG D NH1 1 ATOM 6418 N NH2 . ARG D 4 228 ? -45.781 -41.530 -44.141 1.00 93.44 ? 230 ARG D NH2 1 ATOM 6419 N N . ALA D 4 229 ? -43.193 -46.793 -49.450 1.00 92.78 ? 231 ALA D N 1 ATOM 6420 C CA . ALA D 4 229 ? -43.179 -47.988 -50.307 1.00 92.07 ? 231 ALA D CA 1 ATOM 6421 C C . ALA D 4 229 ? -42.239 -49.099 -49.812 1.00 91.51 ? 231 ALA D C 1 ATOM 6422 O O . ALA D 4 229 ? -41.101 -48.837 -49.411 1.00 91.46 ? 231 ALA D O 1 ATOM 6423 C CB . ALA D 4 229 ? -42.847 -47.600 -51.751 1.00 92.12 ? 231 ALA D CB 1 ATOM 6424 N N . LYS D 4 230 ? -42.731 -50.336 -49.836 1.00 90.71 ? 232 LYS D N 1 ATOM 6425 C CA . LYS D 4 230 ? -41.931 -51.484 -49.437 1.00 89.98 ? 232 LYS D CA 1 ATOM 6426 C C . LYS D 4 230 ? -40.796 -51.667 -50.436 1.00 89.56 ? 232 LYS D C 1 ATOM 6427 O O . LYS D 4 230 ? -41.035 -51.666 -51.643 1.00 89.51 ? 232 LYS D O 1 ATOM 6428 C CB . LYS D 4 230 ? -42.801 -52.745 -49.347 1.00 89.97 ? 232 LYS D CB 1 ATOM 6429 C CG . LYS D 4 230 ? -42.220 -53.870 -48.484 1.00 89.49 ? 232 LYS D CG 1 ATOM 6430 C CD . LYS D 4 230 ? -43.138 -55.093 -48.461 1.00 88.71 ? 232 LYS D CD 1 ATOM 6431 C CE . LYS D 4 230 ? -42.436 -56.320 -47.890 1.00 88.07 ? 232 LYS D CE 1 ATOM 6432 N NZ . LYS D 4 230 ? -43.059 -57.586 -48.367 1.00 87.68 ? 232 LYS D NZ 1 ATOM 6433 N N . PRO D 4 231 ? -39.551 -51.777 -49.938 1.00 89.17 ? 233 PRO D N 1 ATOM 6434 C CA . PRO D 4 231 ? -38.392 -52.066 -50.786 1.00 88.92 ? 233 PRO D CA 1 ATOM 6435 C C . PRO D 4 231 ? -38.320 -53.529 -51.254 1.00 88.71 ? 233 PRO D C 1 ATOM 6436 O O . PRO D 4 231 ? -37.415 -54.268 -50.853 1.00 88.56 ? 233 PRO D O 1 ATOM 6437 C CB . PRO D 4 231 ? -37.202 -51.716 -49.884 1.00 88.89 ? 233 PRO D CB 1 ATOM 6438 C CG . PRO D 4 231 ? -37.716 -51.836 -48.508 1.00 88.95 ? 233 PRO D CG 1 ATOM 6439 C CD . PRO D 4 231 ? -39.149 -51.417 -48.567 1.00 89.11 ? 233 PRO D CD 1 ATOM 6440 N N . VAL D 4 232 ? -39.268 -53.924 -52.107 1.00 88.54 ? 234 VAL D N 1 ATOM 6441 C CA . VAL D 4 232 ? -39.317 -55.277 -52.684 1.00 88.32 ? 234 VAL D CA 1 ATOM 6442 C C . VAL D 4 232 ? -38.311 -55.478 -53.822 1.00 88.14 ? 234 VAL D C 1 ATOM 6443 O O . VAL D 4 232 ? -37.587 -54.553 -54.198 1.00 88.16 ? 234 VAL D O 1 ATOM 6444 C CB . VAL D 4 232 ? -40.750 -55.670 -53.196 1.00 88.32 ? 234 VAL D CB 1 ATOM 6445 C CG1 . VAL D 4 232 ? -41.675 -56.014 -52.039 1.00 88.21 ? 234 VAL D CG1 1 ATOM 6446 C CG2 . VAL D 4 232 ? -41.351 -54.583 -54.094 1.00 88.31 ? 234 VAL D CG2 1 ATOM 6447 N N . THR D 4 233 ? -38.270 -56.699 -54.352 1.00 87.84 ? 235 THR D N 1 ATOM 6448 C CA . THR D 4 233 ? -37.530 -56.995 -55.568 1.00 87.49 ? 235 THR D CA 1 ATOM 6449 C C . THR D 4 233 ? -38.318 -56.456 -56.758 1.00 87.28 ? 235 THR D C 1 ATOM 6450 O O . THR D 4 233 ? -39.462 -56.845 -56.986 1.00 87.06 ? 235 THR D O 1 ATOM 6451 C CB . THR D 4 233 ? -37.265 -58.503 -55.700 1.00 87.50 ? 235 THR D CB 1 ATOM 6452 O OG1 . THR D 4 233 ? -36.350 -58.910 -54.675 1.00 87.27 ? 235 THR D OG1 1 ATOM 6453 C CG2 . THR D 4 233 ? -36.672 -58.839 -57.064 1.00 87.68 ? 235 THR D CG2 1 ATOM 6454 N N . GLN D 4 234 ? -37.696 -55.544 -57.499 1.00 87.29 ? 236 GLN D N 1 ATOM 6455 C CA . GLN D 4 234 ? -38.372 -54.804 -58.559 1.00 87.35 ? 236 GLN D CA 1 ATOM 6456 C C . GLN D 4 234 ? -37.429 -54.343 -59.676 1.00 87.65 ? 236 GLN D C 1 ATOM 6457 O O . GLN D 4 234 ? -36.210 -54.284 -59.495 1.00 87.55 ? 236 GLN D O 1 ATOM 6458 C CB . GLN D 4 234 ? -39.127 -53.604 -57.964 1.00 87.19 ? 236 GLN D CB 1 ATOM 6459 C CG . GLN D 4 234 ? -38.308 -52.744 -56.996 1.00 86.42 ? 236 GLN D CG 1 ATOM 6460 C CD . GLN D 4 234 ? -39.138 -51.675 -56.304 1.00 85.57 ? 236 GLN D CD 1 ATOM 6461 O OE1 . GLN D 4 234 ? -39.844 -50.906 -56.950 1.00 85.33 ? 236 GLN D OE1 1 ATOM 6462 N NE2 . GLN D 4 234 ? -39.047 -51.619 -54.984 1.00 85.17 ? 236 GLN D NE2 1 ATOM 6463 N N . ILE D 4 235 ? -38.015 -54.034 -60.832 1.00 88.07 ? 237 ILE D N 1 ATOM 6464 C CA . ILE D 4 235 ? -37.308 -53.389 -61.935 1.00 88.57 ? 237 ILE D CA 1 ATOM 6465 C C . ILE D 4 235 ? -37.757 -51.938 -62.030 1.00 88.90 ? 237 ILE D C 1 ATOM 6466 O O . ILE D 4 235 ? -38.946 -51.657 -62.199 1.00 88.94 ? 237 ILE D O 1 ATOM 6467 C CB . ILE D 4 235 ? -37.586 -54.084 -63.295 1.00 88.63 ? 237 ILE D CB 1 ATOM 6468 C CG1 . ILE D 4 235 ? -36.911 -55.458 -63.351 1.00 88.96 ? 237 ILE D CG1 1 ATOM 6469 C CG2 . ILE D 4 235 ? -37.136 -53.196 -64.475 1.00 88.48 ? 237 ILE D CG2 1 ATOM 6470 C CD1 . ILE D 4 235 ? -37.525 -56.420 -64.371 1.00 89.02 ? 237 ILE D CD1 1 ATOM 6471 N N . VAL D 4 236 ? -36.804 -51.021 -61.915 1.00 89.34 ? 238 VAL D N 1 ATOM 6472 C CA . VAL D 4 236 ? -37.067 -49.608 -62.158 1.00 89.84 ? 238 VAL D CA 1 ATOM 6473 C C . VAL D 4 236 ? -36.129 -49.089 -63.257 1.00 90.23 ? 238 VAL D C 1 ATOM 6474 O O . VAL D 4 236 ? -34.907 -49.142 -63.121 1.00 90.31 ? 238 VAL D O 1 ATOM 6475 C CB . VAL D 4 236 ? -37.006 -48.762 -60.841 1.00 89.84 ? 238 VAL D CB 1 ATOM 6476 C CG1 . VAL D 4 236 ? -35.724 -49.031 -60.042 1.00 89.56 ? 238 VAL D CG1 1 ATOM 6477 C CG2 . VAL D 4 236 ? -37.186 -47.276 -61.129 1.00 90.03 ? 238 VAL D CG2 1 ATOM 6478 N N . SER D 4 237 ? -36.712 -48.620 -64.356 1.00 90.70 ? 239 SER D N 1 ATOM 6479 C CA . SER D 4 237 ? -35.928 -48.140 -65.491 1.00 91.22 ? 239 SER D CA 1 ATOM 6480 C C . SER D 4 237 ? -36.182 -46.660 -65.797 1.00 91.68 ? 239 SER D C 1 ATOM 6481 O O . SER D 4 237 ? -37.056 -46.039 -65.195 1.00 91.77 ? 239 SER D O 1 ATOM 6482 C CB . SER D 4 237 ? -36.152 -49.026 -66.734 1.00 91.13 ? 239 SER D CB 1 ATOM 6483 O OG . SER D 4 237 ? -37.515 -49.338 -66.947 1.00 90.90 ? 239 SER D OG 1 ATOM 6484 N N . ALA D 4 238 ? -35.389 -46.096 -66.705 1.00 92.32 ? 240 ALA D N 1 ATOM 6485 C CA . ALA D 4 238 ? -35.631 -44.755 -67.228 1.00 92.97 ? 240 ALA D CA 1 ATOM 6486 C C . ALA D 4 238 ? -35.527 -44.780 -68.747 1.00 93.49 ? 240 ALA D C 1 ATOM 6487 O O . ALA D 4 238 ? -34.503 -45.171 -69.309 1.00 93.58 ? 240 ALA D O 1 ATOM 6488 C CB . ALA D 4 238 ? -34.667 -43.750 -66.632 1.00 92.86 ? 240 ALA D CB 1 ATOM 6489 N N . GLU D 4 239 ? -36.606 -44.347 -69.389 1.00 94.18 ? 241 GLU D N 1 ATOM 6490 C CA . GLU D 4 239 ? -36.819 -44.496 -70.822 1.00 94.82 ? 241 GLU D CA 1 ATOM 6491 C C . GLU D 4 239 ? -36.577 -43.170 -71.557 1.00 95.10 ? 