data_3ARG # _entry.id 3ARG # _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 3ARG RCSB RCSB029603 WWPDB D_1000029603 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 3HE6 'Ternary crystal structure of the mouse NKT TCR-CD1d-alpha-galactosylceramide' unspecified PDB 3ARB 'Ternary crystal structure of the mouse NKT TCR-CD1d-OCH' unspecified PDB 3ARD ;Ternary crystal structure of the mouse NKT TCR-CD1d-3'deoxy-alpha-galactosylceramide ; unspecified PDB 3ARE ;Ternary crystal structure of the mouse NKT TCR-CD1d-4'deoxy-alpha-galactosylceramide ; unspecified PDB 3ARF 'Ternary crystal structure of the mouse NKT TCR-CD1d-C20:2' unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3ARG _pdbx_database_status.recvd_initial_deposition_date 2010-11-27 _pdbx_database_status.deposit_site PDBJ _pdbx_database_status.process_site PDBJ _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 'Wun, K.S.' 1 'Rossjohn, J.' 2 # _citation.id primary _citation.title 'A molecular basis for the exquisite CD1d-restricted antigen specificity and functional responses of natural killer T cells' _citation.journal_abbrev Immunity _citation.journal_volume 34 _citation.page_first 327 _citation.page_last 339 _citation.year 2011 _citation.journal_id_ASTM IUNIEH _citation.country US _citation.journal_id_ISSN 1074-7613 _citation.journal_id_CSD 2048 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 21376639 _citation.pdbx_database_id_DOI 10.1016/j.immuni.2011.02.001 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Wun, K.S.' 1 primary 'Cameron, G.' 2 primary 'Patel, O.' 3 primary 'Pang, S.S.' 4 primary 'Pellicci, D.G.' 5 primary 'Sullivan, L.C.' 6 primary 'Keshipeddy, S.' 7 primary 'Young, M.H.' 8 primary 'Uldrich, A.P.' 9 primary 'Thakur, M.S.' 10 primary 'Richardson, S.K.' 11 primary 'Howell, A.R.' 12 primary 'Illarionov, P.A.' 13 primary 'Brooks, A.G.' 14 primary 'Besra, G.S.' 15 primary 'McCluskey, J.' 16 primary 'Gapin, L.' 17 primary 'Porcelli, S.A.' 18 primary 'Godfrey, D.I.' 19 primary 'Rossjohn, J.' 20 # _cell.entry_id 3ARG _cell.length_a 59.165 _cell.length_b 85.774 _cell.length_c 237.805 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? _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.entry_id 3ARG _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 _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 ? ? 'heavy chain' ? 2 polymer man Beta-2-microglobulin 11660.350 1 ? ? ? ? 3 polymer man 'NKT Valpha14-Jalpha18' 22779.180 1 ? ? ? 'Chimera of mouse variable domain and human constant domain' 4 polymer man Vbeta8.2 27166.941 1 ? ? ? 'Chimera of mouse variable domain and human constant domain' 5 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 5 ? ? ? ? 6 non-polymer syn '(11E,14E)-N-[(2S,3S,4R)-1-(alpha-D-glucopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]icosa-11,14-dienamide' 770.131 1 ? ? ? ? 7 water nat water 18.015 22 ? ? ? ? # 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 ;EAAVTQSPRNKVAVTGGKVTLSCNQTNNHNNMYWYRQDTGHGLRLIHYSYGAGSTEKGDIPDGYKASRPSQENFSLILEL ATPSQTSVYFCASGDAGGNYAEQFFGPGTRLTVLEDLKNVFPPEVAVFEPSEAEISHTQKATLVCLATGFYPDHVELSWW VNGKEVHSGVCTDPQPLKEQPALNDSRYALSSRLRVSATFWQNPRNHFRCQVQFYGLSENDEWTQDRAKPVTQIVSAEAW GRAD ; ;EAAVTQSPRNKVAVTGGKVTLSCNQTNNHNNMYWYRQDTGHGLRLIHYSYGAGSTEKGDIPDGYKASRPSQENFSLILEL ATPSQTSVYFCASGDAGGNYAEQFFGPGTRLTVLEDLKNVFPPEVAVFEPSEAEISHTQKATLVCLATGFYPDHVELSWW VNGKEVHSGVCTDPQPLKEQPALNDSRYALSSRLRVSATFWQNPRNHFRCQVQFYGLSENDEWTQDRAKPVTQIVSAEAW GRAD ; 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 GLU n 4 2 ALA n 4 3 ALA n 4 4 VAL n 4 5 THR n 4 6 GLN n 4 7 SER n 4 8 PRO n 4 9 ARG n 4 10 ASN n 4 11 LYS n 4 12 VAL n 4 13 ALA n 4 14 VAL n 4 15 THR n 4 16 GLY n 4 17 GLY n 4 18 LYS n 4 19 VAL n 4 20 THR n 4 21 LEU n 4 22 SER n 4 23 CYS n 4 24 ASN n 4 25 GLN n 4 26 THR n 4 27 ASN n 4 28 ASN n 4 29 HIS n 4 30 ASN n 4 31 ASN n 4 32 MET n 4 33 TYR n 4 34 TRP n 4 35 TYR n 4 36 ARG n 4 37 GLN n 4 38 ASP n 4 39 THR n 4 40 GLY n 4 41 HIS n 4 42 GLY n 4 43 LEU n 4 44 ARG n 4 45 LEU n 4 46 ILE n 4 47 HIS n 4 48 TYR n 4 49 SER n 4 50 TYR n 4 51 GLY n 4 52 ALA n 4 53 GLY n 4 54 SER n 4 55 THR n 4 56 GLU n 4 57 LYS n 4 58 GLY n 4 59 ASP n 4 60 ILE n 4 61 PRO n 4 62 ASP n 4 63 GLY n 4 64 TYR n 4 65 LYS n 4 66 ALA n 4 67 SER n 4 68 ARG n 4 69 PRO n 4 70 SER n 4 71 GLN n 4 72 GLU n 4 73 ASN n 4 74 PHE n 4 75 SER n 4 76 LEU n 4 77 ILE n 4 78 LEU n 4 79 GLU n 4 80 LEU n 4 81 ALA n 4 82 THR n 4 83 PRO n 4 84 SER n 4 85 GLN n 4 86 THR n 4 87 SER n 4 88 VAL n 4 89 TYR n 4 90 PHE n 4 91 CYS n 4 92 ALA n 4 93 SER n 4 94 GLY n 4 95 ASP n 4 96 ALA n 4 97 GLY n 4 98 GLY n 4 99 ASN n 4 100 TYR n 4 101 ALA n 4 102 GLU n 4 103 GLN n 4 104 PHE n 4 105 PHE n 4 106 GLY n 4 107 PRO n 4 108 GLY n 4 109 THR n 4 110 ARG n 4 111 LEU n 4 112 THR n 4 113 VAL n 4 114 LEU n 4 115 GLU n 4 116 ASP n 4 117 LEU n 4 118 LYS n 4 119 ASN n 4 120 VAL n 4 121 PHE n 4 122 PRO n 4 123 PRO n 4 124 GLU n 4 125 VAL n 4 126 ALA n 4 127 VAL n 4 128 PHE n 4 129 GLU n 4 130 PRO n 4 131 SER n 4 132 GLU n 4 133 ALA n 4 134 GLU n 4 135 ILE n 4 136 SER n 4 137 HIS n 4 138 THR n 4 139 GLN n 4 140 LYS n 4 141 ALA n 4 142 THR n 4 143 LEU n 4 144 VAL n 4 145 CYS n 4 146 LEU n 4 147 ALA n 4 148 THR n 4 149 GLY n 4 150 PHE n 4 151 TYR n 4 152 PRO n 4 153 ASP n 4 154 HIS n 4 155 VAL n 4 156 GLU n 4 157 LEU n 4 158 SER n 4 159 TRP n 4 160 TRP n 4 161 VAL n 4 162 ASN n 4 163 GLY n 4 164 LYS n 4 165 GLU n 4 166 VAL n 4 167 HIS n 4 168 SER n 4 169 GLY n 4 170 VAL n 4 171 CYS n 4 172 THR n 4 173 ASP n 4 174 PRO n 4 175 GLN n 4 176 PRO n 4 177 LEU n 4 178 LYS n 4 179 GLU n 4 180 GLN n 4 181 PRO n 4 182 ALA n 4 183 LEU n 4 184 ASN n 4 185 ASP n 4 186 SER n 4 187 ARG n 4 188 TYR n 4 189 ALA n 4 190 LEU n 4 191 SER n 4 192 SER n 4 193 ARG n 4 194 LEU n 4 195 ARG n 4 196 VAL n 4 197 SER n 4 198 ALA n 4 199 THR n 4 200 PHE n 4 201 TRP n 4 202 GLN n 4 203 ASN n 4 204 PRO n 4 205 ARG n 4 206 ASN n 4 207 HIS n 4 208 PHE n 4 209 ARG n 4 210 CYS n 4 211 GLN n 4 212 VAL n 4 213 GLN n 4 214 PHE n 4 215 TYR n 4 216 GLY n 4 217 LEU n 4 218 SER n 4 219 GLU n 4 220 ASN n 4 221 ASP n 4 222 GLU n 4 223 TRP n 4 224 THR n 4 225 GLN n 4 226 ASP n 4 227 ARG n 4 228 ALA n 4 229 LYS n 4 230 PRO n 4 231 VAL n 4 232 THR n 4 233 GLN n 4 234 ILE n 4 235 VAL n 4 236 SER n 4 237 ALA n 4 238 GLU n 4 239 ALA n 4 240 TRP n 4 241 GLY n 4 242 ARG n 4 243 ALA n 4 244 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 ? 'Cd1d1, Cd1.1' ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? 'cabbage looper' 'Trichoplusia ni' 7111 ? ? ? ? ? ? ? ? ? ? ? ? ? ? Baculovirus ? ? ? pBacP10PH ? ? 2 1 sample ? ? ? mouse ? B2m ? ? ? ? ? ? 'Mus musculus' 10090 ? ? ? ? ? ? ? 'cabbage looper' 'Trichoplusia ni' 7111 ? ? ? ? ? ? ? ? ? ? ? ? ? ? Baculovirus ? ? ? pBacP10PH ? ? 3 1 sample ? ? ? 'mouse, human' ? ? ? ? ? ? ? ? 'Mus musculus, Homo sapiens' '10090, 9606' ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? Plasmid ? ? ? pET ? ? 4 1 sample ? ? ? 'mouse, human' ? ? ? ? ? ? ? ? 'Mus musculus, Homo sapiens' '10090, 9606' ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? Plasmid ? ? ? pET ? ? # 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 Q91XJ8_MOUSE Q91XJ8 2 ;IQKTPQIQVYSRHPPENGKPNILNCYVTQFHPPHIEIQMLKNGKKIPKVEMSDMSFSKDWSFYILAHTEFTPTETDTYAC RVKHASMAEPKTVYWDRDM ; 21 ? 3 PDB 3ARG 3ARG 3 ? ? ? 4 PDB 3ARG 3ARG 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 3ARG A 1 ? 279 ? P11609 19 ? 297 ? 1 279 2 2 3ARG B 1 ? 99 ? Q91XJ8 21 ? 119 ? 1 99 3 3 3ARG C 1 ? 207 ? 3ARG 1 ? 210 ? 1 210 4 4 3ARG D 1 ? 244 ? 3ARG 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 3ARG HIS A 201 ? UNP P11609 ASP 219 'SEE REMARK 999' 201 1 1 3ARG GLY A 280 ? UNP P11609 ? ? 'EXPRESSION TAG' 280 2 1 3ARG SER A 281 ? UNP P11609 ? ? 'EXPRESSION TAG' 281 3 1 3ARG LEU A 282 ? UNP P11609 ? ? 'EXPRESSION TAG' 282 4 1 3ARG HIS A 283 ? UNP P11609 ? ? 'EXPRESSION TAG' 283 5 1 3ARG HIS A 284 ? UNP P11609 ? ? 'EXPRESSION TAG' 284 6 1 3ARG ILE A 285 ? UNP P11609 ? ? 'EXPRESSION TAG' 285 7 1 3ARG LEU A 286 ? UNP P11609 ? ? 'EXPRESSION TAG' 286 8 1 3ARG ASP A 287 ? UNP P11609 ? ? 'EXPRESSION TAG' 287 9 1 3ARG ALA A 288 ? UNP P11609 ? ? 'EXPRESSION TAG' 288 10 1 3ARG GLN A 289 ? UNP P11609 ? ? 'EXPRESSION TAG' 289 11 1 3ARG LYS A 290 ? UNP P11609 ? ? 'EXPRESSION TAG' 290 12 1 3ARG MET A 291 ? UNP P11609 ? ? 'EXPRESSION TAG' 291 13 1 3ARG VAL A 292 ? UNP P11609 ? ? 'EXPRESSION TAG' 292 14 1 3ARG TRP A 293 ? UNP P11609 ? ? 'EXPRESSION TAG' 293 15 1 3ARG ASN A 294 ? UNP P11609 ? ? 'EXPRESSION TAG' 294 16 1 3ARG HIS A 295 ? UNP P11609 ? ? 'EXPRESSION TAG' 295 17 1 3ARG ARG A 296 ? UNP P11609 ? ? 'EXPRESSION TAG' 296 18 1 3ARG HIS A 297 ? UNP P11609 ? ? 'EXPRESSION TAG' 297 19 1 3ARG HIS A 298 ? UNP P11609 ? ? 'EXPRESSION TAG' 298 20 1 3ARG HIS A 299 ? UNP P11609 ? ? 'EXPRESSION TAG' 299 21 1 3ARG HIS A 300 ? UNP P11609 ? ? 'EXPRESSION TAG' 300 22 1 3ARG HIS A 301 ? UNP P11609 ? ? 'EXPRESSION TAG' 301 23 1 3ARG HIS A 302 ? UNP P11609 ? ? 'EXPRESSION TAG' 302 24 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 DB6 non-polymer . '(11E,14E)-N-[(2S,3S,4R)-1-(alpha-D-glucopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]icosa-11,14-dienamide' ? 