241 GLU D C 1 ATOM 6492 O O . GLU D 4 239 ? -36.950 -42.100 -71.057 1.00 95.29 ? 241 GLU D O 1 ATOM 6493 C CB . GLU D 4 239 ? -38.256 -44.985 -71.019 1.00 94.84 ? 241 GLU D CB 1 ATOM 6494 C CG . GLU D 4 239 ? -38.735 -45.157 -72.436 1.00 95.57 ? 241 GLU D CG 1 ATOM 6495 C CD . GLU D 4 239 ? -40.090 -45.841 -72.487 1.00 96.76 ? 241 GLU D CD 1 ATOM 6496 O OE1 . GLU D 4 239 ? -40.386 -46.648 -71.576 1.00 97.26 ? 241 GLU D OE1 1 ATOM 6497 O OE2 . GLU D 4 239 ? -40.859 -45.578 -73.435 1.00 97.34 ? 241 GLU D OE2 1 ATOM 6498 N N . ALA D 4 240 ? -35.933 -43.240 -72.725 1.00 95.33 ? 242 ALA D N 1 ATOM 6499 C CA . ALA D 4 240 ? -35.748 -42.062 -73.590 1.00 95.53 ? 242 ALA D CA 1 ATOM 6500 C C . ALA D 4 240 ? -35.687 -42.448 -75.074 1.00 95.69 ? 242 ALA D C 1 ATOM 6501 O O . ALA D 4 240 ? -35.347 -43.582 -75.419 1.00 95.76 ? 242 ALA D O 1 ATOM 6502 C CB . ALA D 4 240 ? -34.507 -41.264 -73.178 1.00 95.43 ? 242 ALA D CB 1 ATOM 6503 N N . TRP D 4 241 ? -36.025 -41.504 -75.950 1.00 95.81 ? 243 TRP D N 1 ATOM 6504 C CA . TRP D 4 241 ? -36.066 -41.778 -77.388 1.00 95.90 ? 243 TRP D CA 1 ATOM 6505 C C . TRP D 4 241 ? -34.951 -41.110 -78.189 1.00 95.89 ? 243 TRP D C 1 ATOM 6506 O O . TRP D 4 241 ? -34.808 -41.348 -79.392 1.00 95.81 ? 243 TRP D O 1 ATOM 6507 C CB . TRP D 4 241 ? -37.431 -41.413 -77.967 1.00 96.02 ? 243 TRP D CB 1 ATOM 6508 C CG . TRP D 4 241 ? -38.207 -42.599 -78.432 1.00 96.09 ? 243 TRP D CG 1 ATOM 6509 C CD1 . TRP D 4 241 ? -38.038 -43.272 -79.607 1.00 96.20 ? 243 TRP D CD1 1 ATOM 6510 C CD2 . TRP D 4 241 ? -39.275 -43.255 -77.742 1.00 96.12 ? 243 TRP D CD2 1 ATOM 6511 N NE1 . TRP D 4 241 ? -38.936 -44.308 -79.695 1.00 96.29 ? 243 TRP D NE1 1 ATOM 6512 C CE2 . TRP D 4 241 ? -39.709 -44.323 -78.565 1.00 96.21 ? 243 TRP D CE2 1 ATOM 6513 C CE3 . TRP D 4 241 ? -39.908 -43.047 -76.508 1.00 96.14 ? 243 TRP D CE3 1 ATOM 6514 C CZ2 . TRP D 4 241 ? -40.749 -45.185 -78.195 1.00 96.25 ? 243 TRP D CZ2 1 ATOM 6515 C CZ3 . TRP D 4 241 ? -40.944 -43.902 -76.140 1.00 96.58 ? 243 TRP D CZ3 1 ATOM 6516 C CH2 . TRP D 4 241 ? -41.354 -44.961 -76.985 1.00 96.45 ? 243 TRP D CH2 1 HETATM 6517 C C1 . NAG E 5 . ? 0.728 -106.083 -65.107 1.00 55.31 ? 305 NAG A C1 1 HETATM 6518 C C2 . NAG E 5 . ? 0.657 -105.237 -66.375 1.00 56.90 ? 305 NAG A C2 1 HETATM 6519 C C3 . NAG E 5 . ? -0.726 -105.337 -67.006 1.00 58.59 ? 305 NAG A C3 1 HETATM 6520 C C4 . NAG E 5 . ? -1.366 -106.726 -66.991 1.00 60.32 ? 305 NAG A C4 1 HETATM 6521 C C5 . NAG E 5 . ? -0.994 -107.526 -65.730 1.00 58.94 ? 305 NAG A C5 1 HETATM 6522 C C6 . NAG E 5 . ? -1.389 -108.995 -65.856 1.00 59.43 ? 305 NAG A C6 1 HETATM 6523 C C7 . NAG E 5 . ? 2.032 -103.204 -66.481 1.00 55.39 ? 305 NAG A C7 1 HETATM 6524 C C8 . NAG E 5 . ? 2.147 -101.760 -66.097 1.00 55.40 ? 305 NAG A C8 1 HETATM 6525 N N2 . NAG E 5 . ? 0.926 -103.838 -66.093 1.00 55.74 ? 305 NAG A N2 1 HETATM 6526 O O3 . NAG E 5 . ? -0.646 -104.878 -68.334 1.00 59.56 ? 305 NAG A O3 1 HETATM 6527 O O4 . NAG E 5 . ? -2.741 -106.419 -66.954 1.00 64.23 ? 305 NAG A O4 1 HETATM 6528 O O5 . NAG E 5 . ? 0.386 -107.413 -65.420 1.00 56.55 ? 305 NAG A O5 1 HETATM 6529 O O6 . NAG E 5 . ? -0.303 -109.837 -65.535 1.00 60.51 ? 305 NAG A O6 1 HETATM 6530 O O7 . NAG E 5 . ? 2.939 -103.734 -67.116 1.00 55.55 ? 305 NAG A O7 1 HETATM 6531 C C1 . NAG F 5 . ? -3.675 -106.969 -67.938 1.00 67.54 ? 306 NAG A C1 1 HETATM 6532 C C2 . NAG F 5 . ? -3.550 -106.575 -69.424 1.00 68.56 ? 306 NAG A C2 1 HETATM 6533 C C3 . NAG F 5 . ? -4.840 -106.959 -70.168 1.00 68.97 ? 306 NAG A C3 1 HETATM 6534 C C4 . NAG F 5 . ? -5.539 -108.232 -69.663 1.00 69.57 ? 306 NAG A C4 1 HETATM 6535 C C5 . NAG F 5 . ? -5.368 -108.436 -68.141 1.00 69.22 ? 306 NAG A C5 1 HETATM 6536 C C6 . NAG F 5 . ? -5.986 -109.704 -67.556 1.00 68.77 ? 306 NAG A C6 1 HETATM 6537 C C7 . NAG F 5 . ? -2.934 -104.483 -70.597 1.00 70.30 ? 306 NAG A C7 1 HETATM 6538 C C8 . NAG F 5 . ? -2.871 -102.981 -70.478 1.00 69.70 ? 306 NAG A C8 1 HETATM 6539 N N2 . NAG F 5 . ? -3.405 -105.134 -69.529 1.00 69.69 ? 306 NAG A N2 1 HETATM 6540 O O3 . NAG F 5 . ? -4.600 -107.053 -71.556 1.00 68.46 ? 306 NAG A O3 1 HETATM 6541 O O4 . NAG F 5 . ? -6.902 -108.107 -70.014 1.00 70.41 ? 306 NAG A O4 1 HETATM 6542 O O5 . NAG F 5 . ? -3.990 -108.348 -67.816 1.00 68.39 ? 306 NAG A O5 1 HETATM 6543 O O6 . NAG F 5 . ? -6.693 -109.350 -66.387 1.00 68.09 ? 306 NAG A O6 1 HETATM 6544 O O7 . NAG F 5 . ? -2.563 -105.052 -71.629 1.00 70.67 ? 306 NAG A O7 1 HETATM 6545 C C1 . NAG G 5 . ? -0.926 -93.208 -36.053 1.00 60.39 ? 304 NAG A C1 1 HETATM 6546 C C2 . NAG G 5 . ? -1.705 -92.505 -34.933 1.00 62.00 ? 304 NAG A C2 1 HETATM 6547 C C3 . NAG G 5 . ? -2.411 -91.234 -35.404 1.00 62.51 ? 304 NAG A C3 1 HETATM 6548 C C4 . NAG G 5 . ? -1.437 -90.296 -36.104 1.00 63.18 ? 304 NAG A C4 1 HETATM 6549 C C5 . NAG G 5 . ? -0.715 -91.057 -37.226 1.00 62.70 ? 304 NAG A C5 1 HETATM 6550 C C6 . NAG G 5 . ? 0.408 -90.204 -37.810 1.00 63.40 ? 304 NAG A C6 1 HETATM 6551 C C7 . NAG G 5 . ? -2.528 -93.966 -33.131 1.00 62.65 ? 304 NAG A C7 1 HETATM 6552 C C8 . NAG G 5 . ? -1.320 -93.608 -32.306 1.00 62.93 ? 304 NAG A C8 1 HETATM 6553 N N2 . NAG G 5 . ? -2.664 -93.423 -34.347 1.00 62.29 ? 304 NAG A N2 1 HETATM 6554 O O3 . NAG G 5 . ? -2.948 -90.560 -34.296 1.00 62.77 ? 304 NAG A O3 1 HETATM 6555 O O4 . NAG G 5 . ? -2.120 -89.141 -36.581 1.00 63.86 ? 304 NAG A O4 1 HETATM 6556 O O5 . NAG G 5 . ? -0.130 -92.272 -36.769 1.00 61.33 ? 304 NAG A O5 1 HETATM 6557 O O6 . NAG G 5 . ? 1.595 -90.405 -37.065 1.00 63.89 ? 304 NAG A O6 1 HETATM 6558 O O7 . NAG G 5 . ? -3.356 -94.750 -32.672 1.00 62.28 ? 304 NAG A O7 1 HETATM 6559 C C1 . NAG H 5 . ? -12.639 -94.095 -30.407 1.00 62.89 ? 303 NAG A C1 1 HETATM 6560 C C2 . NAG H 5 . ? -12.746 -93.214 -29.149 1.00 64.19 ? 303 NAG A C2 1 HETATM 6561 C C3 . NAG H 5 . ? -11.477 -93.348 -28.298 1.00 65.00 ? 303 NAG A C3 1 HETATM 6562 C C4 . NAG H 5 . ? -11.303 -94.814 -27.881 1.00 65.44 ? 303 NAG A C4 1 HETATM 6563 C C5 . NAG H 5 . ? -11.219 -95.693 -29.134 1.00 65.24 ? 303 NAG A C5 1 HETATM 6564 C C6 . NAG H 5 . ? -11.308 -97.173 -28.751 1.00 65.72 ? 303 NAG A C6 1 HETATM 6565 C C7 . NAG H 5 . ? -14.275 -91.372 -29.755 1.00 64.49 ? 303 NAG A C7 1 HETATM 6566 C C8 . NAG H 5 . ? -14.399 -89.898 -29.997 1.00 64.54 ? 303 NAG A C8 1 HETATM 6567 N N2 . NAG H 5 . ? -13.053 -91.816 -29.432 1.00 64.06 ? 303 NAG A N2 1 HETATM 6568 O O3 . NAG H 5 . ? -11.550 -92.503 -27.166 1.00 65.57 ? 303 NAG A O3 1 HETATM 6569 O O4 . NAG H 5 . ? -10.185 -95.007 -27.029 1.00 65.59 ? 303 NAG A O4 1 HETATM 6570 O O5 . NAG H 5 . ? -12.296 -95.432 -30.030 1.00 64.47 ? 303 NAG A O5 1 HETATM 6571 O O6 . NAG H 5 . ? -10.194 -97.897 -29.231 1.00 66.13 ? 303 NAG A O6 1 HETATM 6572 O O7 . NAG H 5 . ? -15.274 -92.087 -29.872 1.00 64.30 ? 303 NAG A O7 1 HETATM 6573 C C . 3GB I 6 . ? -4.821 -94.100 -52.628 1.00 45.31 ? 307 3GB A C 1 HETATM 6574 N N . 3GB I 6 . ? -2.832 -94.231 -53.878 1.00 44.98 ? 307 3GB A N 1 HETATM 6575 O O . 3GB I 6 . ? -5.513 -93.662 -51.613 1.00 45.40 ? 307 3GB A O 1 HETATM 6576 C C1 . 3GB I 6 . ? 0.130 -91.064 -64.367 1.00 59.24 ? 307 3GB A C1 1 HETATM 6577 O O1 . 3GB I 6 . ? -0.018 -91.403 -62.951 1.00 60.12 ? 307 3GB A O1 1 HETATM 6578 C C2 . 3GB I 6 . ? -1.255 -91.068 -65.045 1.00 58.81 ? 307 3GB A C2 1 HETATM 6579 O O2 . 3GB I 6 . ? -2.108 -90.139 -64.388 1.00 59.19 ? 307 3GB A O2 1 HETATM 6580 C C3 . 3GB I 6 . ? -1.885 -92.460 -64.997 1.00 58.50 ? 307 3GB A C3 1 HETATM 6581 O O3 . 3GB I 6 . ? -3.064 -92.479 -65.803 1.00 58.04 ? 307 3GB A O3 1 HETATM 6582 C C4 . 3GB I 6 . ? -0.908 -93.519 -65.498 1.00 59.01 ? 307 3GB A C4 1 HETATM 6583 O O4 . 3GB I 6 . ? -0.733 -93.376 -66.911 1.00 58.50 ? 307 3GB A O4 1 HETATM 6584 C C5 . 3GB I 6 . ? 0.456 -93.388 -64.795 1.00 59.65 ? 307 3GB A C5 1 HETATM 6585 O O5 . 3GB I 6 . ? 0.993 -92.047 -65.016 1.00 59.10 ? 307 3GB A O5 1 HETATM 6586 C C6 . 3GB I 6 . ? 1.435 -94.436 -65.370 1.00 60.15 ? 307 3GB A C6 1 HETATM 6587 O O6 . 3GB I 6 . ? 2.096 -93.895 -66.502 1.00 60.07 ? 307 3GB A O6 1 HETATM 6588 C CA . 3GB I 6 . ? -3.492 -93.379 -52.883 1.00 45.37 ? 307 3GB A CA 1 HETATM 6589 C CB . 3GB I 6 . ? -4.055 -92.125 -53.541 1.00 45.53 ? 307 3GB A CB 1 HETATM 6590 C CAL . 3GB I 6 . ? 0.289 -91.467 -59.470 1.00 58.64 ? 307 3GB A CAL 1 HETATM 6591 C CAM . 3GB I 6 . ? 1.191 -92.391 -60.359 1.00 59.67 ? 307 3GB A CAM 1 HETATM 6592 C CAN . 3GB I 6 . ? 1.918 -91.572 -61.449 1.00 59.80 ? 307 3GB A CAN 1 HETATM 6593 C CAO . 3GB I 6 . ? 0.957 -90.621 -62.149 1.00 60.17 ? 307 3GB A CAO 1 HETATM 6594 C CAP . 3GB I 6 . ? 0.221 -89.806 -61.121 1.00 60.18 ? 307 3GB A CAP 1 HETATM 6595 C CAQ . 3GB I 6 . ? -0.663 -88.793 -61.817 1.00 60.51 ? 307 3GB A CAQ 1 HETATM 6596 O OAR . 3GB I 6 . ? 2.152 -93.049 -59.539 1.00 61.24 ? 307 3GB A OAR 1 HETATM 6597 O OAS . 3GB I 6 . ? 2.492 -92.459 -62.407 1.00 59.60 ? 307 3GB A OAS 1 HETATM 6598 O OAU . 3GB I 6 . ? -0.572 -90.655 -60.327 1.00 59.30 ? 307 3GB A OAU 1 HETATM 6599 O OAV . 3GB I 6 . ? -0.908 -87.689 -60.940 1.00 60.88 ? 307 3GB A OAV 1 HETATM 6600 C CAW . 3GB I 6 . ? -3.016 -90.689 -56.299 1.00 51.62 ? 307 3GB A CAW 1 HETATM 6601 C CAX . 3GB I 6 . ? -2.426 -91.129 -57.656 1.00 52.89 ? 307 3GB A CAX 1 HETATM 6602 C CAY . 3GB I 6 . ? -0.903 -91.487 -57.518 1.00 53.97 ? 307 3GB A CAY 1 HETATM 6603 C CAZ . 3GB I 6 . ? -0.679 -92.304 -56.226 1.00 52.72 ? 307 3GB A CAZ 1 HETATM 6604 C CBA . 3GB I 6 . ? 0.816 -92.539 -56.024 1.00 52.68 ? 307 3GB A CBA 1 HETATM 6605 C CBB . 3GB I 6 . ? -2.559 -91.600 -55.191 1.00 50.02 ? 307 3GB A CBB 1 HETATM 6606 O OBC . 3GB I 6 . ? -3.086 -91.143 -53.953 1.00 47.35 ? 307 3GB A OBC 1 HETATM 6607 O OBD . 3GB I 6 . ? -4.451 -90.704 -56.372 1.00 51.28 ? 307 3GB A OBD 1 HETATM 6608 O OBE . 3GB I 6 . ? -2.585 -90.072 -58.612 1.00 52.82 ? 307 3GB A OBE 1 HETATM 6609 O OBF . 3GB I 6 . ? -0.495 -92.250 -58.634 1.00 56.59 ? 307 3GB A OBF 1 HETATM 6610 O OBG . 3GB I 6 . ? -1.191 -91.599 -55.134 1.00 50.97 ? 307 3GB A OBG 1 HETATM 6611 O OBH . 3GB I 6 . ? 1.448 -91.309 -55.659 1.00 52.88 ? 307 3GB A OBH 1 HETATM 6612 C CBI . 3GB I 6 . ? -15.697 -99.024 -46.071 1.00 45.72 ? 307 3GB A CBI 1 HETATM 6613 C CBJ . 3GB I 6 . ? -15.344 -100.239 -46.939 1.00 45.80 ? 307 3GB A CBJ 1 HETATM 6614 C CBK . 3GB I 6 . ? -13.878 -100.139 -47.389 1.00 46.17 ? 307 3GB A CBK 1 HETATM 6615 C CBL . 3GB I 6 . ? -13.571 -100.977 -48.646 1.00 45.83 ? 307 3GB A CBL 1 HETATM 6616 C CBM . 3GB I 6 . ? -12.481 -102.025 -48.346 1.00 45.58 ? 307 3GB A CBM 1 HETATM 6617 C CBN . 3GB I 6 . ? -11.564 -102.281 -49.546 1.00 45.39 ? 307 3GB A CBN 1 HETATM 6618 C CBO . 3GB I 6 . ? -10.374 -101.316 -49.558 1.00 45.16 ? 307 3GB A CBO 1 HETATM 6619 C CBP . 3GB I 6 . ? -10.084 -100.814 -50.975 1.00 44.47 ? 307 3GB A CBP 1 HETATM 6620 C CBQ . 3GB I 6 . ? -8.753 -101.347 -51.492 1.00 44.06 ? 307 3GB A CBQ 1 HETATM 6621 C CBR . 3GB I 6 . ? -7.603 -100.684 -50.742 1.00 44.21 ? 307 3GB A CBR 1 HETATM 6622 C CBS . 3GB I 6 . ? -6.712 -99.912 -51.699 1.00 44.38 ? 307 3GB A CBS 1 HETATM 6623 C CBT . 3GB I 6 . ? -6.794 -98.403 -51.488 1.00 44.41 ? 307 3GB A CBT 1 HETATM 6624 C CBU . 3GB I 6 . ? -5.774 -97.691 -52.380 1.00 44.05 ? 307 3GB A CBU 1 HETATM 6625 C CBV . 3GB I 6 . ? -5.749 -96.340 -52.087 1.00 44.63 ? 307 3GB A CBV 1 HETATM 6626 C CBW . 3GB I 6 . ? -4.726 -95.556 -52.589 1.00 45.32 ? 307 3GB A CBW 1 HETATM 6627 C CCC . 3GB I 6 . ? -1.607 -94.711 -53.714 1.00 44.84 ? 307 3GB A CCC 1 HETATM 6628 O OCD . 3GB I 6 . ? -0.876 -94.450 -52.755 1.00 45.06 ? 307 3GB A OCD 1 HETATM 6629 C CCE . 3GB I 6 . ? -1.140 -95.614 -54.852 1.00 44.26 ? 307 3GB A CCE 1 HETATM 6630 C CCF . 3GB I 6 . ? -0.336 -96.806 -54.332 1.00 43.38 ? 307 3GB A CCF 1 HETATM 6631 C CCG . 3GB I 6 . ? -1.222 -97.821 -53.615 1.00 42.66 ? 307 3GB A CCG 1 HETATM 6632 C CCH . 3GB I 6 . ? -0.364 -98.780 -52.799 1.00 42.13 ? 307 3GB A CCH 1 HETATM 6633 C CCI . 3GB I 6 . ? -1.105 -100.088 -52.542 1.00 42.53 ? 307 3GB A CCI 1 HETATM 6634 C CCJ . 3GB I 6 . ? -0.136 -101.133 -51.990 1.00 43.14 ? 307 3GB A CCJ 1 HETATM 6635 C CCK . 3GB I 6 . ? -0.783 -101.968 -51.089 1.00 43.90 ? 307 3GB A CCK 1 HETATM 6636 C CCL . 3GB I 6 . ? -0.194 -102.471 -49.924 1.00 44.09 ? 307 3GB A CCL 1 HETATM 6637 C CCM . 3GB I 6 . ? 1.110 -102.213 -49.497 1.00 43.10 ? 307 3GB A CCM 1 HETATM 6638 C CCN . 3GB I 6 . ? 