'C44 H83 N O9' 770.131 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.entry_id 3ARG _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.13 _exptl_crystal.density_percent_sol 60.75 _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.temp 295 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 5.6 _exptl_crystal_grow.pdbx_details '20% PEG 400, 0.1M Ammonium acetate, 0.1M Bis Tris, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 295K' _exptl_crystal_grow.pdbx_pH_range . # _diffrn.id 1 _diffrn.ambient_temp 100 _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 2009-11-14 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'Si(111)' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.95367 _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_synchrotron_site 'Australian Synchrotron' _diffrn_source.pdbx_synchrotron_beamline MX2 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 0.95367 # _reflns.entry_id 3ARG _reflns.observed_criterion_sigma_I 0 _reflns.observed_criterion_sigma_F 0 _reflns.d_resolution_low 50.0 _reflns.d_resolution_high 3.00 _reflns.number_obs 23592 _reflns.number_all 24965 _reflns.percent_possible_obs 94.5 _reflns.pdbx_Rmerge_I_obs 0.218 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 9.4 _reflns.B_iso_Wilson_estimate 61.1 _reflns.pdbx_redundancy 10.4 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # loop_ _reflns_shell.d_res_high _reflns_shell.d_res_low _reflns_shell.percent_possible_all _reflns_shell.Rmerge_I_obs _reflns_shell.pdbx_Rsym_value _reflns_shell.meanI_over_sigI_obs _reflns_shell.pdbx_redundancy _reflns_shell.percent_possible_obs _reflns_shell.number_unique_all _reflns_shell.number_measured_all _reflns_shell.number_measured_obs _reflns_shell.number_unique_obs _reflns_shell.pdbx_chi_squared _reflns_shell.pdbx_rejects _reflns_shell.pdbx_netI_over_sigmaI_obs _reflns_shell.number_possible _reflns_shell.Rmerge_F_all _reflns_shell.Rmerge_F_obs _reflns_shell.Rmerge_I_all _reflns_shell.meanI_over_sigI_all _reflns_shell.pdbx_Rrim_I_all _reflns_shell.pdbx_Rpim_I_all _reflns_shell.pdbx_ordinal _reflns_shell.pdbx_diffrn_id 3.00 3.16 95.9 1.083 ? 2.0 10.5 ? 3603 ? ? ? ? ? ? ? ? ? ? ? ? ? 1 1 9.49 50.0 89.9 0.090 ? 28.3 9.5 ? 894 ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 # _refine.entry_id 3ARG _refine.ls_number_reflns_obs 22355 _refine.ls_number_reflns_all 23958 _refine.pdbx_ls_sigma_I 0 _refine.pdbx_ls_sigma_F ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 47.56 _refine.ls_d_res_high 3.00 _refine.ls_percent_reflns_obs 93.31 _refine.ls_R_factor_obs 0.23563 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.23222 _refine.ls_R_factor_R_free 0.29958 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.1 _refine.ls_number_reflns_R_free 1198 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.921 _refine.correlation_coeff_Fo_to_Fc_free 0.854 _refine.B_iso_mean 67.513 _refine.aniso_B[1][1] 2.99 _refine.aniso_B[2][2] 5.76 _refine.aniso_B[3][3] -8.75 _refine.aniso_B[1][2] -0.00 _refine.aniso_B[1][3] 0.00 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_details MASK _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.40 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' _refine.pdbx_starting_model 3HE6 _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model Isotropic _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R_Free 0.491 _refine.overall_SU_ML 0.446 _refine.overall_SU_B 55.794 _refine.overall_SU_R_Cruickshank_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_diffrn_id 1 _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 6038 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 117 _refine_hist.number_atoms_solvent 22 _refine_hist.number_atoms_total 6177 _refine_hist.d_res_high 3.00 _refine_hist.d_res_low 47.56 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function r_bond_refined_d 0.006 0.021 ? 6339 'X-RAY DIFFRACTION' ? r_bond_other_d ? ? ? ? 'X-RAY DIFFRACTION' ? r_angle_refined_deg 0.992 1.927 ? 8684 'X-RAY DIFFRACTION' ? r_angle_other_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 4.928 5.000 ? 816 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg 34.744 23.417 ? 240 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg 16.948 15.000 ? 781 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg 17.520 15.000 ? 22 'X-RAY DIFFRACTION' ? r_chiral_restr 0.062 0.200 ? 984 'X-RAY DIFFRACTION' ? r_gen_planes_refined 0.004 0.021 ? 4870 'X-RAY DIFFRACTION' ? r_gen_planes_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbd_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcbond_it 0.142 1.500 ? 4117 'X-RAY DIFFRACTION' ? r_mcbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcangle_it 0.278 2.000 ? 6537 'X-RAY DIFFRACTION' ? r_scbond_it 0.379 3.000 ? 2222 'X-RAY DIFFRACTION' ? r_scangle_it 0.626 4.500 ? 2147 'X-RAY DIFFRACTION' ? r_rigid_bond_restr ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_free ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_bonded ? ? ? ? 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 2.996 _refine_ls_shell.d_res_low 3.074 _refine_ls_shell.number_reflns_R_work 1518 _refine_ls_shell.R_factor_R_work 0.347 _refine_ls_shell.percent_reflns_obs 88.87 _refine_ls_shell.R_factor_R_free 0.425 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 103 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.number_reflns_obs 1621 _refine_ls_shell.redundancy_reflns_obs ? # _struct.entry_id 3ARG _struct.title 'Ternary crystal structure of the mouse NKT TCR-CD1d-alpha-glucosylceramide(C20:2)' _struct.pdbx_descriptor 'Antigen-presenting glycoprotein CD1d1, Beta-2-microglobulin, NKT Valpha14-Jalpha18, Vbeta8.2' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3ARG _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' _struct_keywords.text 'mouse NKT TCR, mouse CD1d, 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 5 ? J N N 6 ? K N N 7 ? L N N 7 ? M N N 7 ? N 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 SER A 59 ? MET A 88 ? SER A 59 MET A 88 1 ? 30 HELX_P HELX_P2 2 PRO A 140 ? TRP A 142 ? PRO A 140 TRP A 142 5 ? 3 HELX_P HELX_P3 3 LEU A 143 ? ASN A 151 ? LEU A 143 ASN A 151 1 ? 9 HELX_P HELX_P4 4 ASP A 153 ? ASP A 166 ? ASP A 153 ASP A 166 1 ? 14 HELX_P HELX_P5 5 ASP A 166 ? GLY A 179 ? ASP A 166 GLY A 179 1 ? 14 HELX_P HELX_P6 6 GLY A 179 ? GLU A 184 ? GLY A 179 GLU A 184 1 ? 6 HELX_P HELX_P7 7 SER A 281 ? MET A 291 ? SER A 281 MET A 291 1 ? 11 HELX_P HELX_P8 8 LEU C 80 ? THR C 84 ? LEU C 81 THR C 85 5 ? 5 HELX_P HELX_P9 9 THR D 82 ? THR D 86 ? THR D 83 THR D 87 5 ? 5 HELX_P HELX_P10 10 ASP D 116 ? VAL D 120 ? ASP D 119 VAL D 123 5 ? 5 HELX_P HELX_P11 11 SER D 131 ? GLN D 139 ? SER D 134 GLN D 142 1 ? 9 HELX_P HELX_P12 12 ALA D 198 ? GLN D 202 ? ALA D 201 GLN D 205 1 ? 5 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 104 SG ? ? ? 1_555 A CYS 168 SG ? ? A CYS 104 A CYS 168 1_555 ? ? ? ? ? ? ? 2.049 ? disulf2 disulf ? ? A CYS 208 SG ? ? ? 1_555 A CYS 263 SG ? ? A CYS 208 A CYS 263 1_555 ? ? ? ? ? ? ? 2.036 ? disulf3 disulf ? ? B CYS 25 SG ? ? ? 1_555 B CYS 80 SG ? ? B CYS 25 B CYS 80 1_555 ? ? ? ? ? ? ? 2.037 ? disulf4 disulf ? ? C CYS 22 SG ? ? ? 1_555 C CYS 89 SG ? ? C CYS 22 C CYS 90 1_555 ? ? ? ? ? ? ? 2.041 ? disulf5 disulf ? ? C CYS 136 SG ? ? ? 1_555 C CYS 186 SG ? ? C CYS 139 C CYS 189 1_555 ? ? ? ? ? ? ? 1.929 ? disulf6 disulf ? ? C CYS 161 SG ? ? ? 1_555 D CYS 171 SG ? ? C CYS 164 D CYS 174 1_555 ? ? ? ? ? ? ? 2.048 ? disulf7 disulf ? ? D CYS 23 SG ? ? ? 1_555 D CYS 91 SG ? ? D CYS 23 D CYS 92 1_555 ? ? ? ? ? ? ? 2.036 ? disulf8 disulf ? ? D CYS 145 SG ? ? ? 1_555 D CYS 210 SG ? ? D CYS 148 D CYS 213 1_555 ? ? ? ? ? ? ? 2.078 ? covale1 covale ? ? A ASN 42 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 42 A NAG 314 1_555 ? ? ? ? ? ? ? 1.444 ? covale2 covale ? ? A ASN 20 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 20 A NAG 400 1_555 ? ? ? ? ? ? ? 1.445 ? covale3 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 400 A NAG 401 1_555 ? ? ? ? ? ? ? 1.453 ? covale4 covale ? ? H NAG . O4 ? ? ? 1_555 I NAG . C1 ? ? A NAG 501 A NAG 502 1_555 ? ? ? ? ? ? ? 1.464 ? covale5 covale ? ? A ASN 165 ND2 ? ? ? 1_555 H NAG . C1 ? ? A ASN 165 A NAG 501 1_555 ? ? ? ? ? ? ? 1.475 ? # 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 0.13 2 TYR 214 A . ? TYR 214 A PRO 215 A ? PRO 215 A 1 -2.56 3 ARG 296 A . ? ARG 296 A HIS 297 A ? HIS 297 A 1 -3.07 4 HIS 31 B . ? HIS 31 B PRO 32 B ? PRO 32 B 1 -3.33 5 SER 6 C . ? SER 6 C PRO 7 C ? PRO 7 C 1 -4.69 6 THR 27 C . ? THR 27 C PRO 28 C ? PRO 28 C 1 -6.03 7 SER 7 D . ? SER 7 D PRO 8 D ? PRO 8 D 1 2.14 8 TYR 151 D . ? TYR 154 D PRO 152 D ? PRO 155 D 1 -0.82 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 6 ? B ? 8 ? C ? 4 ? D ? 4 ? E ? 4 ? F ? 4 ? G ? 4 ? H ? 4 ? I ? 5 ? J ? 5 ? K ? 4 ? L ? 8 ? M ? 8 ? N ? 4 ? O ? 6 ? P ? 4 ? Q ? 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 B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel B 4 5 ? anti-parallel B 5 6 ? anti-parallel B 6 7 ? anti-parallel B 7 8 ? 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 I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel I 4 5 ? anti-parallel J 1 2 ? parallel J 2 3 ? anti-parallel J 3 4 ? anti-parallel J 4 5 ? anti-parallel K 1 2 ? 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 L 4 5 ? anti-parallel L 5 6 ? anti-parallel L 6 7 ? anti-parallel L 7 8 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel M 4 5 ? anti-parallel M 5 6 ? anti-parallel M 6 7 ? anti-parallel M 7 8 ? anti-parallel N 1 2 ? anti-parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel O 1 2 ? parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel O 4 5 ? anti-parallel O 5 6 ? anti-parallel P 1 2 ? 