1.246 -102.503 -47.989 1.00 41.56 ? 307 3GB A CCN 1 HETATM 6639 C CCO . 3GB I 6 . ? 2.695 -102.802 -47.608 1.00 39.71 ? 307 3GB A CCO 1 HETATM 6640 C CCP . 3GB I 6 . ? 3.040 -102.249 -46.233 1.00 38.12 ? 307 3GB A CCP 1 HETATM 6641 C CCQ . 3GB I 6 . ? 4.294 -101.383 -46.276 1.00 37.72 ? 307 3GB A CCQ 1 HETATM 6642 C CCR . 3GB I 6 . ? 5.371 -101.992 -47.176 1.00 38.29 ? 307 3GB A CCR 1 HETATM 6643 C CCS . 3GB I 6 . ? 6.674 -102.258 -46.410 1.00 38.83 ? 307 3GB A CCS 1 HETATM 6644 C CCT . 3GB I 6 . ? 7.908 -102.179 -47.327 1.00 39.41 ? 307 3GB A CCT 1 HETATM 6645 C CCU . 3GB I 6 . ? 8.063 -103.406 -48.241 1.00 39.76 ? 307 3GB A CCU 1 HETATM 6646 C CCV . 3GB I 6 . ? 9.326 -103.301 -49.107 1.00 40.30 ? 307 3GB A CCV 1 HETATM 6647 C CCW . 3GB I 6 . ? 9.113 -103.877 -50.515 1.00 41.63 ? 307 3GB A CCW 1 HETATM 6648 C CCX . 3GB I 6 . ? 8.409 -102.882 -51.460 1.00 42.34 ? 307 3GB A CCX 1 HETATM 6649 C CCY . 3GB I 6 . ? 7.912 -103.550 -52.757 1.00 43.34 ? 307 3GB A CCY 1 HETATM 6650 C CCZ . 3GB I 6 . ? 6.863 -104.638 -52.491 1.00 43.81 ? 307 3GB A CCZ 1 HETATM 6651 C CDA . 3GB I 6 . ? 5.829 -104.700 -53.613 1.00 44.07 ? 307 3GB A CDA 1 HETATM 6652 C CDB . 3GB I 6 . ? 4.460 -105.144 -53.083 1.00 44.19 ? 307 3GB A CDB 1 HETATM 6653 C CDC . 3GB I 6 . ? 3.612 -103.939 -52.639 1.00 44.49 ? 307 3GB A CDC 1 HETATM 6654 O O . HOH J 7 . ? -1.573 -113.819 -45.982 1.00 34.24 ? 309 HOH A O 1 HETATM 6655 O O . HOH J 7 . ? -20.078 -106.416 -43.062 1.00 28.24 ? 310 HOH A O 1 HETATM 6656 O O . HOH J 7 . ? -19.564 -107.700 -40.284 1.00 47.48 ? 311 HOH A O 1 HETATM 6657 O O . HOH J 7 . ? -21.706 -102.517 -33.950 1.00 24.43 ? 312 HOH A O 1 HETATM 6658 O O . HOH J 7 . ? 24.655 -97.621 -51.203 1.00 46.37 ? 313 HOH A O 1 HETATM 6659 O O . HOH J 7 . ? -6.178 -115.067 -49.390 1.00 35.49 ? 314 HOH A O 1 HETATM 6660 O O . HOH J 7 . ? 20.373 -106.887 -37.534 1.00 60.37 ? 315 HOH A O 1 HETATM 6661 O O . HOH J 7 . ? -1.362 -115.490 -50.794 1.00 20.11 ? 316 HOH A O 1 HETATM 6662 O O . HOH J 7 . ? 12.237 -97.284 -56.740 1.00 41.09 ? 317 HOH A O 1 HETATM 6663 O O . HOH J 7 . ? 4.884 -110.511 -62.500 1.00 27.70 ? 318 HOH A O 1 HETATM 6664 O O . HOH J 7 . ? 13.177 -133.371 -43.113 1.00 50.65 ? 319 HOH A O 1 HETATM 6665 O O . HOH J 7 . ? 11.376 -142.639 -16.915 1.00 19.62 ? 320 HOH A O 1 HETATM 6666 O O . HOH J 7 . ? 22.212 -135.228 -19.082 1.00 39.26 ? 321 HOH A O 1 HETATM 6667 O O . HOH J 7 . ? 10.093 -118.514 -37.507 1.00 46.11 ? 322 HOH A O 1 HETATM 6668 O O . HOH J 7 . ? 9.214 -95.637 -56.139 1.00 23.65 ? 323 HOH A O 1 HETATM 6669 O O . HOH J 7 . ? -1.719 -110.895 -63.071 1.00 23.05 ? 324 HOH A O 1 HETATM 6670 O O . HOH K 7 . ? -14.692 -115.288 -20.824 1.00 34.97 ? 100 HOH B O 1 HETATM 6671 O O . HOH K 7 . ? -15.655 -116.102 -30.615 1.00 42.13 ? 101 HOH B O 1 HETATM 6672 O O . HOH K 7 . ? -5.975 -122.391 -25.754 1.00 32.10 ? 102 HOH B O 1 HETATM 6673 O O . HOH K 7 . ? 15.431 -115.921 -15.756 1.00 32.06 ? 103 HOH B O 1 HETATM 6674 O O . HOH K 7 . ? -17.663 -111.015 -24.156 1.00 57.83 ? 104 HOH B O 1 HETATM 6675 O O . HOH K 7 . ? 3.265 -114.789 -42.057 1.00 20.63 ? 105 HOH B O 1 HETATM 6676 O O . HOH K 7 . ? -3.224 -117.518 -36.216 1.00 25.97 ? 106 HOH B O 1 HETATM 6677 O O . HOH K 7 . ? -8.884 -100.363 -29.674 1.00 24.27 ? 308 HOH B O 1 HETATM 6678 O O . HOH L 7 . ? -25.840 -29.923 -56.513 1.00 44.12 ? 102 HOH C O 1 HETATM 6679 O O . HOH L 7 . ? -25.400 -32.025 -54.289 1.00 38.48 ? 211 HOH C O 1 HETATM 6680 O O . HOH L 7 . ? -8.026 -92.707 -53.856 1.00 45.34 ? 212 HOH C O 1 HETATM 6681 O O . HOH L 7 . ? -26.607 -27.738 -58.507 1.00 27.85 ? 213 HOH C O 1 HETATM 6682 O O . HOH L 7 . ? -11.012 -32.807 -57.950 1.00 47.38 ? 214 HOH C O 1 HETATM 6683 O O . HOH L 7 . ? -15.957 -61.310 -69.192 1.00 26.74 ? 215 HOH C O 1 HETATM 6684 O O . HOH L 7 . ? -5.256 -80.295 -76.039 1.00 20.94 ? 216 HOH C O 1 HETATM 6685 O O . HOH L 7 . ? -14.716 -85.708 -51.005 1.00 46.79 ? 217 HOH C O 1 HETATM 6686 O O . HOH L 7 . ? 0.341 -86.756 -47.181 1.00 29.82 ? 218 HOH C O 1 HETATM 6687 O O . HOH L 7 . ? -27.636 -28.716 -64.789 1.00 47.56 ? 219 HOH C O 1 HETATM 6688 O O . HOH M 7 . ? -30.374 -76.503 -43.929 1.00 35.70 ? 248 HOH D O 1 HETATM 6689 O O . HOH M 7 . ? -29.382 -44.736 -45.607 1.00 50.53 ? 249 HOH D O 1 HETATM 6690 O O . HOH M 7 . ? -29.291 -33.808 -86.160 1.00 29.08 ? 250 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 7 ASN ASN 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 109 109 109 GLY GLY A . n A 1 110 ASN 110 110 110 ASN ASN A . n A 1 111 ALA 111 111 111 ALA ALA 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 198 198 198 SER SER A . n A 1 199 SER 199 199 199 SER SER A . n A 1 200 ALA 200 200 200 ALA ALA A . n A 1 201 HIS 201 201 201 HIS HIS 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 GLY 280 280 280 GLY GLY A . n A 1 281 SER 281 281 281 SER SER A . n A 1 282 LEU 282 282 282 LEU LEU A . n A 1 283 HIS 283 283 283 HIS HIS A . n A 1 284 HIS 284 284 284 HIS HIS A . n A 1 285 ILE 285 285 285 ILE ILE A . n A 1 286 LEU 286 286 286 LEU LEU A . n A 1 287 ASP 287 287 287 ASP ASP A . n A 1 288 ALA 288 288 288 ALA ALA A . n A 1 289 GLN 289 289 289 GLN GLN A . n A 1 290 LYS 290 290 290 LYS LYS A . n A 1 291 MET 291 291 291 MET MET A . n A 1 292 VAL 292 292 292 VAL VAL A . n A 1 293 TRP 293 293 293 TRP TRP A . n A 1 294 ASN 294 294 294 ASN ASN A . n A 1 295 HIS 295 295 295 HIS HIS A . n A 1 296 ARG 296 296 ? ? ? A . n A 1 297 HIS 297 297 ? ? ? A . n A 1 298 HIS 298 298 ? ? ? A . n A 1 299 HIS 299 299 ? ? ? A . n A 1 300 HIS 300 300 ? ? ? A . n A 1 301 HIS 301 301 ? ? ? A . n A 1 302 HIS 302 302 ? ? ? A . n B 2 1 ILE 1 1 1 ILE ALA 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 3 1 THR 1 1 1 THR THR C . n C 3 2 GLN 2 2 2 GLN GLN C . n C 3 3 VAL 3 3 3 VAL VAL C . n C 3 4 GLU 4 4 4 GLU GLU C . n C 3 5 GLN 5 5 5 GLN GLN C . n C 3 6 SER 6 6 6 SER SER C . n C 3 7 PRO 7 7 7 PRO PRO C . n C 3 8 GLN 8 8 8 GLN GLN C . n C 3 9 SER 9 9 9 SER SER C . n C 3 10 LEU 10 10 10 LEU LEU C . n C 3 11 VAL 11 11 11 VAL VAL C . n C 3 12 VAL 12 12 12 VAL VAL C . n C 3 13 ARG 13 13 13 ARG ARG C . n C 3 14 GLN 14 14 14 GLN GLN C . n C 3 15 GLY 15 15 15 GLY GLY C . n C 3 16 GLU 16 16 16 GLU GLU C . n C 3 17 ASN 17 17 17 ASN ASN C . n C 3 18 SER 18 18 18 SER SER C . n C 3 19 VAL 19 19 19 VAL VAL C . n C 3 20 LEU 20 20 20 LEU LEU C . n C 3 21 GLN 21 21 21 GLN GLN C . n C 3 22 CYS 22 22 22 CYS CYS C . n C 3 23 ASN 23 23 23 ASN ASN C . n C 3 24 TYR 24 24 24 TYR TYR C . n C 3 25 SER 25 25 25 SER SER C . n C 3 26 VAL 26 26 26 VAL VAL C . n C 3 27 THR 27 27 27 THR THR C . n C 3 28 PRO 28 28 28 PRO PRO C . n C 3 29 ASP 29 29 29 ASP ASP C . n C 3 30 ASN 30 30 30 ASN ASN C . n C 3 31 HIS 31 31 31 HIS HIS C . n C 3 32 LEU 32 32 32 LEU LEU C . n C 3 33 ARG 33 33 33 ARG ARG C . n C 3 34 TRP 34 34 34 TRP TRP C . n C 3 35 PHE 35 35 35 PHE PHE C . n C 3 36 LYS 36 36 36 LYS LYS C . n C 3 37 GLN 37 37 37 GLN GLN C . n C 3 38 ASP 38 38 38 ASP ASP C . n C 3 39 THR 39 39 39 THR THR C . n C 3 40 GLY 40 40 40 GLY GLY C . n C 3 41 LYS 41 41 41 LYS LYS C . n C 3 42 GLY 42 42 42 GLY GLY C . n C 3 43 LEU 43 43 43 LEU LEU C . n C 3 44 VAL 44 44 44 VAL VAL C . n C 3 45 SER 45 45 45 SER SER C . n C 3 46 LEU 46 46 46 LEU LEU C . n C 3 47 THR 47 47 47 THR THR C . n C 3 48 VAL 48 48 48 VAL VAL C . n C 3 49 LEU 49 49 49 LEU LEU C . n C 3 50 VAL 50 50 50 VAL VAL C . n C 3 51 ASP 51 51 51 ASP ASP C . n C 3 52 GLN 52 52 52 GLN GLN C . n C 3 53 LYS 53 53 53 LYS LYS C . n C 3 54 ASP 54 54 54 ASP ASP C . n C 3 55 LYS 55 55 55 LYS LYS C . n C 3 56 THR 56 56 56 THR THR C . n C 3 57 SER 57 57 57 SER SER C . n C 3 58 ASN 58 58 58 ASN ASN C . n C 3 59 GLY 59 59 59 GLY GLY C . n C 3 60 ARG 60 60 60 ARG ARG C . n C 3 61 TYR 61 62 62 TYR TYR C . n C 3 62 SER 62 63 63 SER SER C . n C 3 63 ALA 63 64 64 ALA ALA C . n C 3 64 THR 64 65 65 THR THR C . n C 3 65 LEU 65 66 66 LEU LEU C . n C 3 66 ASP 66 67 67 ASP ASP C . n C 3 67 LYS 67 68 68 LYS LYS C . n C 3 68 ASP 68 69 69 ASP ASP C . n C 3 69 ALA 69 70 70 ALA ALA C . n C 3 70 LYS 70 71 71 LYS LYS C . n C 3 71 HIS 71 72 72 HIS HIS C . n C 3 72 SER 72 73 73 SER SER C . n C 3 73 THR 73 74 74 THR THR C . n C 3 74 LEU 74 75 75 LEU LEU C . n C 3 75 HIS 75 76 76 HIS HIS C . n C 3 76 ILE 76 77 77 ILE ILE C . n C 3 77 THR 77 78 78 THR THR C . n C 3 78 ALA 78 79 79 ALA ALA C . n C 3 79 THR 79 80 80 THR THR C . n C 3 80 LEU 80 81 81 LEU LEU C . n C 3 81 LEU 81 82 82 LEU LEU C . n C 3 82 ASP 82 83 83 ASP ASP C . n C 3 83 ASP 83 84 84 ASP ASP C . n C 3 84 THR 84 85 85 THR THR C . n C 3 85 ALA 85 86 86 ALA ALA C . n C 3 86 THR 86 87 87 THR THR C . n C 3 87 TYR 87 88 88 TYR TYR C . n C 3 88 ILE 88 89 89 ILE ILE C . n C 3 89 CYS 89 90 90 CYS CYS C . n C 3 90 VAL 90 91 91 VAL VAL C . n C 3 91 VAL 91 92 92 VAL VAL C . n C 3 92 GLY 92 93 93 GLY GLY C . n C 3 93 ASP 93 94 94 ASP ASP C . n C 3 94 ARG 94 95 95 ARG ARG C . n C 3 95 GLY 95 96 96 GLY GLY C . n C 3 96 SER 96 97 97 SER SER C . n C 3 97 ALA 97 98 98 ALA ALA C . n C 3 98 LEU 98 99 99 LEU LEU C . n C 3 99 GLY 99 100 100 GLY GLY C . n C 3 100 ARG 100 103 103 ARG ARG C . n C 3 101 LEU 101 104 103 LEU LEU C . n C 3 102 HIS 102 105 103 HIS HIS C . n C 3 103 PHE 103 106 104 PHE PHE C . n C 3 104 GLY 104 107 105 GLY GLY C . n C 3 105 ALA 105 108 106 ALA ALA C . n C 3 106 GLY 106 109 107 GLY GLY C . n C 3 107 THR 107 110 108 THR THR C . n C 3 108 GLN 108 111 109 GLN GLN C . n C 3 109 LEU 109 112 110 LEU LEU C . n C 3 110 ILE 110 113 111 ILE ILE C . n C 3 111 VAL 111 114 112 VAL VAL C . n C 3 112 ILE 112 115 113 ILE ILE C . n C 3 113 PRO 113 116 114 PRO PRO C . n C 3 114 ASP 114 117 115 ASP ASP C . n C 3 115 ILE 115 118 116 ILE ILE C . n C 3 116 GLN 116 119 117 GLN GLN C . n C 3 117 ASN 117 120 118 ASN ASN C . n C 3 118 PRO 118 121 119 PRO PRO C . n C 3 119 ASP 119 122 120 ASP ASP C . n C 3 120 PRO 120 123 121 PRO PRO C . n C 3 121 ALA 121 124 122 ALA ALA C . n C 3 122 VAL 122 125 123 VAL VAL C . n C 3 123 TYR 123 126 124 TYR TYR C . n C 3 124 GLN 124 127 125 GLN GLN C . n C 3 125 LEU 125 128 126 LEU LEU C . n C 3 126 ARG 126 129 127 ARG ARG C . n C 3 127 ASP 127 130 128 ASP ASP C . n C 3 128 SER 128 131 129 SER SER C . n C 3 129 LYS 129 132 130 LYS LYS C . n C 3 130 SER 130 133 131 SER SER C . n C 3 131 SER 131 134 132 SER SER C . n C 3 132 ASP 132 135 133 ASP ASP C . n C 3 133 LYS 133 136 ? ? ? C . n C 3 134 SER 134 137 ? ? ? C . n C 3 135 VAL 135 138 ? ? ? C . n C 3 136 CYS 136 139 137 CYS CYS C . n C 3 137 LEU 137 140 138 LEU LEU C . n C 3 138 PHE 138 141 139 PHE PHE C . n C 3 139 THR 139 142 140 THR THR C . n C 3 140 ASP 140 143 141 ASP ASP C . n C 3 141 PHE 141 144 142 PHE PHE C . n C 3 142 ASP 142 145 143 ASP ASP C . n C 3 143 SER 143 146 144 SER SER C . n C 3 144 GLN 144 147 145 GLN GLN C . n C 3 145 THR 145 148 146 THR THR C . n C 3 146 ASN 146 149 147 ASN ASN C . n C 3 147 VAL 147 150 148 VAL VAL C . n C 3 148 SER 148 151 149 SER SER C . n C 3 149 GLN 149 152 150 GLN GLN C . n C 3 150 SER 150 153 151 SER SER C . n C 3 151 LYS 151 154 152 LYS LYS C . n C 3 152 ASP 152 155 153 ASP ASP C . n C 3 153 SER 153 156 154 SER SER C . n C 3 154 ASP 154 157 155 ASP ASP C . n C 3 155 VAL 155 158 156 VAL VAL C . n C 3 156 TYR 156 159 157 TYR TYR C . n C 3 157 ILE 157 160 158 ILE ILE C . n C 3 158 THR 158 161 159 THR THR C . n C 3 159 ASP 159 162 160 ASP ASP C . n C 3 160 LYS 160 163 161 LYS LYS C . n C 3 161 CYS 161 164 162 CYS CYS C . n C 3 162 VAL 162 165 163 VAL VAL C . n C 3 163 LEU 163 166 164 LEU LEU C . n C 3 164 ASP 164 167 165 ASP ASP C . n C 3 165 MET 165 168 166 MET MET C . n C 3 166 ARG 166 169 167 ARG ARG C . n C 3 167 SER 167 170 168 SER SER C . n C 3 168 MET 168 171 169 MET MET C . n C 3 169 ASP 169 172 170 ASP ASP C . n C 3 170 PHE 170 173 171 PHE PHE C . n C 3 171 LYS 171 174 172 LYS LYS C . n C 3 172 SER 172 175 173 SER SER C . n C 3 173 ASN 173 176 174 ASN ASN C . n C 3 174 SER 174 177 175 SER SER C . n C 3 175 ALA 175 178 176 ALA ALA C . n C 3 176 VAL 176 179 177 VAL VAL C . n C 3 177 ALA 177 180 178 ALA ALA C . n C 3 178 TRP 178 181 179 TRP TRP C . n C 3 179 SER 179 182 180 SER SER C . n C 3 180 ASN 180 183 ? ? ? C . n C 3 181 LYS 181 184 ? ? ? C . n C 3 182 SER 182 185 ? ? ? C . n C 3 183 ASP 183 186 ? ? ? C . n C 3 184 PHE 184 187 ? ? ? C . n C 3 185 ALA 185 188 186 