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 # 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 TYR A 8 ? PHE A 18 ? TYR A 8 PHE A 18 A 5 ILE A 96 ? MET A 106 ? ILE A 96 MET A 106 A 6 SER A 112 ? SER A 114 ? SER A 112 SER A 114 B 1 SER A 48 ? PHE A 49 ? SER A 48 PHE A 49 B 2 LEU A 35 ? TRP A 40 ? LEU A 35 TRP A 40 B 3 SER A 24 ? LEU A 32 ? SER A 24 LEU A 32 B 4 TYR A 8 ? PHE A 18 ? TYR A 8 PHE A 18 B 5 ILE A 96 ? MET A 106 ? ILE A 96 MET A 106 B 6 HIS A 117 ? PHE A 120 ? HIS A 117 PHE A 120 B 7 LYS A 123 ? TRP A 129 ? LYS A 123 TRP A 129 B 8 SER A 132 ? THR A 135 ? SER A 132 THR A 135 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 ? THR A 250 ? TRP A 245 THR A 250 C 4 LEU A 238 ? PRO A 239 ? LEU A 238 PRO A 239 D 1 HIS A 233 ? ARG A 234 ? HIS A 233 ARG A 234 D 2 TRP A 245 ? THR A 250 ? TRP A 245 THR A 250 D 3 HIS A 203 ? PHE A 213 ? HIS A 203 PHE A 213 D 4 ASP A 252 ? GLU A 254 ? ASP A 252 GLU A 254 E 1 GLN A 227 ? GLU A 228 ? GLN A 227 GLU A 228 E 2 TRP A 219 ? ARG A 224 ? TRP A 219 ARG A 224 E 3 ALA A 262 ? LYS A 266 ? ALA A 262 LYS A 266 E 4 ILE A 275 ? TYR A 278 ? ILE A 275 TYR A 278 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 GLU B 50 ? MET B 51 ? GLU B 50 MET B 51 G 1 GLN B 6 ? SER B 11 ? GLN B 6 SER B 11 G 2 ASN B 21 ? PHE B 30 ? ASN B 21 PHE B 30 G 3 PHE B 62 ? PHE B 70 ? PHE B 62 PHE B 70 G 4 SER B 55 ? PHE B 56 ? SER B 55 PHE B 56 H 1 LYS B 44 ? LYS B 45 ? LYS B 44 LYS B 45 H 2 GLU B 36 ? LYS B 41 ? GLU B 36 LYS B 41 H 3 TYR B 78 ? LYS B 83 ? TYR B 78 LYS B 83 H 4 LYS B 91 ? TYR B 94 ? LYS B 91 TYR B 94 I 1 VAL C 3 ? SER C 6 ? VAL C 3 SER C 6 I 2 SER C 18 ? TYR C 24 ? SER C 18 TYR C 24 I 3 HIS C 71 ? ILE C 76 ? HIS C 72 ILE C 77 I 4 TYR C 61 ? ASP C 66 ? TYR C 62 ASP C 67 I 5 LYS C 53 ? ASN C 58 ? LYS C 53 ASN C 58 J 1 SER C 9 ? ARG C 13 ? SER C 9 ARG C 13 J 2 THR C 107 ? ILE C 112 ? THR C 110 ILE C 115 J 3 THR C 86 ? GLY C 92 ? THR C 87 GLY C 93 J 4 HIS C 31 ? GLN C 37 ? HIS C 31 GLN C 37 J 5 LEU C 43 ? LEU C 49 ? LEU C 43 LEU C 49 K 1 SER C 9 ? ARG C 13 ? SER C 9 ARG C 13 K 2 THR C 107 ? ILE C 112 ? THR C 110 ILE C 115 K 3 THR C 86 ? GLY C 92 ? THR C 87 GLY C 93 K 4 LEU C 101 ? PHE C 103 ? LEU C 104 PHE C 106 L 1 VAL C 155 ? ILE C 157 ? VAL C 158 ILE C 160 L 2 PHE C 170 ? SER C 179 ? PHE C 173 SER C 182 L 3 SER C 134 ? THR C 139 ? SER C 137 THR C 142 L 4 ALA C 121 ? ASP C 127 ? ALA C 124 ASP C 130 L 5 GLU D 124 ? GLU D 129 ? GLU D 127 GLU D 132 L 6 LYS D 140 ? PHE D 150 ? LYS D 143 PHE D 153 L 7 TYR D 188 ? SER D 197 ? TYR D 191 SER D 200 L 8 VAL D 170 ? THR D 172 ? VAL D 173 THR D 175 M 1 CYS C 161 ? MET C 165 ? CYS C 164 MET C 168 M 2 PHE C 170 ? SER C 179 ? PHE C 173 SER C 182 M 3 SER C 134 ? THR C 139 ? SER C 137 THR C 142 M 4 ALA C 121 ? ASP C 127 ? ALA C 124 ASP C 130 M 5 GLU D 124 ? GLU D 129 ? GLU D 127 GLU D 132 M 6 LYS D 140 ? PHE D 150 ? LYS D 143 PHE D 153 M 7 TYR D 188 ? SER D 197 ? TYR D 191 SER D 200 M 8 LEU D 177 ? LYS D 178 ? LEU D 180 LYS D 181 N 1 VAL D 4 ? SER D 7 ? VAL D 4 SER D 7 N 2 VAL D 19 ? GLN D 25 ? VAL D 19 GLN D 25 N 3 SER D 75 ? LEU D 78 ? SER D 76 LEU D 79 N 4 LYS D 65 ? SER D 67 ? LYS D 66 SER D 68 O 1 ASN D 10 ? VAL D 14 ? ASN D 10 VAL D 14 O 2 THR D 109 ? LEU D 114 ? THR D 112 LEU D 117 O 3 SER D 87 ? GLY D 94 ? SER D 88 GLY D 95 O 4 ASN D 31 ? GLN D 37 ? ASN D 31 GLN D 37 O 5 ARG D 44 ? SER D 49 ? ARG D 44 SER D 49 O 6 GLU D 56 ? LYS D 57 ? GLU D 56 LYS D 57 P 1 ASN D 10 ? VAL D 14 ? ASN D 10 VAL D 14 P 2 THR D 109 ? LEU D 114 ? THR D 112 LEU D 117 P 3 SER D 87 ? GLY D 94 ? SER D 88 GLY D 95 P 4 PHE D 104 ? PHE D 105 ? PHE D 107 PHE D 108 Q 1 LYS D 164 ? VAL D 166 ? LYS D 167 VAL D 169 Q 2 VAL D 155 ? VAL D 161 ? VAL D 158 VAL D 164 Q 3 HIS D 207 ? PHE D 214 ? HIS D 210 PHE D 217 Q 4 GLN D 233 ? TRP D 240 ? GLN D 236 TRP D 243 # 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 GLU A 105 ? N GLU A 105 O GLU A 113 ? O GLU A 113 B 1 2 O SER A 48 ? O SER A 48 N ARG A 39 ? N ARG A 39 B 2 3 O THR A 37 ? O THR A 37 N VAL A 30 ? N VAL A 30 B 3 4 O VAL A 29 ? O VAL A 29 N LEU A 13 ? N LEU A 13 B 4 5 N SER A 16 ? N SER A 16 O ILE A 98 ? O ILE A 98 B 5 6 N SER A 101 ? N SER A 101 O HIS A 117 ? O HIS A 117 B 6 7 N VAL A 118 ? N VAL A 118 O VAL A 126 ? O VAL A 126 B 7 8 N ARG A 127 ? N ARG A 127 O GLN A 134 ? O GLN A 134 C 1 2 N TRP A 192 ? N TRP A 192 O HIS A 209 ? O HIS A 209 C 2 3 N VAL A 210 ? N VAL A 210 O LEU A 247 ? O LEU A 247 C 3 4 O TYR A 246 ? O TYR A 246 N LEU A 238 ? N LEU A 238 D 1 2 N HIS A 233 ? N HIS A 233 O THR A 250 ? O THR A 250 D 2 3 O LEU A 247 ? O LEU A 247 N VAL A 210 ? N VAL A 210 D 3 4 N ARG A 204 ? N ARG A 204 O VAL A 253 ? O VAL A 253 E 1 2 O GLN A 227 ? O GLN A 227 N ARG A 224 ? N ARG A 224 E 2 3 N TRP A 219 ? N TRP A 219 O LYS A 266 ? O LYS A 266 E 3 4 N CYS A 263 ? N CYS A 263 O LEU A 277 ? O LEU A 277 F 1 2 N TYR B 10 ? N TYR B 10 O ASN B 24 ? O ASN B 24 F 2 3 N ASN B 21 ? N ASN B 21 O PHE B 70 ? O PHE B 70 F 3 4 O HIS B 67 ? O HIS B 67 N GLU B 50 ? N GLU B 50 G 1 2 N TYR B 10 ? N TYR B 10 O ASN B 24 ? O ASN B 24 G 2 3 N ASN B 21 ? N ASN B 21 O PHE B 70 ? O PHE B 70 G 3 4 O TYR B 63 ? O TYR B 63 N SER B 55 ? N SER B 55 H 1 2 O LYS B 44 ? O LYS B 44 N LYS B 41 ? N LYS B 41 H 2 3 N GLU B 36 ? N GLU B 36 O LYS B 83 ? O LYS B 83 H 3 4 N CYS B 80 ? N CYS B 80 O VAL B 93 ? O VAL B 93 I 1 2 N SER C 6 ? N SER C 6 O GLN C 21 ? O GLN C 21 I 2 3 N LEU C 20 ? N LEU C 20 O LEU C 74 ? O LEU C 75 I 3 4 O HIS C 75 ? O HIS C 76 N SER C 62 ? N SER C 63 I 4 5 O TYR C 61 ? O TYR C 62 N ASN C 58 ? N ASN C 58 J 1 2 N LEU C 10 ? N LEU C 10 O ILE C 110 ? O ILE C 113 J 2 3 O THR C 107 ? O THR C 110 N TYR C 87 ? N TYR C 88 J 3 4 O VAL C 90 ? O VAL C 91 N ARG C 33 ? N ARG C 33 J 4 5 N TRP C 34 ? N TRP C 34 O LEU C 46 ? O LEU C 46 K 1 2 N LEU C 10 ? N LEU C 10 O ILE C 110 ? O ILE C 113 K 2 3 O THR C 107 ? O THR C 110 N TYR C 87 ? N TYR C 88 K 3 4 N VAL C 91 ? N VAL C 92 O HIS C 102 ? O HIS C 105 L 1 2 N TYR C 156 ? N TYR C 159 O TRP C 178 ? O TRP C 181 L 2 3 O ALA C 175 ? O ALA C 178 N PHE C 138 ? N PHE C 141 L 3 4 O THR C 139 ? O THR C 142 N ALA C 121 ? N ALA C 124 L 4 5 N ARG C 126 ? N ARG C 129 O GLU D 129 ? O GLU D 132 L 5 6 N PHE D 128 ? N PHE D 131 O VAL D 144 ? O VAL D 147 L 6 7 N PHE D 150 ? N PHE D 153 O TYR D 188 ? O TYR D 191 L 7 8 O ARG D 193 ? O ARG D 196 N CYS D 171 ? N CYS D 174 M 1 2 N MET C 165 ? N MET C 168 O PHE C 170 ? O PHE C 173 M 2 3 O ALA C 175 ? O ALA C 178 N PHE C 138 ? N PHE C 141 M 3 4 O THR C 139 ? O THR C 142 N ALA C 121 ? N ALA C 124 M 4 5 N ARG C 126 ? N ARG C 129 O GLU D 129 ? O GLU D 132 M 5 6 N PHE D 128 ? N PHE D 131 O VAL D 144 ? O VAL D 147 M 6 7 N PHE D 150 ? N PHE D 153 O TYR D 188 ? O TYR D 191 M 7 8 O ALA D 189 ? O ALA D 192 N LEU D 177 ? N LEU D 180 N 1 2 N THR D 5 ? N THR D 5 O ASN D 24 ? O ASN D 24 N 2 3 N VAL D 19 ? N VAL D 19 O LEU D 78 ? O LEU D 79 N 3 4 O ILE D 77 ? O ILE D 78 N LYS D 65 ? N LYS D 66 O 1 2 N ALA D 13 ? N ALA D 13 O LEU D 114 ? O LEU D 117 O 2 3 O THR D 109 ? O THR D 112 N TYR D 89 ? N TYR D 90 O 3 4 O PHE D 90 ? O PHE D 91 N TYR D 35 ? N TYR D 35 O 4 5 N TRP D 34 ? N TRP D 34 O ILE D 46 ? O ILE D 46 O 5 6 N TYR D 48 ? N TYR D 48 O GLU D 56 ? O GLU D 56 P 1 2 N ALA D 13 ? N ALA D 13 O LEU D 114 ? O LEU D 117 P 2 3 O THR D 109 ? O THR D 112 N TYR D 89 ? N TYR D 90 P 3 4 N SER D 93 ? N SER D 94 O PHE D 104 ? O PHE D 107 Q 1 2 O LYS D 164 ? O LYS D 167 N VAL D 161 ? N VAL D 164 Q 2 3 N SER D 158 ? N SER D 161 O GLN D 211 ? O GLN D 214 Q 3 4 N CYS D 210 ? N CYS D 213 O ALA D 237 ? O ALA D 240 # 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 ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 400' AC2 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 401' AC3 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 314' AC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 501' AC5 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 502' AC6 Software ? ? ? ? 17 'BINDING SITE FOR RESIDUE DB6 A 650' # 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 3 ASN A 20 ? ASN A 20 . ? 1_555 ? 2 AC1 3 TRP A 23 ? TRP A 23 . ? 1_555 ? 3 AC1 3 NAG F . ? NAG A 401 . ? 1_555 ? 4 AC2 1 NAG E . ? NAG A 400 . ? 1_555 ? 5 AC3 3 TRP A 23 ? TRP A 23 . ? 1_555 ? 6 AC3 3 SER A 24 ? SER A 24 . ? 1_555 ? 7 AC3 3 ASN A 42 ? ASN A 42 . ? 1_555 ? 8 AC4 4 GLY A 130 ? GLY A 130 . ? 1_555 ? 9 AC4 4 GLN A 161 ? GLN A 161 . ? 1_555 ? 10 AC4 4 ASN A 165 ? ASN A 165 . ? 1_555 ? 11 AC4 4 NAG I . ? NAG A 502 . ? 1_555 ? 12 AC5 1 NAG H . ? NAG A 501 . ? 1_555 ? 13 AC6 17 CYS A 12 ? CYS A 12 . ? 1_555 ? 14 AC6 17 GLN A 14 ? GLN A 14 . ? 1_555 ? 15 AC6 17 SER A 28 ? SER A 28 . ? 1_555 ? 16 AC6 17 TYR A 73 ? TYR A 73 . ? 1_555 ? 17 AC6 17 SER A 76 ? SER A 76 . ? 1_555 ? 18 AC6 17 PHE A 77 ? PHE A 77 . ? 1_555 ? 19 AC6 17 ASP A 80 ? ASP A 80 . ? 1_555 ? 20 AC6 17 TRP A 133 ? TRP A 133 . ? 1_555 ? 21 AC6 17 ASP A 153 ? ASP A 153 . ? 1_555 ? 22 AC6 17 GLY A 155 ? GLY A 155 . ? 1_555 ? 23 AC6 17 THR A 156 ? THR A 156 . ? 1_555 ? 24 AC6 17 THR A 159 ? THR A 159 . ? 1_555 ? 25 AC6 17 PHE A 171 ? PHE A 171 . ? 1_555 ? 26 AC6 17 PRO C 28 ? PRO C 28 . ? 1_555 ? 27 AC6 17 ASN C 30 ? ASN C 30 . ? 1_555 ? 28 AC6 17 ARG C 94 ? ARG C 95 . ? 1_555 ? 29 AC6 17 GLY C 95 ? GLY C 96 . ? 1_555 ? # _database_PDB_matrix.entry_id 3ARG _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 3ARG _atom_sites.fract_transf_matrix[1][1] 0.016902 _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] 0.011659 _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] 0.004205 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . ASN A 1 7 ? -34.617 -46.551 -86.121 1.00 105.65 ? 7 ASN A N 1 ATOM 2 C CA . ASN A 1 7 ? -33.598 -47.013 -85.129 1.00 101.54 ? 7 ASN A CA 1 ATOM 3 C C . ASN A 1 7 ? -32.159 -46.784 -85.600 1.00 95.66 ? 7 ASN A C 1 ATOM 4 O O . ASN A 1 7 ? -31.808 -47.111 -86.738 1.00 94.71 ? 7 ASN A O 1 ATOM 5 C CB . ASN A 1 7 ? -33.826 -48.486 -84.746 1.00 103.50 ? 7 ASN A CB 1 ATOM 6 C CG . ASN A 1 7 ? -33.902 -49.420 -85.954 1.00 104.71 ? 7 ASN A CG 1 ATOM 7 O OD1 . ASN A 1 7 ? -33.843 -48.989 -87.108 1.00 104.22 ? 7 ASN A OD1 1 ATOM 8 N ND2 . ASN A 1 7 ? -34.041 -50.713 -85.682 1.00 106.59 ? 7 ASN A ND2 1 ATOM 9 N N . TYR A 1 8 ? -31.335 -46.217 -84.719 1.00 92.24 ? 8 TYR A N 1 ATOM 10 C CA . TYR A 1 8 ? -29.961 -45.837 -85.072 1.00 87.22 ? 8 TYR A CA 1 ATOM 11 C C . TYR A 1 8 ? -28.929 -46.280 -84.031 1.00 83.72 ? 8 TYR A C 1 ATOM 12 O O . TYR A 1 8 ? -29.064 -45.976 -82.844 1.00 84.27 ? 8 TYR A O 1 ATOM 13 C CB . TYR A 1 8 ? -29.873 -44.324 -85.322 1.00 86.93 ? 8 TYR A CB 1 ATOM 14 C CG . TYR A 1 8 ? -30.677 -43.866 -86.522 1.00 90.08 ? 8 TYR A CG 1 ATOM 15 C CD1 . TYR A 1 8 ? -30.137 -43.928 -87.807 1.00 88.93 ? 8 TYR A CD1 1 ATOM 16 C CD2 . TYR A 1 8 ? -31.982 -43.384 -86.377 1.00 94.91 ? 8 TYR A CD2 1 ATOM 17 C CE1 . TYR A 1 8 ? -30.872 -43.520 -88.921 1.00 91.90 ? 8 TYR A CE1 1 ATOM 18 C CE2 . TYR A 1 8 ? -32.725 -42.971 -87.485 1.00 98.00 ? 8 TYR A CE2 1 ATOM 19 C CZ . TYR A 1 8 ? -32.159 -43.043 -88.752 1.00 96.27 ? 8 TYR A CZ 1 ATOM 20 O OH . TYR A 1 8 ? -32.871 -42.644 -89.856 1.00 99.28 ? 8 TYR A OH 1 ATOM 21 N N . THR A 1 9 ? -27.904 -46.998 -84.489 1.00 80.45 ? 9 THR A N 1 ATOM 22 C CA . THR A 1 9 ? -26.869 -47.536 -83.610 1.00 77.43 ? 9 THR A CA 1 ATOM 23 C C . THR A 1 9 ? -25.754 -46.515 -83.392 1.00 74.05 ? 9 THR A C 1 ATOM 24 O O . THR A 1 9 ? -25.042 -46.144 -84.329 1.00 72.36 ? 9 THR A O 1 ATOM 25 C CB . THR A 1 9 ? -26.278 -48.854 -84.160 1.00 76.47 ? 9 THR A CB 1 ATOM 26 O OG1 . THR A 1 9 ? -27.333 -49.698 -84.631 1.00 80.32 ? 9 THR A OG1 1 ATOM 27 C CG2 . THR A 1 9 ? -25.496 -49.593 -83.079 1.00 74.89 ? 9 THR A CG2 1 ATOM 28 N N . PHE A 1 10 ? -25.613 -46.069 -82.145 1.00 73.63 ? 10 PHE A N 1 ATOM 29 C CA . PHE A 1 10 ? -24.619 -45.073 -81.763 1.00 71.07 ? 10 PHE A CA 1 ATOM 30 C C . PHE A 1 10 ? -23.370 -45.783 -81.265 1.00 68.19 ? 10 PHE A C 1 ATOM 31 O O . PHE A 1 10 ? -23.422 -46.516 -80.277 1.00 68.58 ? 10 PHE A O 1 ATOM 32 C CB . PHE A 1 10 ? -25.200 -44.165 -80.680 1.00 73.15 ? 10 PHE A CB 1 ATOM 33 C CG . PHE A 1 10 ? -24.239 -43.142 -80.153 1.00 71.74 ? 10 PHE A CG 1 ATOM 34 C CD1 . PHE A 1 10 ? -24.082 -41.921 -80.794 1.00 72.18 ? 10 PHE A CD1 1 ATOM 35 C CD2 . PHE A 1 10 ? -23.514 -43.384 -78.993 1.00 71.18 ? 10 PHE A CD2 1 ATOM 36 C CE1 . PHE A 1 10 ? -23.203 -40.961 -80.296 1.00 71.64 ? 10 PHE A CE1 1 ATOM 37 C CE2 . PHE A 1 10 ? -22.628 -42.433 -78.488 1.00 70.50 ? 10 PHE A CE2 1 ATOM 38 C CZ . PHE A 1 10 ? -22.476 -41.219 -79.140 1.00 70.86 ? 10 PHE A CZ 1 ATOM 39 N N . ARG A 1 11 ? -22.252 -45.564 -81.953 1.00 65.72 ? 11 ARG A N 1 ATOM 40 C CA . ARG A 1 11 ? -21.017 -46.300 -81.674 1.00 63.47 ? 11 ARG A CA 1 ATOM 41 C C . ARG A 1 11 ? -19.868 -45.389 -81.251 1.00 62.05 ? 11 ARG A C 1 ATOM 42 O O . ARG A 1 11 ? -19.551 -44.411 -81.933 1.00 61.87 ? 11 ARG A O 1 ATOM 43 C CB . ARG A 1 11 ? -20.593 -47.144 -82.886 1.00 62.67 ? 11 ARG A CB 1 ATOM 44 C CG . ARG A 1 11 ? -21.732 -47.915 -83.569 1.00 64.75 ? 11 ARG A CG 1 ATOM 45 C CD . ARG A 1 11 ? -21.232 -49.116 -84.355 1.00 63.70 ? 11 ARG A CD 1 ATOM 46 N NE . ARG A 1 11 ? -20.824 -50.207 -83.476 1.00 63.37 ? 11 ARG A NE 1 ATOM 47 N N . CYS A 1 12 ? -19.266 -45.714 -80.109 1.00 61.51 ? 12 CYS A N 1 ATOM 48 C CA . CYS A 1 12 ? -18.032 -45.083 -79.654 1.00 60.40 ? 12 CYS A CA 1 ATOM 49 C C . CYS A 1 12 ? -16.879 -46.032 -79.912 1.00 58.71 ? 12 CYS A C 1 ATOM 50 O O . CYS A 1 12 ? -16.829 -47.125 -79.345 1.00 58.82 ? 12 CYS A O 1 ATOM 51 C CB . CYS A 1 12 ? -18.105 -44.751 -78.167 1.00 61.50 ? 12 CYS A CB 1 ATOM 52 S SG . CYS A 1 12 ? -18.372 -43.007 -77.812 0.70 63.80 ? 12 CYS A SG 1 ATOM 53 N N . LEU A 1 13 ? -15.962 -45.616 -80.779 1.00 57.70 ? 13 LEU A N 1 ATOM 54 C CA . LEU A 1 13 ? -14.839 -46.457 -81.178 1.00 56.54 ? 13 LEU A CA 1 ATOM 55 C C . LEU A 1 13 ? -13.509 -45.876 -80.724 1.00 56.32 ? 13 LEU A C 1 ATOM 56 O O . LEU A 1 13 ? -13.155 -44.754 -81.086 1.00 56.88 ? 13 LEU A O 1 ATOM 57 C CB . LEU A 1 13 ? -14.835 -46.668 -82.693 1.00 56.37 ? 13 LEU A CB 1 ATOM 58 C CG . LEU A 1 13 ? -16.133 -47.186 -83.314 1.00 57.23 ? 13 LEU A CG 1 ATOM 59 C CD1 . LEU A 1 13 ? -15.927 -47.461 -84.787 1.00 57.63 ? 13 LEU A CD1 1 ATOM 60 C CD2 . LEU A 1 13 ? -16.639 -48.439 -82.604 1.00 58.31 ? 13 LEU A CD2 1 ATOM 61 N N . GLN A 1 14 ? -12.780 -46.651 -79.928 1.00 55.89 ? 14 GLN A N 1 ATOM 62 C CA . GLN A 1 14 ? -11.480 -46.241 -79.432 1.00 56.21 ? 14 GLN A CA 1 ATOM 63 C C . GLN A 1 14 ? -10.417 -47.282 -79.765 1.00 56.10 ? 14 GLN A C 1 ATOM 64 O O . GLN A 1 14 ? -10.604 -48.486 -79.539 1.00 55.62 ? 14 GLN A O 1 ATOM 65 C CB . GLN A 1 14 ? -11.543 -46.000 -77.925 1.00 57.05 ? 14 GLN A CB 1 ATOM 66 C CG . GLN A 1 14 ? -10.219 -45.636 -77.283 1.00 58.37 ? 14 GLN A CG 1 ATOM 67 C CD . GLN A 1 14 ? -10.291 -45.671 -75.777 1.00 59.80 ? 14 GLN A CD 1 ATOM 68 O OE1 . GLN A 1 14 ? -10.652 -44.682 -75.138 1.00 61.07 ? 14 GLN A OE1 1 ATOM 69 N NE2 . GLN A 1 14 ? -9.944 -46.814 -75.196 1.00 60.10 ? 14 GLN A NE2 1 ATOM 70 N N . MET A 1 15 ? -9.306 -46.796 -80.312 1.00 56.80 ? 15 MET A N 1 ATOM 71 C CA . MET A 1 15 ? -8.151 -47.630 -80.634 1.00 57.39 ? 15 MET A CA 1 ATOM 72 C C . MET A 1 15 ? -6.911 -47.092 -79.928 1.00 58.84 ? 15 MET A C 1 ATOM 73 O O . MET A 1 15 ? -6.563 -45.914 -80.058 1.00 59.94 ? 15 MET A O 1 ATOM 74 C CB . MET A 1 15 ? -7.943 -47.734 -82.157 1.00 57.68 ? 15 MET A CB 1 ATOM 75 C CG . MET A 1 15 ? -7.785 -46.399 -82.892 1.00 58.49 ? 15 MET A CG 1 ATOM 76 S SD . MET A 1 15 ? -8.762 -46.295 -84.406 0.70 57.46 ? 15 MET A SD 1 ATOM 77 C CE . MET A 1 15 ? -10.352 -45.764 -83.773 1.00 56.19 ? 15 MET A CE 1 ATOM 78 N N . SER A 1 16 ? -6.266 -47.964 -79.163 1.00 59.25 ? 16 SER A N 1 ATOM 79 C CA . SER A 1 16 ? -5.094 -47.597 -78.390 1.00 61.05 ? 16 SER A CA 1 ATOM 80 C C . SER A 1 16 ? -3.935 -48.533 -78.728 1.00 62.43 ? 16 SER A C 1 ATOM 81 O O . SER A 1 16 ? -4.051 -49.753 -78.599 1.00 62.04 ? 16 SER A O 1 ATOM 82 C CB . SER A 1 16 ? -5.411 -47.648 -76.891 1.00 61.23 ? 16 SER A CB 1 ATOM 83 O OG . SER A 1 16 ? -6.544 -46.856 -76.560 1.00 60.04 ? 16 SER A OG 1 ATOM 84 N N . SER A 1 17 ? -2.823 -47.953 -79.169 1.00 64.49 ? 17 SER A N 1 ATOM 85 C CA . SER A 1 17 ? -1.636 -48.727 -79.515 1.00 66.57 ? 17 SER A CA 1 ATOM 86 C C . SER A 1 17 ? -0.490 -48.468 -78.536 1.00 69.46 ? 17 SER A C 1 ATOM 87 O O . SER A 1 17 ? -0.071 -47.324 -78.339 1.00 71.14 ? 17 SER A O 1 ATOM 88 C CB . SER A 1 17 ? -1.198 -48.422 -80.951 1.00 67.66 ? 17 SER A CB 1 ATOM 89 N N . PHE A 1 18 ? -0.004 -49.540 -77.914 1.00 70.45 ? 18 PHE A N 1 ATOM 90 C CA . PHE A 1 18 ? 1.170 -49.485 -77.048 1.00 73.74 ? 18 PHE A CA 1 ATOM 91 C C . PHE A 1 18 ? 2.304 -50.195 -77.768 1.00 76.65 ? 18 PHE A C 1 ATOM 92 O O . PHE A 1 18 ? 2.198 -51.386 -78.065 1.00 76.15 ? 18 PHE A O 1 ATOM 93 C CB . PHE A 1 18 ? 0.900 -50.170 -75.698 1.00 73.35 ? 18 PHE A CB 1 ATOM 94 C CG . PHE A 1 18 ? -0.344 -49.688 -75.001 0.70 70.54 ? 18 PHE A CG 1 ATOM 95 C CD1 . PHE A 1 18 ? -1.543 -50.381 -75.130 0.70 67.79 ? 18 PHE A CD1 1 ATOM 96 C CD2 . PHE A 1 18 ? -0.317 -48.549 -74.212 0.70 71.24 ? 18 PHE A CD2 1 ATOM 97 C CE1 . PHE A 1 18 ? -2.699 -49.937 -74.490 0.70 65.69 ? 18 PHE A CE1 1 ATOM 98 C CE2 . PHE A 1 18 ? -1.467 -48.100 -73.570 0.70 69.45 ? 18 PHE A CE2 1 ATOM 99 C CZ . PHE A 1 18 ? -2.659 -48.798 -73.708 0.70 66.43 ? 18 PHE A CZ 1 ATOM 100 N N . ALA A 1 19 ? 3.375 -49.462 -78.064 1.00 80.23 ? 19 ALA A N 1 ATOM 101 C CA . ALA A 1 19 ? 4.522 -50.030 -78.779 1.00 83.99 ? 19 ALA A CA 1 ATOM 102 C C . ALA A 1 19 ? 5.480 -50.746 -77.836 1.00 87.34 ? 19 ALA A C 1 ATOM 103 O O . ALA A 1 19 ? 5.846 -51.897 -78.074 1.00 88.54 ? 19 ALA A O 1 ATOM 104 C CB . ALA A 1 19 ? 5.257 -48.955 -79.570 1.00 86.97 ? 19 ALA A CB 1 ATOM 105 N N . ASN A 1 20 ? 5.884 -50.050 -76.775 1.00 89.36 ? 20 ASN A N 1 ATOM 106 C CA . ASN A 1 20 ? 6.777 -50.597 -75.758 1.00 93.05 ? 20 ASN A CA 1 ATOM 107 C C . ASN A 1 20 ? 6.479 -50.006 -74.382 1.00 92.71 ? 20 ASN A C 1 ATOM 108 O O . ASN A 1 20 ? 5.344 -49.609 -74.104 1.00 88.92 ? 20 ASN A O 1 ATOM 109 C CB . ASN A 1 20 ? 8.254 -50.383 -76.140 1.00 99.07 ? 20 ASN A CB 1 ATOM 110 C CG . ASN A 1 20 ? 8.537 -48.980 -76.680 1.00 101.56 ? 20 ASN A CG 1 ATOM 111 O OD1 . ASN A 1 20 ? 7.887 -48.004 -76.291 1.00 99.95 ? 20 ASN A OD1 1 ATOM 112 N ND2 . ASN A 1 20 ? 9.521 -48.882 -77.582 1.00 106.69 ? 20 ASN A ND2 1 ATOM 113 N N . ARG A 1 21 ? 7.501 -49.956 -73.530 1.00 97.17 ? 21 ARG A N 1 ATOM 114 C CA . ARG A 1 21 ? 7.391 -49.384 -72.191 1.00 97.94 ? 21 ARG A CA 1 ATOM 115 C C . ARG A 1 21 ? 7.034 -47.894 -72.228 1.00 97.67 ? 21 ARG A C 1 ATOM 116 O O . ARG A 1 21 ? 6.142 -47.451 -71.504 1.00 95.37 ? 21 ARG A O 1 ATOM 117 C CB . ARG A 1 21 ? 8.692 -49.604 -71.416 1.00 103.69 ? 21 ARG A CB 1 ATOM 118 N N . SER A 1 22 ? 7.716 -47.138 -73.089 1.00 100.40 ? 22 SER A N 1 ATOM 119 C CA . SER A 1 22 ? 7.534 -45.686 -73.172 1.00 101.31 ? 22 SER A CA 1 ATOM 120 C C . SER A 1 22 ? 6.410 -45.249 -74.115 1.00 96.74 ? 22 SER A C 1 ATOM 121 O O . SER A 1 22 ? 5.523 -44.496 -73.714 1.00 94.78 ? 22 SER A O 1 ATOM 122 C CB . SER A 1 22 ? 8.845 -45.009 -73.577 1.00 107.53 ? 22 SER A CB 1 ATOM 123 N N . TRP A 1 23 ? 6.451 -45.736 -75.355 1.00 95.50 ? 23 TRP A N 1 ATOM 124 C CA . TRP A 1 23 ? 5.586 -45.257 -76.444 1.00 92.24 ? 23 TRP A CA 1 ATOM 125 C C . TRP A 1 23 ? 4.162 -45.814 -76.392 1.00 86.38 ? 23 TRP A C 1 ATOM 126 O O . TRP A 1 23 ? 3.965 -47.024 -76.259 1.00 84.54 ? 23 TRP A O 1 ATOM 127 C CB . TRP A 1 23 ? 6.228 -45.605 -77.791 1.00 93.91 ? 23 TRP A CB 1 ATOM 128 C CG . TRP A 1 23 ? 5.815 -44.740 -78.940 1.00 93.24 ? 23 TRP A CG 1 ATOM 129 C CD1 . TRP A 1 23 ? 6.419 -43.588 -79.358 1.00 97.41 ? 23 TRP A CD1 1 ATOM 130 C CD2 . TRP A 1 23 ? 4.730 -44.974 -79.842 1.00 88.82 ? 23 TRP A CD2 1 ATOM 131 N NE1 . TRP A 1 23 ? 5.769 -43.081 -80.456 1.00 95.58 ? 23 TRP A NE1 1 ATOM 132 C CE2 . TRP A 1 23 ? 4.727 -43.913 -80.775 1.00 90.40 ? 23 TRP A CE2 1 ATOM 133 C CE3 . TRP A 1 23 ? 3.752 -45.971 -79.949 1.00 84.24 ? 23 TRP A CE3 1 ATOM 134 C CZ2 . TRP A 1 23 ? 3.786 -43.824 -81.805 1.00 87.30 ? 23 TRP A CZ2 1 ATOM 135 C CZ3 . TRP A 1 23 ? 2.818 -45.884 -80.973 1.00 81.29 ? 23 TRP A CZ3 1 ATOM 136 C CH2 . TRP A 1 23 ? 2.843 -44.816 -81.887 1.00 82.90 ? 23 TRP A CH2 1 ATOM 137 N N . SER A 1 24 ? 3.180 -44.921 -76.507 1.00 84.03 ? 24 SER A N 1 ATOM 138 C CA . SER A 1 24 ? 1.759 -45.291 -76.508 1.00 79.06 ? 