ALA ALA C . n C 3 186 CYS 186 189 187 CYS CYS C . n C 3 187 ALA 187 190 188 ALA ALA C . n C 3 188 ASN 188 191 189 ASN ASN C . n C 3 189 ALA 189 192 190 ALA ALA C . n C 3 190 PHE 190 193 191 PHE PHE C . n C 3 191 ASN 191 194 192 ASN ASN C . n C 3 192 ASN 192 195 193 ASN ASN C . n C 3 193 SER 193 196 ? ? ? C . n C 3 194 ILE 194 197 ? ? ? C . n C 3 195 ILE 195 198 196 ILE ILE C . n C 3 196 PRO 196 199 197 PRO PRO C . n C 3 197 GLU 197 200 198 GLU GLU C . n C 3 198 ASP 198 201 199 ASP ASP C . n C 3 199 THR 199 202 200 THR THR C . n C 3 200 PHE 200 203 201 PHE PHE C . n C 3 201 PHE 201 204 202 PHE PHE C . n C 3 202 PRO 202 205 ? ? ? C . n C 3 203 SER 203 206 ? ? ? C . n C 3 204 PRO 204 207 ? ? ? C . n C 3 205 GLU 205 208 ? ? ? C . n C 3 206 SER 206 209 ? ? ? C . n C 3 207 SER 207 210 ? ? ? C . n D 4 1 HIS 1 -1 ? ? ? D . n D 4 2 MET 2 0 ? ? ? D . n D 4 3 GLY 3 1 1 GLY GLY D . n D 4 4 GLY 4 2 2 GLY GLY D . n D 4 5 ILE 5 3 3 ILE ILE D . n D 4 6 ILE 6 4 4 ILE ILE D . n D 4 7 THR 7 5 5 THR THR D . n D 4 8 GLN 8 6 6 GLN GLN D . n D 4 9 THR 9 7 7 THR THR D . n D 4 10 PRO 10 8 8 PRO PRO D . n D 4 11 LYS 11 9 9 LYS LYS D . n D 4 12 PHE 12 10 10 PHE PHE D . n D 4 13 LEU 13 11 11 LEU LEU D . n D 4 14 ILE 14 12 12 ILE ILE D . n D 4 15 GLY 15 13 13 GLY GLY D . n D 4 16 GLN 16 14 14 GLN GLN D . n D 4 17 GLU 17 15 15 GLU GLU D . n D 4 18 GLY 18 16 16 GLY GLY D . n D 4 19 GLN 19 17 17 GLN GLN D . n D 4 20 LYS 20 18 18 LYS LYS D . n D 4 21 LEU 21 19 19 LEU LEU D . n D 4 22 THR 22 20 20 THR THR D . n D 4 23 LEU 23 21 21 LEU LEU D . n D 4 24 LYS 24 22 22 LYS LYS D . n D 4 25 CYS 25 23 23 CYS CYS D . n D 4 26 GLN 26 24 24 GLN GLN D . n D 4 27 GLN 27 25 25 GLN GLN D . n D 4 28 ASN 28 26 26 ASN ASN D . n D 4 29 PHE 29 27 27 PHE PHE D . n D 4 30 ASN 30 28 28 ASN ASN D . n D 4 31 HIS 31 29 29 HIS HIS D . n D 4 32 ASP 32 30 30 ASP ASP D . n D 4 33 THR 33 31 31 THR THR D . n D 4 34 MET 34 32 32 MET MET D . n D 4 35 TYR 35 33 33 TYR TYR D . n D 4 36 TRP 36 34 34 TRP TRP D . n D 4 37 TYR 37 35 35 TYR TYR D . n D 4 38 ARG 38 36 36 ARG ARG D . n D 4 39 GLN 39 37 37 GLN GLN D . n D 4 40 ASP 40 38 38 ASP ASP D . n D 4 41 SER 41 39 39 SER SER D . n D 4 42 GLY 42 40 40 GLY GLY D . n D 4 43 LYS 43 41 41 LYS LYS D . n D 4 44 GLY 44 42 42 GLY GLY D . n D 4 45 LEU 45 43 43 LEU LEU D . n D 4 46 ARG 46 44 44 ARG ARG D . n D 4 47 LEU 47 45 45 LEU LEU D . n D 4 48 ILE 48 46 46 ILE ILE D . n D 4 49 TYR 49 47 47 TYR TYR D . n D 4 50 TYR 50 48 48 TYR TYR D . n D 4 51 SER 51 49 49 SER SER D . n D 4 52 TYR 52 50 50 TYR TYR D . n D 4 53 GLY 53 51 51 GLY GLY D . n D 4 54 ALA 54 52 52 ALA ALA D . n D 4 55 GLY 55 53 53 GLY GLY D . n D 4 56 SER 56 54 54 SER SER D . n D 4 57 THR 57 55 55 THR THR D . n D 4 58 GLU 58 56 56 GLU GLU D . n D 4 59 LYS 59 57 57 LYS LYS D . n D 4 60 GLY 60 58 58 GLY GLY D . n D 4 61 ASP 61 59 59 ASP ASP D . n D 4 62 LEU 62 60 60 LEU LEU D . n D 4 63 SER 63 61 61 SER SER D . n D 4 64 GLU 64 62 62 GLU GLU D . n D 4 65 GLY 65 63 63 GLY GLY D . n D 4 66 TYR 66 64 64 TYR TYR D . n D 4 67 ASP 67 65 65 ASP ASP D . n D 4 68 ALA 68 66 66 ALA ALA D . n D 4 69 SER 69 67 67 SER SER D . n D 4 70 ARG 70 68 68 ARG ARG D . n D 4 71 GLU 71 69 69 GLU GLU D . n D 4 72 LYS 72 70 70 LYS LYS D . n D 4 73 LYS 73 71 71 LYS LYS D . n D 4 74 SER 74 72 72 SER SER D . n D 4 75 SER 75 73 73 SER SER D . n D 4 76 PHE 76 74 74 PHE PHE D . n D 4 77 SER 77 75 75 SER SER D . n D 4 78 LEU 78 76 76 LEU LEU D . n D 4 79 THR 79 77 77 THR THR D . n D 4 80 VAL 80 78 78 VAL VAL D . n D 4 81 THR 81 79 79 THR THR D . n D 4 82 SER 82 80 80 SER SER D . n D 4 83 ALA 83 81 81 ALA ALA D . n D 4 84 GLN 84 82 82 GLN GLN D . n D 4 85 LYS 85 83 83 LYS LYS D . n D 4 86 ASN 86 84 84 ASN ASN D . n D 4 87 GLU 87 85 85 GLU GLU D . n D 4 88 MET 88 86 86 MET MET D . n D 4 89 ALA 89 87 87 ALA ALA D . n D 4 90 VAL 90 88 88 VAL VAL D . n D 4 91 PHE 91 89 89 PHE PHE D . n D 4 92 LEU 92 90 90 LEU LEU D . n D 4 93 CYS 93 91 91 CYS CYS D . n D 4 94 ALA 94 92 92 ALA ALA D . n D 4 95 SER 95 93 93 SER SER D . n D 4 96 GLY 96 94 94 GLY GLY D . n D 4 97 SER 97 95 95 SER SER D . n D 4 98 LEU 98 96 96 LEU LEU D . n D 4 99 LEU 99 97 97 LEU LEU D . n D 4 100 ASP 100 98 98 ASP ASP D . n D 4 101 VAL 101 99 99 VAL VAL D . n D 4 102 ARG 102 100 100 ARG ARG D . n D 4 103 GLU 103 105 101 GLU GLU D . n D 4 104 VAL 104 106 102 VAL VAL D . n D 4 105 PHE 105 107 103 PHE PHE D . n D 4 106 PHE 106 108 104 PHE PHE D . n D 4 107 GLY 107 109 105 GLY GLY D . n D 4 108 LYS 108 110 106 LYS LYS D . n D 4 109 GLY 109 111 107 GLY GLY D . n D 4 110 THR 110 112 108 THR THR D . n D 4 111 ARG 111 113 109 ARG ARG D . n D 4 112 LEU 112 114 110 LEU LEU D . n D 4 113 THR 113 115 111 THR THR D . n D 4 114 VAL 114 116 112 VAL VAL D . n D 4 115 VAL 115 117 113 VAL VAL D . n D 4 116 GLU 116 118 114 GLU GLU D . n D 4 117 ASP 117 119 115 ASP ASP D . n D 4 118 LEU 118 120 116 LEU LEU D . n D 4 119 LYS 119 121 117 LYS LYS D . n D 4 120 ASN 120 122 118 ASN ASN D . n D 4 121 VAL 121 123 119 VAL VAL D . n D 4 122 PHE 122 124 120 PHE PHE D . n D 4 123 PRO 123 125 121 PRO PRO D . n D 4 124 PRO 124 126 122 PRO PRO D . n D 4 125 GLU 125 127 123 GLU GLU D . n D 4 126 VAL 126 128 124 VAL VAL D . n D 4 127 ALA 127 129 125 ALA ALA D . n D 4 128 VAL 128 130 126 VAL VAL D . n D 4 129 PHE 129 131 127 PHE PHE D . n D 4 130 GLU 130 132 128 GLU GLU D . n D 4 131 PRO 131 133 129 PRO PRO D . n D 4 132 SER 132 134 130 SER SER D . n D 4 133 GLU 133 135 131 GLU GLU D . n D 4 134 ALA 134 136 132 ALA ALA D . n D 4 135 GLU 135 137 133 GLU GLU D . n D 4 136 ILE 136 138 134 ILE ILE D . n D 4 137 SER 137 139 135 SER SER D . n D 4 138 HIS 138 140 136 HIS HIS D . n D 4 139 THR 139 141 137 THR THR D . n D 4 140 GLN 140 142 138 GLN GLN D . n D 4 141 LYS 141 143 139 LYS LYS D . n D 4 142 ALA 142 144 140 ALA ALA D . n D 4 143 THR 143 145 141 THR THR D . n D 4 144 LEU 144 146 142 LEU LEU D . n D 4 145 VAL 145 147 143 VAL VAL D . n D 4 146 CYS 146 148 144 CYS CYS D . n D 4 147 LEU 147 149 145 LEU LEU D . n D 4 148 ALA 148 150 146 ALA ALA D . n D 4 149 THR 149 151 147 THR THR D . n D 4 150 GLY 150 152 148 GLY GLY D . n D 4 151 PHE 151 153 149 PHE PHE D . n D 