24 SER A CA 1 ATOM 139 C C . SER A 1 24 ? 0.895 -44.165 -77.069 1.00 77.65 ? 24 SER A C 1 ATOM 140 O O . SER A 1 24 ? 1.164 -42.993 -76.807 1.00 80.30 ? 24 SER A O 1 ATOM 141 C CB . SER A 1 24 ? 1.291 -45.627 -75.093 1.00 78.01 ? 24 SER A CB 1 ATOM 142 N N . ARG A 1 25 ? -0.138 -44.516 -77.836 1.00 74.04 ? 25 ARG A N 1 ATOM 143 C CA . ARG A 1 25 ? -1.100 -43.516 -78.325 1.00 72.72 ? 25 ARG A CA 1 ATOM 144 C C . ARG A 1 25 ? -2.552 -44.009 -78.450 1.00 68.75 ? 25 ARG A C 1 ATOM 145 O O . ARG A 1 25 ? -2.803 -45.201 -78.651 1.00 66.84 ? 25 ARG A O 1 ATOM 146 C CB . ARG A 1 25 ? -0.618 -42.858 -79.625 1.00 74.58 ? 25 ARG A CB 1 ATOM 147 C CG . ARG A 1 25 ? -0.505 -43.766 -80.844 1.00 73.39 ? 25 ARG A CG 1 ATOM 148 C CD . ARG A 1 25 ? -0.278 -42.925 -82.094 1.00 74.64 ? 25 ARG A CD 1 ATOM 149 N NE . ARG A 1 25 ? -1.425 -42.063 -82.370 1.00 72.75 ? 25 ARG A NE 1 ATOM 150 C CZ . ARG A 1 25 ? -1.344 -40.810 -82.810 1.00 75.12 ? 25 ARG A CZ 1 ATOM 151 N NH1 . ARG A 1 25 ? -0.164 -40.243 -83.023 1.00 79.43 ? 25 ARG A NH1 1 ATOM 152 N NH2 . ARG A 1 25 ? -2.454 -40.118 -83.028 1.00 73.75 ? 25 ARG A NH2 1 ATOM 153 N N . THR A 1 26 ? -3.496 -43.073 -78.332 1.00 68.02 ? 26 THR A N 1 ATOM 154 C CA . THR A 1 26 ? -4.926 -43.391 -78.285 1.00 65.07 ? 26 THR A CA 1 ATOM 155 C C . THR A 1 26 ? -5.753 -42.410 -79.108 1.00 64.71 ? 26 THR A C 1 ATOM 156 O O . THR A 1 26 ? -5.710 -41.199 -78.880 1.00 66.83 ? 26 THR A O 1 ATOM 157 C CB . THR A 1 26 ? -5.449 -43.409 -76.824 1.00 64.94 ? 26 THR A CB 1 ATOM 158 O OG1 . THR A 1 26 ? -4.864 -44.512 -76.124 1.00 65.36 ? 26 THR A OG1 1 ATOM 159 C CG2 . THR A 1 26 ? -6.977 -43.532 -76.768 1.00 62.68 ? 26 THR A CG2 1 ATOM 160 N N . ASP A 1 27 ? -6.510 -42.943 -80.063 1.00 62.58 ? 27 ASP A N 1 ATOM 161 C CA . ASP A 1 27 ? -7.413 -42.130 -80.870 1.00 62.16 ? 27 ASP A CA 1 ATOM 162 C C . ASP A 1 27 ? -8.821 -42.734 -80.872 1.00 59.62 ? 27 ASP A C 1 ATOM 163 O O . ASP A 1 27 ? -8.983 -43.956 -80.789 1.00 57.94 ? 27 ASP A O 1 ATOM 164 C CB . ASP A 1 27 ? -6.873 -41.964 -82.299 1.00 63.22 ? 27 ASP A CB 1 ATOM 165 C CG . ASP A 1 27 ? -5.437 -41.436 -82.337 1.00 66.50 ? 27 ASP A CG 1 ATOM 166 O OD1 . ASP A 1 27 ? -5.236 -40.247 -82.673 1.00 68.86 ? 27 ASP A OD1 1 ATOM 167 O OD2 . ASP A 1 27 ? -4.510 -42.216 -82.027 1.00 67.64 ? 27 ASP A OD2 1 ATOM 168 N N . SER A 1 28 ? -9.830 -41.867 -80.966 1.00 59.70 ? 28 SER A N 1 ATOM 169 C CA . SER A 1 28 ? -11.231 -42.279 -80.861 1.00 58.31 ? 28 SER A CA 1 ATOM 170 C C . SER A 1 28 ? -12.163 -41.571 -81.850 1.00 58.76 ? 28 SER A C 1 ATOM 171 O O . SER A 1 28 ? -11.994 -40.380 -82.136 1.00 60.48 ? 28 SER A O 1 ATOM 172 C CB . SER A 1 28 ? -11.734 -42.050 -79.437 1.00 58.80 ? 28 SER A CB 1 ATOM 173 N N . VAL A 1 29 ? -13.148 -42.313 -82.361 1.00 57.65 ? 29 VAL A N 1 ATOM 174 C CA . VAL A 1 29 ? -14.191 -41.749 -83.234 1.00 58.38 ? 29 VAL A CA 1 ATOM 175 C C . VAL A 1 29 ? -15.616 -42.103 -82.775 1.00 58.37 ? 29 VAL A C 1 ATOM 176 O O . VAL A 1 29 ? -15.828 -43.128 -82.122 1.00 57.53 ? 29 VAL A O 1 ATOM 177 C CB . VAL A 1 29 ? -13.997 -42.136 -84.724 1.00 58.04 ? 29 VAL A CB 1 ATOM 178 C CG1 . VAL A 1 29 ? -12.763 -41.466 -85.289 1.00 59.17 ? 29 VAL A CG1 1 ATOM 179 C CG2 . VAL A 1 29 ? -13.926 -43.648 -84.901 1.00 57.15 ? 29 VAL A CG2 1 ATOM 180 N N . VAL A 1 30 ? -16.581 -41.248 -83.123 1.00 59.79 ? 30 VAL A N 1 ATOM 181 C CA . VAL A 1 30 ? -17.970 -41.413 -82.679 1.00 60.68 ? 30 VAL A CA 1 ATOM 182 C C . VAL A 1 30 ? -18.964 -41.354 -83.842 1.00 61.55 ? 30 VAL A C 1 ATOM 183 O O . VAL A 1 30 ? -19.057 -40.334 -84.522 1.00 62.70 ? 30 VAL A O 1 ATOM 184 C CB . VAL A 1 30 ? -18.338 -40.349 -81.619 1.00 62.57 ? 30 VAL A CB 1 ATOM 185 C CG1 . VAL A 1 30 ? -19.794 -40.457 -81.215 1.00 63.95 ? 30 VAL A CG1 1 ATOM 186 C CG2 . VAL A 1 30 ? -17.452 -40.490 -80.398 1.00 62.39 ? 30 VAL A CG2 1 ATOM 187 N N . TRP A 1 31 ? -19.709 -42.445 -84.042 1.00 61.49 ? 31 TRP A N 1 ATOM 188 C CA . TRP A 1 31 ? -20.671 -42.576 -85.146 1.00 62.96 ? 31 TRP A CA 1 ATOM 189 C C . TRP A 1 31 ? -22.124 -42.675 -84.677 1.00 65.11 ? 31 TRP A C 1 ATOM 190 O O . TRP A 1 31 ? -22.468 -43.551 -83.885 1.00 65.30 ? 31 TRP A O 1 ATOM 191 C CB . TRP A 1 31 ? -20.379 -43.830 -85.985 1.00 62.11 ? 31 TRP A CB 1 ATOM 192 C CG . TRP A 1 31 ? -18.988 -43.954 -86.529 1.00 61.11 ? 31 TRP A CG 1 ATOM 193 C CD1 . TRP A 1 31 ? -17.927 -44.587 -85.939 1.00 59.94 ? 31 TRP A CD1 1 ATOM 194 C CD2 . TRP A 1 31 ? -18.512 -43.464 -87.785 1.00 61.76 ? 31 TRP A CD2 1 ATOM 195 N NE1 . TRP A 1 31 ? -16.816 -44.503 -86.743 1.00 59.31 ? 31 TRP A NE1 1 ATOM 196 C CE2 . TRP A 1 31 ? -17.147 -43.821 -87.884 1.00 60.47 ? 31 TRP A CE2 1 ATOM 197 C CE3 . TRP A 1 31 ? -19.102 -42.750 -88.834 1.00 63.56 ? 31 TRP A CE3 1 ATOM 198 C CZ2 . TRP A 1 31 ? -16.363 -43.488 -88.988 1.00 61.12 ? 31 TRP A CZ2 1 ATOM 199 C CZ3 . TRP A 1 31 ? -18.321 -42.416 -89.932 1.00 64.31 ? 31 TRP A CZ3 1 ATOM 200 C CH2 . TRP A 1 31 ? -16.964 -42.789 -90.000 1.00 63.08 ? 31 TRP A CH2 1 ATOM 201 N N . LEU A 1 32 ? -22.976 -41.788 -85.179 1.00 67.36 ? 32 LEU A N 1 ATOM 202 C CA . LEU A 1 32 ? -24.420 -41.978 -85.075 1.00 70.15 ? 32 LEU A CA 1 ATOM 203 C C . LEU A 1 32 ? -24.924 -42.474 -86.428 1.00 71.26 ? 32 LEU A C 1 ATOM 204 O O . LEU A 1 32 ? -24.690 -41.838 -87.459 1.00 71.38 ? 32 LEU A O 1 ATOM 205 C CB . LEU A 1 32 ? -25.134 -40.687 -84.662 1.00 72.69 ? 32 LEU A CB 1 ATOM 206 C CG . LEU A 1 32 ? -26.664 -40.753 -84.545 1.00 76.32 ? 32 LEU A CG 1 ATOM 207 C CD1 . LEU A 1 32 ? -27.103 -41.768 -83.496 1.00 77.33 ? 32 LEU A CD1 1 ATOM 208 C CD2 . LEU A 1 32 ? -27.264 -39.389 -84.245 1.00 79.20 ? 32 LEU A CD2 1 ATOM 209 N N . GLY A 1 33 ? -25.615 -43.611 -86.417 1.00 72.56 ? 33 GLY A N 1 ATOM 210 C CA . GLY A 1 33 ? -25.948 -44.318 -87.652 1.00 73.71 ? 33 GLY A CA 1 ATOM 211 C C . GLY A 1 33 ? -24.641 -44.653 -88.342 1.00 71.02 ? 33 GLY A C 1 ATOM 212 O O . GLY A 1 33 ? -23.876 -45.500 -87.865 1.00 69.14 ? 33 GLY A O 1 ATOM 213 N N . ASP A 1 34 ? -24.379 -43.959 -89.449 1.00 71.20 ? 34 ASP A N 1 ATOM 214 C CA . ASP A 1 34 ? -23.079 -44.007 -90.132 1.00 68.98 ? 34 ASP A CA 1 ATOM 215 C C . ASP A 1 34 ? -22.542 -42.584 -90.381 1.00 68.49 ? 34 ASP A C 1 ATOM 216 O O . ASP A 1 34 ? -21.893 -42.308 -91.392 1.00 68.33 ? 34 ASP A O 1 ATOM 217 C CB . ASP A 1 34 ? -23.165 -44.828 -91.430 1.00 70.14 ? 34 ASP A CB 1 ATOM 218 C CG . ASP A 1 34 ? -24.400 -44.492 -92.267 1.00 73.96 ? 34 ASP A CG 1 ATOM 219 O OD1 . ASP A 1 34 ? -24.946 -43.372 -92.129 1.00 75.94 ? 34 ASP A OD1 1 ATOM 220 O OD2 . ASP A 1 34 ? -24.826 -45.353 -93.069 1.00 75.96 ? 34 ASP A OD2 1 ATOM 221 N N . LEU A 1 35 ? -22.829 -41.687 -89.440 1.00 68.64 ? 35 LEU A N 1 ATOM 222 C CA . LEU A 1 35 ? -22.358 -40.306 -89.508 1.00 68.84 ? 35 LEU A CA 1 ATOM 223 C C . LEU A 1 35 ? -21.426 -39.983 -88.356 1.00 67.05 ? 35 LEU A C 1 ATOM 224 O O . LEU A 1 35 ? -21.818 -40.051 -87.191 1.00 66.95 ? 35 LEU A O 1 ATOM 225 C CB . LEU A 1 35 ? -23.534 -39.322 -89.519 1.00 71.74 ? 35 LEU A CB 1 ATOM 226 C CG . LEU A 1 35 ? -24.185 -39.016 -90.866 1.00 73.74 ? 35 LEU A CG 1 ATOM 227 C CD1 . LEU A 1 35 ? -25.500 -38.298 -90.643 1.00 77.25 ? 35 LEU A CD1 1 ATOM 228 C CD2 . LEU A 1 35 ? -23.261 -38.184 -91.747 1.00 73.37 ? 35 LEU A CD2 1 ATOM 229 N N . GLN A 1 36 ? -20.189 -39.634 -88.695 1.00 66.07 ? 36 GLN A N 1 ATOM 230 C CA . GLN A 1 36 ? -19.193 -39.243 -87.706 1.00 65.08 ? 36 GLN A CA 1 ATOM 231 C C . GLN A 1 36 ? -19.591 -37.927 -87.040 1.00 67.26 ? 36 GLN A C 1 ATOM 232 O O . GLN A 1 36 ? -19.857 -36.935 -87.719 1.00 69.30 ? 36 GLN A O 1 ATOM 233 C CB . GLN A 1 36 ? -17.810 -39.134 -88.354 1.00 64.37 ? 36 GLN A CB 1 ATOM 234 C CG . GLN A 1 36 ? -16.701 -38.731 -87.393 1.00 63.73 ? 36 GLN A CG 1 ATOM 235 C CD . GLN A 1 36 ? -15.319 -38.935 -87.969 1.00 63.07 ? 36 GLN A CD 1 ATOM 236 O OE1 . GLN A 1 36 ? -15.101 -39.812 -88.806 1.00 62.88 ? 36 GLN A OE1 1 ATOM 237 N NE2 . GLN A 1 36 ? -14.369 -38.132 -87.513 1.00 63.77 ? 36 GLN A NE2 1 ATOM 238 N N . THR A 1 37 ? -19.636 -37.936 -85.711 1.00 67.25 ? 37 THR A N 1 ATOM 239 C CA . THR A 1 37 ? -20.028 -36.756 -84.941 1.00 70.00 ? 37 THR A CA 1 ATOM 240 C C . THR A 1 37 ? -18.914 -36.240 -84.028 1.00 70.19 ? 37 THR A C 1 ATOM 241 O O . THR A 1 37 ? -18.872 -35.050 -83.716 1.00 72.94 ? 37 THR A O 1 ATOM 242 C CB . THR A 1 37 ? -21.316 -36.991 -84.109 1.00 71.13 ? 37 THR A CB 1 ATOM 243 O OG1 . THR A 1 37 ? -21.183 -38.190 -83.337 1.00 69.24 ? 37 THR A OG1 1 ATOM 244 C CG2 . THR A 1 37 ? -22.541 -37.101 -85.017 1.00 72.61 ? 37 THR A CG2 1 ATOM 245 N N . HIS A 1 38 ? -18.017 -37.126 -83.602 1.00 68.01 ? 38 HIS A N 1 ATOM 246 C CA . HIS A 1 38 ? -16.922 -36.722 -82.719 1.00 68.45 ? 38 HIS A CA 1 ATOM 247 C C . HIS A 1 38 ? -15.565 -37.336 -83.073 1.00 66.74 ? 38 HIS A C 1 ATOM 248 O O . HIS A 1 38 ? -15.465 -38.516 -83.447 1.00 64.30 ? 38 HIS A O 1 ATOM 249 C CB . HIS A 1 38 ? -17.255 -37.021 -81.257 1.00 68.59 ? 38 HIS A CB 1 ATOM 250 C CG . HIS A 1 38 ? -18.529 -36.400 -80.779 1.00 71.10 ? 38 HIS A CG 1 ATOM 251 N ND1 . HIS A 1 38 ? -19.759 -36.991 -80.966 1.00 71.12 ? 38 HIS A ND1 1 ATOM 252 C CD2 . HIS A 1 38 ? -18.763 -35.250 -80.104 1.00 74.50 ? 38 HIS A CD2 1 ATOM 253 C CE1 . HIS A 1 38 ? -20.697 -36.231 -80.430 1.00 74.24 ? 38 HIS A CE1 1 ATOM 254 N NE2 . HIS A 1 38 ? -20.119 -35.167 -79.902 1.00 76.43 ? 38 HIS A NE2 1 ATOM 255 N N . ARG A 1 39 ? -14.533 -36.507 -82.922 1.00 68.32 ? 39 ARG A N 1 ATOM 256 C CA . ARG A 1 39 ? -13.147 -36.866 -83.199 1.00 67.79 ? 39 ARG A CA 1 ATOM 257 C C . ARG A 1 39 ? -12.303 -36.594 -81.954 1.00 69.09 ? 39 ARG A C 1 ATOM 258 O O . ARG A 1 39 ? -12.449 -35.550 -81.317 1.00 71.63 ? 39 ARG A O 1 ATOM 259 C CB . ARG A 1 39 ? -12.641 -36.048 -84.398 1.00 69.61 ? 39 ARG A CB 1 ATOM 260 C CG . ARG A 1 39 ? -11.128 -35.925 -84.544 1.00 70.40 ? 39 ARG A CG 1 ATOM 261 C CD . ARG A 1 39 ? -10.754 -34.828 -85.535 1.00 72.84 ? 39 ARG A CD 1 ATOM 262 N NE . ARG A 1 39 ? -10.855 -35.268 -86.927 0.70 71.87 ? 39 ARG A NE 1 ATOM 263 C CZ . ARG A 1 39 ? -11.873 -34.998 -87.745 0.70 71.67 ? 39 ARG A CZ 1 ATOM 264 N NH1 . ARG A 1 39 ? -12.905 -34.279 -87.327 0.70 72.58 ? 39 ARG A NH1 1 ATOM 265 N NH2 . ARG A 1 39 ? -11.855 -35.451 -88.991 0.70 70.96 ? 39 ARG A NH2 1 ATOM 266 N N . TRP A 1 40 ? -11.435 -37.538 -81.598 1.00 67.81 ? 40 TRP A N 1 ATOM 267 C CA . TRP A 1 40 ? -10.505 -37.325 -80.494 1.00 69.49 ? 40 TRP A CA 1 ATOM 268 C C . TRP A 1 40 ? -9.129 -37.922 -80.752 1.00 69.43 ? 40 TRP A C 1 ATOM 269 O O . TRP A 1 40 ? -8.962 -39.145 -80.807 1.00 67.10 ? 40 TRP A O 1 ATOM 270 C CB . TRP A 1 40 ? -11.082 -37.845 -79.181 1.00 68.74 ? 40 TRP A CB 1 ATOM 271 C CG . TRP A 1 40 ? -10.559 -37.107 -77.979 1.00 72.13 ? 40 TRP A CG 1 ATOM 272 C CD1 . TRP A 1 40 ? -10.090 -35.815 -77.938 1.00 75.82 ? 40 TRP A CD1 1 ATOM 273 C CD2 . TRP A 1 40 ? -10.480 -37.602 -76.639 1.00 72.41 ? 40 TRP A CD2 1 ATOM 274 N NE1 . TRP A 1 40 ? -9.715 -35.488 -76.658 1.00 78.21 ? 40 TRP A NE1 1 ATOM 275 C CE2 . TRP A 1 40 ? -9.945 -36.564 -75.840 1.00 76.21 ? 40 TRP A CE2 1 ATOM 276 C CE3 . TRP A 1 40 ? -10.806 -38.823 -76.036 1.00 70.23 ? 40 TRP A CE3 1 ATOM 277 C CZ2 . TRP A 1 40 ? -9.726 -36.714 -74.468 1.00 77.71 ? 40 TRP A CZ2 1 ATOM 278 C CZ3 . TRP A 1 40 ? -10.587 -38.971 -74.672 1.00 71.77 ? 40 TRP A CZ3 1 ATOM 279 C CH2 . TRP A 1 40 ? -10.053 -37.921 -73.904 1.00 75.35 ? 40 TRP A CH2 1 ATOM 280 N N . SER A 1 41 ? -8.151 -37.032 -80.897 1.00 72.53 ? 41 SER A N 1 ATOM 281 C CA . SER A 1 41 ? -6.787 -37.390 -81.273 1.00 73.55 ? 41 SER A CA 1 ATOM 282 C C . SER A 1 41 ? -5.869 -37.482 -80.053 1.00 75.07 ? 41 SER A C 1 ATOM 283 O O . SER A 1 41 ? -6.017 -36.706 -79.108 1.00 77.12 ? 41 SER A O 1 ATOM 284 C CB . SER A 1 41 ? -6.253 -36.348 -82.262 1.00 76.78 ? 41 SER A CB 1 ATOM 285 O OG . SER A 1 41 ? -4.848 -36.433 -82.422 1.00 79.69 ? 41 SER A OG 1 ATOM 286 N N . ASN A 1 42 ? -4.924 -38.426 -80.084 1.00 74.47 ? 42 ASN A N 1 ATOM 287 C CA . ASN A 1 42 ? -3.877 -38.523 -79.055 1.00 76.54 ? 42 ASN A CA 1 ATOM 288 C C . ASN A 1 42 ? -3.072 -37.229 -78.938 1.00 81.17 ? 42 ASN A C 1 ATOM 289 O O . ASN A 1 42 ? -2.534 -36.914 -77.879 1.00 83.68 ? 42 ASN A O 1 ATOM 290 C CB . ASN A 1 42 ? -2.924 -39.691 -79.337 1.00 76.16 ? 42 ASN A CB 1 ATOM 291 C CG . ASN A 1 42 ? -2.051 -40.030 -78.136 1.00 78.05 ? 42 ASN A CG 1 ATOM 292 O OD1 . ASN A 1 42 ? -2.482 -40.744 -77.229 1.00 76.44 ? 42 ASN A OD1 1 ATOM 293 N ND2 . ASN A 1 42 ? -0.817 -39.521 -78.127 1.00 82.10 ? 42 ASN A ND2 1 ATOM 294 N N . ASP A 1 43 ? -2.995 -36.500 -80.046 1.00 82.59 ? 43 ASP A N 1 ATOM 295 C CA . ASP A 1 43 ? -2.361 -35.194 -80.086 1.00 87.62 ? 43 ASP A CA 1 ATOM 296 C C . ASP A 1 43 ? -3.245 -34.124 -79.449 1.00 88.82 ? 43 ASP A C 1 ATOM 297 O O . ASP A 1 43 ? -2.737 -33.131 -78.924 1.00 93.45 ? 43 ASP A O 1 ATOM 298 C CB . ASP A 1 43 ? -2.041 -34.810 -81.533 1.00 89.21 ? 43 ASP A CB 1 ATOM 299 N N . SER A 1 44 ? -4.562 -34.334 -79.492 1.00 85.15 ? 44 SER A N 1 ATOM 300 C CA . SER A 1 44 ? -5.531 -33.316 -79.057 1.00 86.44 ? 44 SER A CA 1 ATOM 301 C C . SER A 1 44 ? -5.940 -33.434 -77.588 1.00 86.14 ? 44 SER A C 1 ATOM 302 O O . SER A 1 44 ? -6.038 -34.539 -77.044 1.00 82.90 ? 44 SER A O 1 ATOM 303 C CB . SER A 1 44 ? -6.775 -33.322 -79.954 1.00 83.74 ? 44 SER A CB 1 ATOM 304 O OG . SER A 1 44 ? -7.632 -32.237 -79.633 1.00 85.81 ? 44 SER A OG 1 ATOM 305 N N . ALA A 1 45 ? -6.190 -32.280 -76.969 1.00 89.74 ? 45 ALA A N 1 ATOM 306 C CA . ALA A 1 45 ? -6.506 -32.191 -75.544 1.00 90.61 ? 45 ALA A CA 1 ATOM 307 C C . ALA A 1 45 ? -8.009 -32.228 -75.248 1.00 88.33 ? 45 ALA A C 1 ATOM 308 O O . ALA A 1 45 ? -8.422 -32.700 -74.187 1.00 87.45 ? 45 ALA A O 1 ATOM 309 C CB . ALA A 1 45 ? -5.882 -30.940 -74.953 1.00 96.81 ? 45 ALA A CB 1 ATOM 310 N N . THR A 1 46 ? -8.816 -31.725 -76.184 1.00 87.74 ? 46 THR A N 1 ATOM 311 C CA . THR A 1 46 ? -10.275 -31.696 -76.036 1.00 86.11 ? 46 THR A CA 1 ATOM 312 C C . THR A 1 46 ? -10.967 -32.475 -77.154 1.00 81.73 ? 46 THR A C 1 ATOM 313 O O . THR A 1 46 ? -10.469 -32.519 -78.280 1.00 80.96 ? 46 THR A O 1 ATOM 314 C CB . THR A 1 46 ? -10.831 -30.242 -76.006 1.00 90.72 ? 46 THR A CB 1 ATOM 315 O OG1 . THR A 1 46 ? -10.297 -29.488 -77.101 1.00 92.55 ? 46 THR A OG1 1 ATOM 316 C CG2 . THR A 1 46 ? -10.473 -29.553 -74.703 1.00 95.02 ? 46 THR A CG2 1 ATOM 317 N N . ILE A 1 47 ? -12.111 -33.082 -76.835 1.00 79.31 ? 47 ILE A N 1 ATOM 318 C CA . ILE A 1 47 ? -12.913 -33.826 -77.823 1.00 75.80 ? 47 ILE A CA 1 ATOM 319 C C . ILE A 1 47 ? -13.510 -32.878 -78.869 1.00 77.58 ? 47 ILE A C 1 ATOM 320 O O . ILE A 1 47 ? -14.242 -31.939 -78.537 1.00 80.58 ? 47 ILE A O 1 ATOM 321 C CB . ILE A 1 47 ? -14.028 -34.696 -77.160 1.00 73.66 ? 47 ILE A CB 1 ATOM 322 C CG1 . ILE A 1 47 ? -13.421 -35.719 -76.201 1.00 71.90 ? 47 ILE A CG1 1 ATOM 323 C CG2 . ILE A 1 47 ? -14.860 -35.423 -78.207 1.00 70.43 ? 47 ILE A CG2 1 ATOM 324 N N . SER A 1 48 ? -13.178 -33.137 -80.131 1.00 76.07 ? 48 SER A N 1 ATOM 325 C CA . SER A 1 48 ? -13.597 -32.292 -81.245 1.00 77.84 ? 48 SER A CA 1 ATOM 326 C C . SER A 1 48 ? -14.986 -32.667 -81.755 1.00 76.15 ? 48 SER A C 1 ATOM 327 O O . SER A 1 48 ? -15.300 -33.850 -81.939 1.00 72.88 ? 48 SER A O 1 ATOM 328 C CB . SER A 1 48 ? -12.584 -32.378 -82.396 1.00 77.60 ? 48 SER A CB 1 ATOM 329 O OG . SER A 1 48 ? -11.249 -32.414 -81.918 1.00 78.66 ? 48 SER A OG 1 ATOM 330 N N . PHE A 1 49 ? -15.812 -31.649 -81.974 1.00 78.90 ? 49 PHE A N 1 ATOM 331 C CA . PHE A 1 49 ? -17.091 -31.814 -82.651 1.00 78.20 ? 49 PHE A CA 1 ATOM 332 C C . PHE A 1 49 ? -16.838 -31.852 -84.157 1.00 77.42 ? 49 PHE A C 1 ATOM 333 O O . PHE A 1 49 ? -15.947 -31.161 -84.653 1.00 79.25 ? 49 PHE A O 1 ATOM 334 C CB . PHE A 1 49 ? -18.032 -30.661 -82.290 1.00 82.41 ? 49 PHE A CB 1 ATOM 335 N N . THR A 1 50 ? -17.599 -32.677 -84.878 1.00 75.10 ? 50 THR A N 1 ATOM 336 C CA . THR A 1 50 ? -17.439 -32.797 -86.338 1.00 74.49 ? 50 THR A CA 1 ATOM 337 C C . THR A 1 50 ? -18.713 -32.397 -87.085 1.00 76.24 ? 50 THR A C 1 ATOM 338 O O . THR A 1 50 ? -18.703 -32.249 -88.308 1.00 76.92 ? 50 THR A O 1 ATOM 339 C CB . THR A 1 50 ? -16.970 -34.215 -86.793 1.00 70.69 ? 50 THR A CB 1 ATOM 340 O OG1 . THR A 1 50 ? -18.078 -35.119 -86.812 1.00 68.88 ? 50 THR A OG1 1 ATOM 341 C CG2 . THR A 1 50 ? -15.890 -34.763 -85.879 1.00 68.82 ? 50 THR A CG2 1 ATOM 342 N N . LYS A 1 51 ? -19.803 -32.236 -86.338 1.00 77.30 ? 51 LYS A N 1 ATOM 343 C CA . LYS A 1 51 ? -21.059 -31.728 -86.884 1.00 79.82 ? 51 LYS A CA 1 ATOM 344 C C . LYS A 1 51 ? -21.498 -30.471 -86.116 1.00 83.79 ? 51 LYS A C 1 ATOM 345 O O . LYS A 1 51 ? -21.160 -30.317 -84.940 1.00 83.98 ? 51 LYS A O 1 ATOM 346 C CB . LYS A 1 51 ? -22.138 -32.815 -86.836 1.00 78.20 ? 51 LYS A CB 1 ATOM 347 N N . PRO A 1 52 ? -22.239 -29.557 -86.778 1.00 87.42 ? 52 PRO A N 1 ATOM 348 C CA . PRO A 1 52 ? -22.723 -28.360 -86.075 1.00 91.85 ? 52 PRO A CA 1 ATOM 349 C C . PRO A 1 52 ? -23.906 -28.642 -85.138 1.00 92.68 ? 52 PRO A C 1 ATOM 350 O O . PRO A 1 52 ? -24.696 -27.740 -84.853 1.00 97.16 ? 52 PRO A O 1 ATOM 351 C CB . PRO A 1 52 ? -23.150 -27.430 -87.218 1.00 95.43 ? 52 PRO A CB 1 ATOM 352 C CG . PRO A 1 52 ? -23.523 -28.347 -88.326 1.00 93.09 ? 52 PRO A CG 1 ATOM 353 C CD . PRO A 1 52 ? -22.579 -29.522 -88.216 1.00 88.15 ? 52 PRO A CD 1 ATOM 354 N N . TRP A 1 53 ? -24.016 -29.882 -84.667 1.00 88.88 ? 53 TRP A N 1 ATOM 355 C CA . TRP A 1 53 ? -25.063 -30.273 -83.726 1.00 89.79 ? 53 TRP A CA 1 ATOM 356 C C . TRP A 1 53 ? -24.629 -31.423 -82.823 1.00 86.21 ? 53 TRP A C 1 ATOM 357 O O . TRP A 1 53 ? -25.447 -31.985 -82.092 1.00 86.72 ? 53 TRP A O 1 ATOM 358 C CB . TRP A 1 53 ? -26.353 -30.638 -84.467 1.00 90.97 ? 53 TRP A CB 1 ATOM 359 C CG . TRP A 1 53 ? -26.166 -31.611 -85.588 1.00 87.17 ? 53 TRP A CG 1 ATOM 360 C CD1 . TRP A 1 53 ? -25.899 -31.312 -86.892 1.00 87.17 ? 53 TRP A CD1 1 ATOM 361 C CD2 . TRP A 1 53 ? -26.242 -33.040 -85.512 1.00 83.35 ? 53 TRP A CD2 1 ATOM 362 N NE1 . TRP A 1 53 ? -25.799 -32.464 -87.634 1.00 83.69 ? 53 TRP A NE1 1 ATOM 363 C CE2 . TRP A 1 53 ? -26.006 -33.540 -86.812 1.00 81.42 ? 53 TRP A CE2 1 ATOM 364 C CE3 . TRP A 1 53 ? -26.487 -33.948 -84.474 1.00 81.93 ? 53 TRP A CE3 1 ATOM 365 C CZ2 . TRP A 1 53 ? -26.005 -34.908 -87.100 1.00 78.21 ? 53 TRP A CZ2 1 ATOM 366 C CZ3 . TRP A 1 53 ? -26.484 -35.310 -84.764 1.00 78.65 ? 53 TRP A CZ3 1 ATOM 367 C CH2 . TRP A 1 53 ? -26.245 -35.774 -86.066 1.00 76.80 ? 53 TRP A CH2 1 ATOM 368 N N . SER A 1 54 ? -23.337 -31.747 -82.863 1.00 83.22 ? 54 SER A N 1 ATOM 369 C CA . SER A 1 54 ? -22.778 -32.910 -82.160 1.00 79.61 ? 54 SER A CA 1 ATOM 370 C C . SER A 1 54 ? -22.837 -32.805 -80.636 1.00 80.99 ? 54 SER A C 1 ATOM 371 O O . SER A 1 54 ? -22.713 -33.814 -79.939 1.00 78.60 ? 54 SER A O 1 ATOM 372 C CB . SER A 1 54 ? -21.340 -33.169 -82.613 1.00 76.70 ? 54 SER A CB 1 ATOM 373 N N . GLN A 1 55 ? -23.031 -31.585 -80.133 1.00 85.26 ? 55 GLN A N 1 ATOM 374 C CA . GLN A 1 55 ? -23.202 -31.342 -78.698 1.00 87.73 ? 55 GLN A CA 1 ATOM 375 C C . GLN A 1 55 ? -24.527 -31.918 -78.186 1.00 89.14 ? 55 GLN A C 1 ATOM 376 O O . GLN A 1 55 ? -24.652 -32.235 -77.002 1.00 89.92 ? 55 GLN A O 1 ATOM 377 C CB . GLN A 1 55 ? -23.104 -29.841 -78.382 1.00 92.53 ? 55 GLN A CB 1 ATOM 378 C CG . GLN A 1 55 ? -22.943 -29.504 -76.890 1.00 95.11 ? 55 GLN A CG 1 ATOM 379 C CD . GLN A 1 55 ? -22.884 -28.011 -76.623 1.00 100.15 ? 55 GLN A CD 1 ATOM 380 N N . GLY A 1 56 ? -25.501 -32.056 -79.085 1.00 89.99 ? 56 GLY A N 1 ATOM 381 C CA . GLY A 1 56 ? -26.821 -32.583 -78.737 1.00 92.22 ? 56 GLY A CA 1 ATOM 382 C C . GLY A 1 56 ? -27.637 -31.591 -77.929 1.00 98.06 ? 56 GLY A C 1 ATOM 383 O O . GLY A 1 56 ? -27.428 -30.379 -78.022 1.00 101.03 ? 56 GLY A O 1 ATOM 384 N N . LYS A 1 57 ? -28.566 -32.104 -77.128 1.00 100.28 ? 