4 152 TYR 152 154 150 TYR TYR D . n D 4 153 PRO 153 155 151 PRO PRO D . n D 4 154 ASP 154 156 152 ASP ASP D . n D 4 155 HIS 155 157 153 HIS HIS D . n D 4 156 VAL 156 158 154 VAL VAL D . n D 4 157 GLU 157 159 155 GLU GLU D . n D 4 158 LEU 158 160 156 LEU LEU D . n D 4 159 SER 159 161 157 SER SER D . n D 4 160 TRP 160 162 158 TRP TRP D . n D 4 161 TRP 161 163 159 TRP TRP D . n D 4 162 VAL 162 164 160 VAL VAL D . n D 4 163 ASN 163 165 161 ASN ASN D . n D 4 164 GLY 164 166 162 GLY GLY D . n D 4 165 LYS 165 167 163 LYS LYS D . n D 4 166 GLU 166 168 164 GLU GLU D . n D 4 167 VAL 167 169 165 VAL VAL D . n D 4 168 HIS 168 170 166 HIS HIS D . n D 4 169 SER 169 171 167 SER SER D . n D 4 170 GLY 170 172 168 GLY GLY D . n D 4 171 VAL 171 173 169 VAL VAL D . n D 4 172 CYS 172 174 170 CYS CYS D . n D 4 173 THR 173 175 171 THR THR D . n D 4 174 ASP 174 176 172 ASP ASP D . n D 4 175 PRO 175 177 173 PRO PRO D . n D 4 176 GLN 176 178 174 GLN GLN D . n D 4 177 PRO 177 179 175 PRO PRO D . n D 4 178 LEU 178 180 176 LEU LEU D . n D 4 179 LYS 179 181 177 LYS LYS D . n D 4 180 GLU 180 182 178 GLU GLU D . n D 4 181 GLN 181 183 179 GLN GLN D . n D 4 182 PRO 182 184 180 PRO PRO D . n D 4 183 ALA 183 185 181 ALA ALA D . n D 4 184 LEU 184 186 182 LEU LEU D . n D 4 185 ASN 185 187 183 ASN ASN D . n D 4 186 ASP 186 188 184 ASP ASP D . n D 4 187 SER 187 189 185 SER SER D . n D 4 188 ARG 188 190 186 ARG ARG D . n D 4 189 TYR 189 191 187 TYR TYR D . n D 4 190 ALA 190 192 188 ALA ALA D . n D 4 191 LEU 191 193 189 LEU LEU D . n D 4 192 SER 192 194 190 SER SER D . n D 4 193 SER 193 195 191 SER SER D . n D 4 194 ARG 194 196 192 ARG ARG D . n D 4 195 LEU 195 197 193 LEU LEU D . n D 4 196 ARG 196 198 194 ARG ARG D . n D 4 197 VAL 197 199 195 VAL VAL D . n D 4 198 SER 198 200 196 SER SER D . n D 4 199 ALA 199 201 197 ALA ALA D . n D 4 200 THR 200 202 198 THR THR D . n D 4 201 PHE 201 203 199 PHE PHE D . n D 4 202 TRP 202 204 200 TRP TRP D . n D 4 203 GLN 203 205 201 GLN GLN D . n D 4 204 ASN 204 206 202 ASN ASN D . n D 4 205 PRO 205 207 203 PRO PRO D . n D 4 206 ARG 206 208 204 ARG ARG D . n D 4 207 ASN 207 209 205 ASN ASN D . n D 4 208 HIS 208 210 206 HIS HIS D . n D 4 209 PHE 209 211 207 PHE PHE D . n D 4 210 ARG 210 212 208 ARG ARG D . n D 4 211 CYS 211 213 209 CYS CYS D . n D 4 212 GLN 212 214 210 GLN GLN D . n D 4 213 VAL 213 215 211 VAL VAL D . n D 4 214 GLN 214 216 212 GLN GLN D . n D 4 215 PHE 215 217 213 PHE PHE D . n D 4 216 TYR 216 218 214 TYR TYR D . n D 4 217 GLY 217 219 215 GLY GLY D . n D 4 218 LEU 218 220 216 LEU LEU D . n D 4 219 SER 219 221 217 SER SER D . n D 4 220 GLU 220 222 218 GLU GLU D . n D 4 221 ASN 221 223 219 ASN ASN D . n D 4 222 ASP 222 224 220 ASP ASP D . n D 4 223 GLU 223 225 221 GLU GLU D . n D 4 224 TRP 224 226 222 TRP TRP D . n D 4 225 THR 225 227 223 THR THR D . n D 4 226 GLN 226 228 224 GLN GLN D . n D 4 227 ASP 227 229 225 ASP ASP D . n D 4 228 ARG 228 230 226 ARG ARG D . n D 4 229 ALA 229 231 227 ALA ALA D . n D 4 230 LYS 230 232 228 LYS LYS D . n D 4 231 PRO 231 233 229 PRO PRO D . n D 4 232 VAL 232 234 230 VAL VAL D . n D 4 233 THR 233 235 231 THR THR D . n D 4 234 GLN 234 236 232 GLN GLN D . n D 4 235 ILE 235 237 233 ILE ILE D . n D 4 236 VAL 236 238 234 VAL VAL D . n D 4 237 SER 237 239 235 SER SER D . n D 4 238 ALA 238 240 236 ALA ALA D . n D 4 239 GLU 239 241 237 GLU GLU D . n D 4 240 ALA 240 242 238 ALA ALA D . n D 4 241 TRP 241 243 239 TRP TRP D . n D 4 242 GLY 242 244 ? ? ? D . n D 4 243 ARG 243 245 ? ? ? D . n D 4 244 ALA 244 246 ? ? ? D . n D 4 245 ASP 245 247 ? ? ? D . n # 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 165 A ASN 165 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 20 A ASN 20 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 42 A ASN 42 ? ASN 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details tetrameric _pdbx_struct_assembly.oligomeric_count 4 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # _pdbx_audit_revision_history.ordinal 1 _pdbx_audit_revision_history.data_content_type 'Structure model' _pdbx_audit_revision_history.major_revision 1 _pdbx_audit_revision_history.minor_revision 0 _pdbx_audit_revision_history.revision_date 2011-10-05 # _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_ _software.pdbx_ordinal _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id 1 MOSFLM . ? package 'Andrew G.W. Leslie' andrew@mrc-lmb.cam.ac.uk 'data reduction' http://www.mrc-lmb.cam.ac.uk/harry/mosflm/ ? ? 2 SCALA 3.3.15 2009/03/31 other 'Phil R. Evans' pre@mrc-lmb.cam.ac.uk 'data scaling' http://www.ccp4.ac.uk/dist/html/scala.html Fortran_77 ? 3 REFMAC . ? program 'Garib N. Murshudov' garib@ysbl.york.ac.uk refinement http://www.ccp4.ac.uk/dist/html/refmac5.html Fortran_77 ? 4 PDB_EXTRACT 3.10 'June 10, 2010' package PDB deposit@deposit.rcsb.org 'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? # _pdbx_entry_details.entry_id 3SDC _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details ;1. SEQUENCE CONFLICT IN ENTITY 1 IS BASED ON REFERENCE 3 OF DATABASE P11609 (CD1D1_MOUSE). 2. THE SEQUENCE CONFLICT OF ENTITY 2 IS A NATURAL VARIANT ACCORDING TO DATABASE P01887 (B2MG_MOUSE). ; _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? # _pdbx_validate_close_contact.id 1 _pdbx_validate_close_contact.PDB_model_num 1 _pdbx_validate_close_contact.auth_atom_id_1 NH2 _pdbx_validate_close_contact.auth_asym_id_1 C _pdbx_validate_close_contact.auth_comp_id_1 ARG _pdbx_validate_close_contact.auth_seq_id_1 60 _pdbx_validate_close_contact.PDB_ins_code_1 ? _pdbx_validate_close_contact.label_alt_id_1 ? _pdbx_validate_close_contact.auth_atom_id_2 OD1 _pdbx_validate_close_contact.auth_asym_id_2 C _pdbx_validate_close_contact.auth_comp_id_2 ASP _pdbx_validate_close_contact.auth_seq_id_2 84 _pdbx_validate_close_contact.PDB_ins_code_2 ? _pdbx_validate_close_contact.label_alt_id_2 ? _pdbx_validate_close_contact.dist 2.11 # loop_ _pdbx_validate_symm_contact.id _pdbx_validate_symm_contact.PDB_model_num _pdbx_validate_symm_contact.auth_atom_id_1 _pdbx_validate_symm_contact.auth_asym_id_1 _pdbx_validate_symm_contact.auth_comp_id_1 _pdbx_validate_symm_contact.auth_seq_id_1 _pdbx_validate_symm_contact.PDB_ins_code_1 _pdbx_validate_symm_contact.label_alt_id_1 _pdbx_validate_symm_contact.site_symmetry_1 _pdbx_validate_symm_contact.auth_atom_id_2 _pdbx_validate_symm_contact.auth_asym_id_2 _pdbx_validate_symm_contact.auth_comp_id_2 _pdbx_validate_symm_contact.auth_seq_id_2 _pdbx_validate_symm_contact.PDB_ins_code_2 _pdbx_validate_symm_contact.label_alt_id_2 _pdbx_validate_symm_contact.site_symmetry_2 _pdbx_validate_symm_contact.dist 1 1 OD2 A ASP 93 ? ? 