57 LYS A N 1 ATOM 385 C CA . LYS A 1 57 ? -29.371 -31.256 -76.249 1.00 106.20 ? 57 LYS A CA 1 ATOM 386 C C . LYS A 1 57 ? -28.708 -31.083 -74.875 1.00 106.96 ? 57 LYS A C 1 ATOM 387 O O . LYS A 1 57 ? -29.389 -30.992 -73.848 1.00 110.96 ? 57 LYS A O 1 ATOM 388 C CB . LYS A 1 57 ? -30.799 -31.802 -76.121 1.00 109.33 ? 57 LYS A CB 1 ATOM 389 C CG . LYS A 1 57 ? -31.688 -31.518 -77.326 1.00 111.29 ? 57 LYS A CG 1 ATOM 390 N N . LEU A 1 58 ? -27.375 -31.028 -74.872 1.00 103.60 ? 58 LEU A N 1 ATOM 391 C CA . LEU A 1 58 ? -26.598 -30.824 -73.648 1.00 104.36 ? 58 LEU A CA 1 ATOM 392 C C . LEU A 1 58 ? -26.056 -29.400 -73.545 1.00 107.96 ? 58 LEU A C 1 ATOM 393 O O . LEU A 1 58 ? -25.553 -28.845 -74.528 1.00 107.12 ? 58 LEU A O 1 ATOM 394 C CB . LEU A 1 58 ? -25.430 -31.814 -73.564 1.00 98.72 ? 58 LEU A CB 1 ATOM 395 C CG . LEU A 1 58 ? -25.660 -33.325 -73.499 1.00 94.90 ? 58 LEU A CG 1 ATOM 396 C CD1 . LEU A 1 58 ? -24.407 -33.986 -72.947 1.00 91.01 ? 58 LEU A CD1 1 ATOM 397 C CD2 . LEU A 1 58 ? -26.875 -33.706 -72.660 1.00 98.25 ? 58 LEU A CD2 1 ATOM 398 N N . SER A 1 59 ? -26.156 -28.829 -72.345 1.00 112.44 ? 59 SER A N 1 ATOM 399 C CA . SER A 1 59 ? -25.614 -27.504 -72.055 1.00 116.75 ? 59 SER A CA 1 ATOM 400 C C . SER A 1 59 ? -24.102 -27.574 -71.856 1.00 114.00 ? 59 SER A C 1 ATOM 401 O O . SER A 1 59 ? -23.564 -28.634 -71.532 1.00 109.75 ? 59 SER A O 1 ATOM 402 C CB . SER A 1 59 ? -26.275 -26.929 -70.804 1.00 123.01 ? 59 SER A CB 1 ATOM 403 O OG . SER A 1 59 ? -25.966 -27.712 -69.665 1.00 121.77 ? 59 SER A OG 1 ATOM 404 N N . ASN A 1 60 ? -23.429 -26.439 -72.043 1.00 117.10 ? 60 ASN A N 1 ATOM 405 C CA . ASN A 1 60 ? -21.973 -26.335 -71.879 1.00 115.87 ? 60 ASN A CA 1 ATOM 406 C C . ASN A 1 60 ? -21.462 -26.978 -70.593 1.00 115.33 ? 60 ASN A C 1 ATOM 407 O O . ASN A 1 60 ? -20.437 -27.665 -70.602 1.00 111.29 ? 60 ASN A O 1 ATOM 408 C CB . ASN A 1 60 ? -21.526 -24.869 -71.931 1.00 121.46 ? 60 ASN A CB 1 ATOM 409 C CG . ASN A 1 60 ? -21.986 -24.155 -73.191 1.00 122.93 ? 60 ASN A CG 1 ATOM 410 O OD1 . ASN A 1 60 ? -22.441 -24.782 -74.150 1.00 119.35 ? 60 ASN A OD1 1 ATOM 411 N ND2 . ASN A 1 60 ? -21.868 -22.832 -73.191 1.00 128.72 ? 60 ASN A ND2 1 ATOM 412 N N . GLN A 1 61 ? -22.188 -26.742 -69.498 1.00 119.92 ? 61 GLN A N 1 ATOM 413 C CA . GLN A 1 61 ? -21.884 -27.327 -68.192 1.00 120.34 ? 61 GLN A CA 1 ATOM 414 C C . GLN A 1 61 ? -21.998 -28.854 -68.223 1.00 114.67 ? 61 GLN A C 1 ATOM 415 O O . GLN A 1 61 ? -21.122 -29.557 -67.713 1.00 112.19 ? 61 GLN A O 1 ATOM 416 C CB . GLN A 1 61 ? -22.807 -26.747 -67.116 1.00 126.70 ? 61 GLN A CB 1 ATOM 417 N N . GLN A 1 62 ? -23.070 -29.360 -68.829 1.00 113.18 ? 62 GLN A N 1 ATOM 418 C CA . GLN A 1 62 ? -23.273 -30.797 -68.956 1.00 108.31 ? 62 GLN A CA 1 ATOM 419 C C . GLN A 1 62 ? -22.195 -31.419 -69.830 1.00 102.66 ? 62 GLN A C 1 ATOM 420 O O . GLN A 1 62 ? -21.808 -32.573 -69.621 1.00 99.06 ? 62 GLN A O 1 ATOM 421 C CB . GLN A 1 62 ? -24.649 -31.103 -69.542 1.00 108.68 ? 62 GLN A CB 1 ATOM 422 C CG . GLN A 1 62 ? -25.795 -30.941 -68.567 1.00 114.08 ? 62 GLN A CG 1 ATOM 423 C CD . GLN A 1 62 ? -27.100 -31.491 -69.107 1.00 114.53 ? 62 GLN A CD 1 ATOM 424 O OE1 . GLN A 1 62 ? -28.085 -30.763 -69.240 1.00 119.31 ? 62 GLN A OE1 1 ATOM 425 N NE2 . GLN A 1 62 ? -27.115 -32.782 -69.424 1.00 110.08 ? 62 GLN A NE2 1 ATOM 426 N N . TRP A 1 63 ? -21.713 -30.650 -70.805 1.00 102.47 ? 63 TRP A N 1 ATOM 427 C CA . TRP A 1 63 ? -20.702 -31.141 -71.737 1.00 97.69 ? 63 TRP A CA 1 ATOM 428 C C . TRP A 1 63 ? -19.285 -31.094 -71.156 1.00 97.51 ? 63 TRP A C 1 ATOM 429 O O . TRP A 1 63 ? -18.551 -32.083 -71.236 1.00 93.47 ? 63 TRP A O 1 ATOM 430 C CB . TRP A 1 63 ? -20.771 -30.397 -73.076 1.00 97.75 ? 63 TRP A CB 1 ATOM 431 C CG . TRP A 1 63 ? -19.665 -30.781 -74.001 1.00 93.22 ? 63 TRP A CG 1 ATOM 432 C CD1 . TRP A 1 63 ? -18.605 -30.012 -74.371 0.70 94.14 ? 63 TRP A CD1 1 ATOM 433 C CD2 . TRP A 1 63 ? -19.491 -32.045 -74.647 0.70 87.89 ? 63 TRP A CD2 1 ATOM 434 N NE1 . TRP A 1 63 ? -17.784 -30.711 -75.219 0.70 89.88 ? 63 TRP A NE1 1 ATOM 435 C CE2 . TRP A 1 63 ? -18.305 -31.963 -75.406 0.70 85.96 ? 63 TRP A CE2 1 ATOM 436 C CE3 . TRP A 1 63 ? -20.226 -33.238 -74.664 0.70 85.31 ? 63 TRP A CE3 1 ATOM 437 C CZ2 . TRP A 1 63 ? -17.834 -33.028 -76.176 0.70 81.59 ? 63 TRP A CZ2 1 ATOM 438 C CZ3 . TRP A 1 63 ? -19.758 -34.299 -75.428 0.70 80.78 ? 63 TRP A CZ3 1 ATOM 439 C CH2 . TRP A 1 63 ? -18.571 -34.185 -76.174 0.70 79.11 ? 63 TRP A CH2 1 ATOM 440 N N . GLU A 1 64 ? -18.912 -29.953 -70.572 1.00 102.38 ? 64 GLU A N 1 ATOM 441 C CA . GLU A 1 64 ? -17.574 -29.769 -70.002 1.00 103.39 ? 64 GLU A CA 1 ATOM 442 C C . GLU A 1 64 ? -17.269 -30.800 -68.915 1.00 101.99 ? 64 GLU A C 1 ATOM 443 O O . GLU A 1 64 ? -16.141 -31.288 -68.817 1.00 100.04 ? 64 GLU A O 1 ATOM 444 C CB . GLU A 1 64 ? -17.399 -28.351 -69.457 1.00 109.76 ? 64 GLU A CB 1 ATOM 445 N N . LYS A 1 65 ? -18.286 -31.132 -68.119 1.00 103.50 ? 65 LYS A N 1 ATOM 446 C CA . LYS A 1 65 ? -18.180 -32.169 -67.089 1.00 102.48 ? 65 LYS A CA 1 ATOM 447 C C . LYS A 1 65 ? -17.933 -33.554 -67.691 1.00 96.66 ? 65 LYS A C 1 ATOM 448 O O . LYS A 1 65 ? -17.129 -34.325 -67.167 1.00 94.99 ? 65 LYS A O 1 ATOM 449 C CB . LYS A 1 65 ? -19.434 -32.189 -66.207 1.00 105.75 ? 65 LYS A CB 1 ATOM 450 N N . LEU A 1 66 ? -18.625 -33.861 -68.787 1.00 94.11 ? 66 LEU A N 1 ATOM 451 C CA . LEU A 1 66 ? -18.455 -35.142 -69.466 1.00 89.28 ? 66 LEU A CA 1 ATOM 452 C C . LEU A 1 66 ? -17.114 -35.256 -70.177 1.00 86.52 ? 66 LEU A C 1 ATOM 453 O O . LEU A 1 66 ? -16.484 -36.317 -70.159 1.00 83.45 ? 66 LEU A O 1 ATOM 454 C CB . LEU A 1 66 ? -19.590 -35.403 -70.459 1.00 88.04 ? 66 LEU A CB 1 ATOM 455 C CG . LEU A 1 66 ? -20.607 -36.488 -70.094 1.00 87.85 ? 66 LEU A CG 1 ATOM 456 C CD1 . LEU A 1 66 ? -21.607 -36.660 -71.227 1.00 87.23 ? 66 LEU A CD1 1 ATOM 457 C CD2 . LEU A 1 66 ? -19.928 -37.824 -69.781 1.00 84.75 ? 66 LEU A CD2 1 ATOM 458 N N . GLN A 1 67 ? -16.690 -34.163 -70.806 1.00 88.09 ? 67 GLN A N 1 ATOM 459 C CA . GLN A 1 67 ? -15.402 -34.115 -71.490 1.00 86.45 ? 67 GLN A CA 1 ATOM 460 C C . GLN A 1 67 ? -14.285 -34.343 -70.481 1.00 87.37 ? 67 GLN A C 1 ATOM 461 O O . GLN A 1 67 ? -13.350 -35.102 -70.743 1.00 84.72 ? 67 GLN A O 1 ATOM 462 C CB . GLN A 1 67 ? -15.217 -32.773 -72.198 1.00 89.25 ? 67 GLN A CB 1 ATOM 463 C CG . GLN A 1 67 ? -14.292 -32.841 -73.403 1.00 87.09 ? 67 GLN A CG 1 ATOM 464 C CD . GLN A 1 67 ? -14.105 -31.498 -74.080 1.00 90.13 ? 67 GLN A CD 1 ATOM 465 O OE1 . GLN A 1 67 ? -13.706 -30.524 -73.445 1.00 94.47 ? 67 GLN A OE1 1 ATOM 466 N NE2 . GLN A 1 67 ? -14.382 -31.444 -75.380 1.00 88.33 ? 67 GLN A NE2 1 ATOM 467 N N . HIS A 1 68 ? -14.409 -33.693 -69.324 1.00 91.52 ? 68 HIS A N 1 ATOM 468 C CA . HIS A 1 68 ? -13.483 -33.878 -68.206 1.00 93.24 ? 68 HIS A CA 1 ATOM 469 C C . HIS A 1 68 ? -13.464 -35.330 -67.724 1.00 90.01 ? 68 HIS A C 1 ATOM 470 O O . HIS A 1 68 ? -12.409 -35.846 -67.346 1.00 89.54 ? 68 HIS A O 1 ATOM 471 C CB . HIS A 1 68 ? -13.842 -32.940 -67.049 1.00 98.64 ? 68 HIS A CB 1 ATOM 472 C CG . HIS A 1 68 ? -12.891 -33.012 -65.896 0.70 101.18 ? 68 HIS A CG 1 ATOM 473 N ND1 . HIS A 1 68 ? -13.060 -33.889 -64.846 0.70 100.93 ? 68 HIS A ND1 1 ATOM 474 C CD2 . HIS A 1 68 ? -11.760 -32.318 -65.629 0.70 104.56 ? 68 HIS A CD2 1 ATOM 475 C CE1 . HIS A 1 68 ? -12.074 -33.731 -63.982 0.70 103.92 ? 68 HIS A CE1 1 ATOM 476 N NE2 . HIS A 1 68 ? -11.272 -32.784 -64.433 0.70 106.23 ? 68 HIS A NE2 1 ATOM 477 N N . MET A 1 69 ? -14.631 -35.975 -67.743 1.00 88.32 ? 69 MET A N 1 ATOM 478 C CA . MET A 1 69 ? -14.775 -37.367 -67.318 1.00 85.79 ? 69 MET A CA 1 ATOM 479 C C . MET A 1 69 ? -13.916 -38.276 -68.194 1.00 81.59 ? 69 MET A C 1 ATOM 480 O O . MET A 1 69 ? -13.213 -39.158 -67.692 1.00 80.55 ? 69 MET A O 1 ATOM 481 C CB . MET A 1 69 ? -16.250 -37.792 -67.361 1.00 85.48 ? 69 MET A CB 1 ATOM 482 C CG . MET A 1 69 ? -16.600 -39.027 -66.524 1.00 85.32 ? 69 MET A CG 1 ATOM 483 S SD . MET A 1 69 ? -16.186 -40.620 -67.287 1.00 80.86 ? 69 MET A SD 1 ATOM 484 N N . PHE A 1 70 ? -13.971 -38.039 -69.502 1.00 79.53 ? 70 PHE A N 1 ATOM 485 C CA . PHE A 1 70 ? -13.184 -38.798 -70.461 1.00 76.11 ? 70 PHE A CA 1 ATOM 486 C C . PHE A 1 70 ? -11.727 -38.344 -70.472 1.00 77.15 ? 70 PHE A C 1 ATOM 487 O O . PHE A 1 70 ? -10.825 -39.164 -70.662 1.00 75.52 ? 70 PHE A O 1 ATOM 488 C CB . PHE A 1 70 ? -13.789 -38.696 -71.864 1.00 74.19 ? 70 PHE A CB 1 ATOM 489 C CG . PHE A 1 70 ? -15.126 -39.386 -72.008 1.00 73.46 ? 70 PHE A CG 1 ATOM 490 C CD1 . PHE A 1 70 ? -15.206 -40.774 -72.117 1.00 71.08 ? 70 PHE A CD1 1 ATOM 491 C CD2 . PHE A 1 70 ? -16.305 -38.646 -72.055 1.00 75.47 ? 70 PHE A CD2 1 ATOM 492 C CE1 . PHE A 1 70 ? -16.443 -41.413 -72.257 1.00 70.64 ? 70 PHE A CE1 1 ATOM 493 C CE2 . PHE A 1 70 ? -17.544 -39.278 -72.194 1.00 75.05 ? 70 PHE A CE2 1 ATOM 494 C CZ . PHE A 1 70 ? -17.612 -40.663 -72.297 1.00 72.29 ? 70 PHE A CZ 1 ATOM 495 N N . GLN A 1 71 ? -11.498 -37.047 -70.265 1.00 80.35 ? 71 GLN A N 1 ATOM 496 C CA . GLN A 1 71 ? -10.142 -36.504 -70.228 1.00 82.40 ? 71 GLN A CA 1 ATOM 497 C C . GLN A 1 71 ? -9.282 -37.208 -69.182 1.00 83.01 ? 71 GLN A C 1 ATOM 498 O O . GLN A 1 71 ? -8.125 -37.543 -69.448 1.00 82.84 ? 71 GLN A O 1 ATOM 499 C CB . GLN A 1 71 ? -10.160 -34.999 -69.974 1.00 86.99 ? 71 GLN A CB 1 ATOM 500 C CG . GLN A 1 71 ? -10.243 -34.156 -71.235 1.00 87.40 ? 71 GLN A CG 1 ATOM 501 C CD . GLN A 1 71 ? -10.555 -32.692 -70.951 1.00 92.61 ? 71 GLN A CD 1 ATOM 502 O OE1 . GLN A 1 71 ? -10.231 -32.162 -69.884 1.00 96.71 ? 71 GLN A OE1 1 ATOM 503 N NE2 . GLN A 1 71 ? -11.188 -32.031 -71.913 1.00 92.84 ? 71 GLN A NE2 1 ATOM 504 N N . VAL A 1 72 ? -9.859 -37.438 -68.003 1.00 84.09 ? 72 VAL A N 1 ATOM 505 C CA . VAL A 1 72 ? -9.187 -38.178 -66.933 1.00 84.78 ? 72 VAL A CA 1 ATOM 506 C C . VAL A 1 72 ? -9.026 -39.646 -67.308 1.00 80.67 ? 