1_555 OE1 A GLN 273 ? ? 6_424 1.25 2 1 OD2 A ASP 93 ? ? 1_555 CD A GLN 273 ? ? 6_424 1.96 # _pdbx_validate_rmsd_angle.id 1 _pdbx_validate_rmsd_angle.PDB_model_num 1 _pdbx_validate_rmsd_angle.auth_atom_id_1 N _pdbx_validate_rmsd_angle.auth_asym_id_1 A _pdbx_validate_rmsd_angle.auth_comp_id_1 GLY _pdbx_validate_rmsd_angle.auth_seq_id_1 109 _pdbx_validate_rmsd_angle.PDB_ins_code_1 ? _pdbx_validate_rmsd_angle.label_alt_id_1 ? _pdbx_validate_rmsd_angle.auth_atom_id_2 CA _pdbx_validate_rmsd_angle.auth_asym_id_2 A _pdbx_validate_rmsd_angle.auth_comp_id_2 GLY _pdbx_validate_rmsd_angle.auth_seq_id_2 109 _pdbx_validate_rmsd_angle.PDB_ins_code_2 ? _pdbx_validate_rmsd_angle.label_alt_id_2 ? _pdbx_validate_rmsd_angle.auth_atom_id_3 C _pdbx_validate_rmsd_angle.auth_asym_id_3 A _pdbx_validate_rmsd_angle.auth_comp_id_3 GLY _pdbx_validate_rmsd_angle.auth_seq_id_3 109 _pdbx_validate_rmsd_angle.PDB_ins_code_3 ? _pdbx_validate_rmsd_angle.label_alt_id_3 ? _pdbx_validate_rmsd_angle.angle_value 96.49 _pdbx_validate_rmsd_angle.angle_target_value 113.10 _pdbx_validate_rmsd_angle.angle_deviation -16.61 _pdbx_validate_rmsd_angle.angle_standard_deviation 2.50 _pdbx_validate_rmsd_angle.linker_flag 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 112 ? ? -176.83 140.77 2 1 ASP A 242 ? ? -88.40 30.24 3 1 VAL A 292 ? ? -39.49 133.13 4 1 SER C 25 ? ? -144.25 -5.99 5 1 ASP C 29 ? ? -111.21 76.81 6 1 LEU C 46 ? ? -98.70 -62.24 7 1 ASP C 84 ? ? -61.66 10.24 8 1 ARG C 103 ? ? -124.16 -159.41 9 1 ASP C 130 ? ? 94.61 -2.22 10 1 ASP C 143 ? ? 56.01 18.88 11 1 ASP C 172 ? ? -100.75 73.04 12 1 PHE C 193 ? ? 35.65 42.23 13 1 ASP C 201 ? ? -65.58 3.80 14 1 LYS D 41 ? ? -135.60 -32.22 15 1 TYR D 48 ? ? -123.32 -168.71 16 1 GLU D 105 ? ? -53.50 73.17 17 1 GLU D 118 ? ? -155.47 40.50 18 1 ASP D 119 ? ? -114.62 -168.52 19 1 ASP D 156 ? ? -68.54 57.79 20 1 HIS D 157 ? ? -109.24 78.40 21 1 ALA D 185 ? ? -77.66 -70.96 22 1 ASP D 188 ? ? 88.47 4.63 # 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 PRO A 108 ? ? GLY A 109 ? ? -137.22 2 1 GLU D 118 ? ? ASP D 119 ? ? 33.49 # _pdbx_validate_main_chain_plane.id 1 _pdbx_validate_main_chain_plane.PDB_model_num 1 _pdbx_validate_main_chain_plane.auth_comp_id ARG _pdbx_validate_main_chain_plane.auth_asym_id C _pdbx_validate_main_chain_plane.auth_seq_id 103 _pdbx_validate_main_chain_plane.PDB_ins_code ? _pdbx_validate_main_chain_plane.label_alt_id ? _pdbx_validate_main_chain_plane.improper_torsion_angle -10.43 # 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 ? NE ? A ARG 21 NE 2 1 Y 0 A LYS 57 ? CE ? A LYS 57 CE 3 1 Y 0 A ASP 93 ? CG ? A ASP 93 CG 4 1 Y 0 A GLU 105 ? OE2 ? A GLU 105 OE2 5 1 Y 0 A GLU 113 ? CD ? A GLU 113 CD 6 1 Y 0 A ARG 173 ? NE ? A ARG 173 NE 7 1 Y 1 B ILE 1 ? CG1 ? B ILE 1 CG1 8 1 Y 1 B ILE 1 ? CG2 ? B ILE 1 CG2 9 1 Y 1 B ILE 1 ? CD1 ? B ILE 1 CD1 10 1 Y 0 B LYS 58 ? CD ? B LYS 58 CD 11 1 Y 0 C ARG 13 ? NE ? C ARG 13 NE 12 1 Y 0 C ARG 13 ? CZ ? C ARG 13 CZ 13 1 Y 0 C ASP 67 ? CG ? C ASP 66 CG 14 1 Y 0 D GLU 62 ? CD ? D GLU 64 CD 15 1 Y 0 D GLU 69 ? CG ? D GLU 71 CG 16 1 Y 0 D GLU 69 ? CD ? D GLU 71 CD 17 1 Y 0 D ARG 113 ? NE ? D ARG 111 NE 18 1 Y 0 D ARG 113 ? CZ ? D ARG 111 CZ # 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 ARG 296 ? A ARG 296 8 1 Y 1 A HIS 297 ? A HIS 297 9 1 Y 1 A HIS 298 ? A HIS 298 10 1 Y 1 A HIS 299 ? A HIS 299 11 1 Y 1 A HIS 300 ? A HIS 300 12 1 Y 1 A HIS 301 ? A HIS 301 13 1 Y 1 A HIS 302 ? A HIS 302 14 1 Y 1 C LYS 136 ? C LYS 133 15 1 Y 1 C SER 137 ? C SER 134 16 1 Y 1 C VAL 138 ? C VAL 135 17 1 Y 1 C ASN 183 ? C ASN 180 18 1 Y 1 C LYS 184 ? C LYS 181 19 1 Y 1 C SER 185 ? C SER 182 20 1 Y 1 C ASP 186 ? C ASP 183 21 1 Y 1 C PHE 187 ? C PHE 184 22 1 Y 1 C SER 196 ? C SER 193 23 1 Y 1 C ILE 197 ? C ILE 194 24 1 Y 1 C PRO 205 ? C PRO 202 25 1 Y 1 C SER 206 ? C SER 203 26 1 Y 1 C PRO 207 ? C PRO 204 27 1 Y 1 C GLU 208 ? C GLU 205 28 1 Y 1 C SER 209 ? C SER 206 29 1 Y 1 C SER 210 ? C SER 207 30 1 Y 1 D HIS -1 ? D HIS 1 31 1 Y 1 D MET 0 ? D MET 2 32 1 Y 1 D GLY 244 ? D GLY 242 33 1 Y 1 D ARG 245 ? D ARG 243 34 1 Y 1 D ALA 246 ? D ALA 244 35 1 Y 1 D ASP 247 ? D ASP 245 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 5 N-ACETYL-D-GLUCOSAMINE NAG 6 ;N-[(2S,3R,4E)-1-{[alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]hexacosanamide ; 3GB 7 water HOH # 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 5 NAG 1 305 305 NAG NAG A . F 5 NAG 2 306 306 NAG NAG A . G 5 NAG 1 304 304 NAG NAG A . H 5 NAG 1 303 303 NAG NAG A . I 6 3GB 1 307 1 3GB DRG A . J 7 HOH 1 309 48 HOH HOH A . J 7 HOH 2 310 62 HOH HOH A . J 7 HOH 3 311 75 HOH HOH A . J 7 HOH 4 312 76 HOH HOH A . J 7 HOH 5 313 78 HOH HOH A . J 7 HOH 6 314 79 HOH HOH A . J 7 HOH 7 315 83 HOH HOH A . J 7 HOH 8 316 87 HOH HOH A . J 7 HOH 9 317 93 HOH HOH A . J 7 HOH 10 318 95 HOH HOH A . J 7 HOH 11 319 96 HOH HOH A . J 7 HOH 12 320 97 HOH HOH A . J 7 HOH 13 321 98 HOH HOH A . J 7 HOH 14 322 101 HOH HOH A . J 7 HOH 15 323 103 HOH HOH A . J 7 HOH 16 324 104 HOH HOH A . K 7 HOH 1 100 100 HOH HOH B . K 7 HOH 2 101 30 HOH HOH B . K 7 HOH 3 102 69 HOH HOH B . K 7 HOH 4 103 80 HOH HOH B . K 7 HOH 5 104 81 HOH HOH B . K 7 HOH 6 105 82 HOH HOH B . K 7 HOH 7 106 99 HOH HOH B . K 7 HOH 8 308 2 HOH HOH B . L 7 HOH 1 102 102 HOH HOH C . L 7 HOH 2 211 6 HOH HOH C . L 7 HOH 3 212 38 HOH HOH C . L 7 HOH 4 213 70 HOH HOH C . L 7 HOH 5 214 72 HOH HOH C . L 7 HOH 6 215 74 HOH HOH C . L 7 HOH 7 216 88 HOH HOH C . L 7 HOH 8 217 89 HOH HOH C . L 7 HOH 9 218 94 HOH HOH C . L 7 HOH 10 219 105 HOH HOH C . M 7 HOH 1 248 44 HOH HOH D . M 7 HOH 2 249 73 HOH HOH D . M 7 HOH 3 250 92 HOH HOH D . #