72 VAL A C 1 ATOM 507 O O . VAL A 1 72 ? -7.991 -40.250 -67.028 1.00 80.84 ? 72 VAL A O 1 ATOM 508 C CB . VAL A 1 72 ? -9.942 -38.072 -65.588 1.00 87.36 ? 72 VAL A CB 1 ATOM 509 N N . TYR A 1 73 ? -10.047 -40.204 -67.955 1.00 77.48 ? 73 TYR A N 1 ATOM 510 C CA . TYR A 1 73 ? -10.031 -41.601 -68.374 1.00 74.16 ? 73 TYR A CA 1 ATOM 511 C C . TYR A 1 73 ? -8.873 -41.918 -69.321 1.00 72.73 ? 73 TYR A C 1 ATOM 512 O O . TYR A 1 73 ? -8.193 -42.935 -69.151 1.00 71.94 ? 73 TYR A O 1 ATOM 513 C CB . TYR A 1 73 ? -11.365 -42.006 -69.020 1.00 71.83 ? 73 TYR A CB 1 ATOM 514 C CG . TYR A 1 73 ? -11.291 -43.303 -69.804 1.00 68.62 ? 73 TYR A CG 1 ATOM 515 C CD1 . TYR A 1 73 ? -11.241 -44.534 -69.149 1.00 68.42 ? 73 TYR A CD1 1 ATOM 516 C CD2 . TYR A 1 73 ? -11.255 -43.299 -71.196 1.00 66.58 ? 73 TYR A CD2 1 ATOM 517 C CE1 . TYR A 1 73 ? -11.161 -45.731 -69.858 1.00 66.18 ? 73 TYR A CE1 1 ATOM 518 C CE2 . TYR A 1 73 ? -11.177 -44.494 -71.918 1.00 64.56 ? 73 TYR A CE2 1 ATOM 519 C CZ . TYR A 1 73 ? -11.133 -45.707 -71.240 1.00 64.29 ? 73 TYR A CZ 1 ATOM 520 O OH . TYR A 1 73 ? -11.057 -46.893 -71.937 0.70 62.25 ? 73 TYR A OH 1 ATOM 521 N N . ARG A 1 74 ? -8.658 -41.054 -70.314 1.00 72.68 ? 74 ARG A N 1 ATOM 522 C CA . ARG A 1 74 ? -7.643 -41.306 -71.335 1.00 71.59 ? 74 ARG A CA 1 ATOM 523 C C . ARG A 1 74 ? -6.288 -41.624 -70.711 1.00 73.42 ? 74 ARG A C 1 ATOM 524 O O . ARG A 1 74 ? -5.690 -42.661 -71.015 1.00 72.16 ? 74 ARG A O 1 ATOM 525 C CB . ARG A 1 74 ? -7.529 -40.140 -72.323 1.00 72.54 ? 74 ARG A CB 1 ATOM 526 C CG . ARG A 1 74 ? -6.589 -40.432 -73.490 1.00 71.91 ? 74 ARG A CG 1 ATOM 527 C CD . ARG A 1 74 ? -6.810 -39.506 -74.670 1.00 72.64 ? 74 ARG A CD 1 ATOM 528 N NE . ARG A 1 74 ? -6.313 -38.158 -74.412 1.00 77.24 ? 74 ARG A NE 1 ATOM 529 C CZ . ARG A 1 74 ? -6.284 -37.179 -75.312 1.00 79.10 ? 74 ARG A CZ 1 ATOM 530 N NH1 . ARG A 1 74 ? -6.721 -37.389 -76.548 1.00 77.21 ? 74 ARG A NH1 1 ATOM 531 N NH2 . ARG A 1 74 ? -5.814 -35.986 -74.975 1.00 83.42 ? 74 ARG A NH2 1 ATOM 532 N N . VAL A 1 75 ? -5.824 -40.744 -69.826 1.00 76.78 ? 75 VAL A N 1 ATOM 533 C CA . VAL A 1 75 ? -4.551 -40.944 -69.142 1.00 79.28 ? 75 VAL A CA 1 ATOM 534 C C . VAL A 1 75 ? -4.614 -42.188 -68.269 1.00 78.26 ? 75 VAL A C 1 ATOM 535 O O . VAL A 1 75 ? -3.788 -43.093 -68.404 1.00 77.87 ? 75 VAL A O 1 ATOM 536 C CB . VAL A 1 75 ? -4.161 -39.735 -68.283 1.00 83.83 ? 75 VAL A CB 1 ATOM 537 C CG1 . VAL A 1 75 ? -2.770 -39.935 -67.707 1.00 87.12 ? 75 VAL A CG1 1 ATOM 538 C CG2 . VAL A 1 75 ? -4.214 -38.456 -69.108 1.00 85.51 ? 75 VAL A CG2 1 ATOM 539 N N . SER A 1 76 ? -5.616 -42.231 -67.396 1.00 78.25 ? 76 SER A N 1 ATOM 540 C CA . SER A 1 76 ? -5.806 -43.342 -66.462 1.00 77.90 ? 76 SER A CA 1 ATOM 541 C C . SER A 1 76 ? -5.792 -44.706 -67.144 1.00 74.63 ? 76 SER A C 1 ATOM 542 O O . SER A 1 76 ? -5.214 -45.654 -66.617 1.00 75.12 ? 76 SER A O 1 ATOM 543 C CB . SER A 1 76 ? -7.103 -43.157 -65.677 1.00 78.22 ? 76 SER A CB 1 ATOM 544 O OG . SER A 1 76 ? -7.126 -41.886 -65.046 1.00 81.80 ? 76 SER A OG 1 ATOM 545 N N . PHE A 1 77 ? -6.416 -44.787 -68.318 1.00 71.73 ? 77 PHE A N 1 ATOM 546 C CA . PHE A 1 77 ? -6.491 -46.031 -69.083 1.00 69.06 ? 77 PHE A CA 1 ATOM 547 C C . PHE A 1 77 ? -5.116 -46.471 -69.574 1.00 69.51 ? 77 PHE A C 1 ATOM 548 O O . PHE A 1 77 ? -4.706 -47.613 -69.357 1.00 69.52 ? 77 PHE A O 1 ATOM 549 C CB . PHE A 1 77 ? -7.454 -45.886 -70.263 1.00 66.50 ? 77 PHE A CB 1 ATOM 550 C CG . PHE A 1 77 ? -7.441 -47.058 -71.201 1.00 64.58 ? 77 PHE A CG 1 ATOM 551 C CD1 . PHE A 1 77 ? -6.731 -46.999 -72.396 1.00 64.14 ? 77 PHE A CD1 1 ATOM 552 C CD2 . PHE A 1 77 ? -8.129 -48.225 -70.886 1.00 63.98 ? 77 PHE A CD2 1 ATOM 553 C CE1 . PHE A 1 77 ? -6.711 -48.085 -73.266 1.00 62.83 ? 77 PHE A CE1 1 ATOM 554 C CE2 . PHE A 1 77 ? -8.117 -49.316 -71.751 1.00 62.66 ? 77 PHE A CE2 1 ATOM 555 C CZ . PHE A 1 77 ? -7.407 -49.247 -72.941 1.00 62.00 ? 77 PHE A CZ 1 ATOM 556 N N . THR A 1 78 ? -4.422 -45.557 -70.245 1.00 70.29 ? 78 THR A N 1 ATOM 557 C CA . THR A 1 78 ? -3.061 -45.787 -70.715 1.00 71.61 ? 78 THR A CA 1 ATOM 558 C C . THR A 1 78 ? -2.203 -46.338 -69.574 1.00 74.07 ? 78 THR A C 1 ATOM 559 O O . THR A 1 78 ? -1.607 -47.409 -69.694 1.00 73.96 ? 78 THR A O 1 ATOM 560 C CB . THR A 1 78 ? -2.435 -44.471 -71.260 1.00 73.79 ? 78 THR A CB 1 ATOM 561 O OG1 . THR A 1 78 ? -3.387 -43.780 -72.082 1.00 71.95 ? 78 THR A OG1 1 ATOM 562 C CG2 . THR A 1 78 ? -1.175 -44.748 -72.071 1.00 75.22 ? 78 THR A CG2 1 ATOM 563 N N . ARG A 1 79 ? -2.188 -45.609 -68.457 1.00 76.48 ? 79 ARG A N 1 ATOM 564 C CA . ARG A 1 79 ? -1.337 -45.925 -67.311 1.00 79.56 ? 79 ARG A CA 1 ATOM 565 C C . ARG A 1 79 ? -1.722 -47.223 -66.604 1.00 78.48 ? 79 ARG A C 1 ATOM 566 O O . ARG A 1 79 ? -0.883 -47.844 -65.957 1.00 80.77 ? 79 ARG A O 1 ATOM 567 C CB . ARG A 1 79 ? -1.318 -44.767 -66.311 1.00 82.78 ? 79 ARG A CB 1 ATOM 568 C CG . ARG A 1 79 ? 0.007 -44.630 -65.582 1.00 87.40 ? 79 ARG A CG 1 ATOM 569 C CD . ARG A 1 79 ? -0.163 -43.987 -64.219 1.00 90.97 ? 79 ARG A CD 1 ATOM 570 N NE . ARG A 1 79 ? -0.627 -44.939 -63.209 1.00 90.62 ? 79 ARG A NE 1 ATOM 571 C CZ . ARG A 1 79 ? -0.678 -44.688 -61.902 1.00 93.64 ? 79 ARG A CZ 1 ATOM 572 N NH1 . ARG A 1 79 ? -0.296 -43.507 -61.433 1.00 97.66 ? 79 ARG A NH1 1 ATOM 573 N NH2 . ARG A 1 79 ? -1.115 -45.618 -61.063 1.00 93.13 ? 79 ARG A NH2 1 ATOM 574 N N . ASP A 1 80 ? -2.985 -47.622 -66.726 1.00 75.46 ? 80 ASP A N 1 ATOM 575 C CA . ASP A 1 80 ? -3.452 -48.882 -66.154 1.00 74.82 ? 80 ASP A CA 1 ATOM 576 C C . ASP A 1 80 ? -2.962 -50.077 -66.961 1.00 73.68 ? 80 ASP A C 1 ATOM 577 O O . ASP A 1 80 ? -2.411 -51.026 -66.401 1.00 75.26 ? 80 ASP A O 1 ATOM 578 C CB . ASP A 1 80 ? -4.983 -48.909 -66.043 1.00 72.88 ? 80 ASP A CB 1 ATOM 579 C CG . ASP A 1 80 ? -5.495 -48.242 -64.774 0.70 75.14 ? 80 ASP A CG 1 ATOM 580 O OD1 . ASP A 1 80 ? -4.808 -47.339 -64.251 0.70 78.12 ? 80 ASP A OD1 1 ATOM 581 O OD2 . ASP A 1 80 ? -6.589 -48.619 -64.301 0.70 74.45 ? 80 ASP A OD2 1 ATOM 582 N N . ILE A 1 81 ? -3.160 -50.018 -68.277 1.00 71.29 ? 81 ILE A N 1 ATOM 583 C CA . ILE A 1 81 ? -2.786 -51.113 -69.156 1.00 70.50 ? 81 ILE A CA 1 ATOM 584 C C . ILE A 1 81 ? -1.309 -51.451 -68.974 1.00 73.61 ? 81 ILE A C 1 ATOM 585 O O . ILE A 1 81 ? -0.969 -52.601 -68.695 1.00 74.91 ? 81 ILE A O 1 ATOM 586 C CB . ILE A 1 81 ? -3.111 -50.812 -70.643 1.00 68.09 ? 81 ILE A CB 1 ATOM 587 C CG1 . ILE A 1 81 ? -4.624 -50.607 -70.856 1.00 65.42 ? 81 ILE A CG1 1 ATOM 588 C CG2 . ILE A 1 81 ? -2.551 -51.910 -71.560 1.00 68.17 ? 81 ILE A CG2 1 ATOM 589 C CD1 . ILE A 1 81 ? -5.492 -51.879 -70.789 1.00 63.92 ? 81 ILE A CD1 1 ATOM 590 N N . GLN A 1 82 ? -0.443 -50.445 -69.092 1.00 75.46 ? 82 GLN A N 1 ATOM 591 C CA . GLN A 1 82 ? 1.004 -50.659 -68.987 1.00 78.97 ? 82 GLN A CA 1 ATOM 592 C C . GLN A 1 82 ? 1.449 -51.242 -67.636 1.00 81.79 ? 82 GLN A C 1 ATOM 593 O O . GLN A 1 82 ? 2.557 -51.767 -67.521 1.00 84.86 ? 82 GLN A O 1 ATOM 594 C CB . GLN A 1 82 ? 1.784 -49.385 -69.341 1.00 81.07 ? 82 GLN A CB 1 ATOM 595 C CG . GLN A 1 82 ? 1.344 -48.133 -68.599 1.00 82.13 ? 82 GLN A CG 1 ATOM 596 C CD . GLN A 1 82 ? 1.575 -46.857 -69.398 1.00 83.33 ? 82 GLN A CD 1 ATOM 597 O OE1 . GLN A 1 82 ? 1.515 -46.862 -70.630 1.00 81.58 ? 82 GLN A OE1 1 ATOM 598 N NE2 . GLN A 1 82 ? 1.833 -45.753 -68.696 1.00 86.29 ? 82 GLN A NE2 1 ATOM 599 N N . GLU A 1 83 ? 0.580 -51.158 -66.629 1.00 81.16 ? 83 GLU A N 1 ATOM 600 C CA . GLU A 1 83 ? 0.813 -51.832 -65.351 1.00 83.67 ? 83 GLU A CA 1 ATOM 601 C C . GLU A 1 83 ? 0.337 -53.282 -65.411 1.00 82.40 ? 83 GLU A C 1 ATOM 602 O O . GLU A 1 83 ? 0.990 -54.177 -64.878 1.00 84.87 ? 83 GLU A O 1 ATOM 603 C CB . GLU A 1 83 ? 0.124 -51.099 -64.191 1.00 84.47 ? 83 GLU A CB 1 ATOM 604 C CG . GLU A 1 83 ? 0.650 -49.692 -63.896 1.00 86.96 ? 83 GLU A CG 1 ATOM 605 C CD . GLU A 1 83 ? 2.102 -49.670 -63.459 1.00 91.66 ? 83 GLU A CD 1 ATOM 606 O OE1 . GLU A 1 83 ? 2.413 -50.211 -62.375 1.00 94.11 ? 83 GLU A OE1 1 ATOM 607 O OE2 . GLU A 1 83 ? 2.929 -49.096 -64.200 1.00 93.20 ? 83 GLU A OE2 1 ATOM 608 N N . LEU A 1 84 ? -0.805 -53.502 -66.061 1.00 78.98 ? 84 LEU A N 1 ATOM 609 C CA . LEU A 1 84 ? -1.342 -54.848 -66.266 1.00 78.24 ? 84 LEU A CA 1 ATOM 610 C C . LEU A 1 84 ? -0.365 -55.720 -67.054 1.00 79.66 ? 84 LEU A C 1 ATOM 611 O O . LEU A 1 84 ? -0.249 -56.920 -66.794 1.00 81.24 ? 84 LEU A O 1 ATOM 612 C CB . LEU A 1 84 ? -2.692 -54.783 -66.979 1.00 74.62 ? 84 LEU A CB 1 ATOM 613 C CG . LEU A 1 84 ? -3.873 -54.307 -66.133 1.00 73.76 ? 84 LEU A CG 1 ATOM 614 C CD1 . LEU A 1 84 ? -4.723 -53.328 -66.911 1.00 71.17 ? 84 LEU A CD1 1 ATOM 615 C CD2 . LEU A 1 84 ? -4.711 -55.470 -65.629 1.00 73.80 ? 84 LEU A CD2 1 ATOM 616 N N . VAL A 1 85 ? 0.332 -55.098 -68.006 1.00 79.61 ? 85 VAL A N 1 ATOM 617 C CA . VAL A 1 85 ? 1.418 -55.734 -68.754 1.00 81.74 ? 85 VAL A CA 1 ATOM 618 C C . VAL A 1 85 ? 2.576 -56.107 -67.829 1.00 86.29 ? 85 VAL A C 1 ATOM 619 O O . VAL A 1 85 ? 3.118 -57.208 -67.924 1.00 88.57 ? 85 VAL A O 1 ATOM 620 C CB . VAL A 1 85 ? 1.956 -54.809 -69.862 1.00 81.23 ? 85 VAL A CB 1 ATOM 621 C CG1 . VAL A 1 85 ? 3.034 -55.513 -70.676 1.00 83.60 ? 85 VAL A CG1 1 ATOM 622 C CG2 . VAL A 1 85 ? 0.828 -54.341 -70.762 1.00 77.39 ? 85 VAL A CG2 1 ATOM 623 N N . LYS A 1 86 ? 2.948 -55.184 -66.941 1.00 88.18 ? 86 LYS A N 1 ATOM 624 C CA . LYS A 1 86 ? 4.015 -55.417 -65.971 1.00 92.96 ? 86 LYS A CA 1 ATOM 625 C C . LYS A 1 86 ? 3.701 -56.591 -65.050 1.00 94.39 ? 86 LYS A C 1 ATOM 626 O O . LYS A 1 86 ? 4.611 -57.291 -64.609 1.00 98.20 ? 86 LYS A O 1 ATOM 627 C CB . LYS A 1 86 ? 4.279 -54.165 -65.135 1.00 94.66 ? 86 LYS A CB 1 ATOM 628 C CG . LYS A 1 86 ? 5.092 -53.089 -65.834 1.00 96.08 ? 86 LYS A CG 1 ATOM 629 C CD . LYS A 1 86 ? 5.288 -51.884 -64.925 1.00 98.25 ? 86 LYS A CD 1 ATOM 630 C CE . LYS A 1 86 ? 6.172 -50.833 -65.571 1.00 100.53 ? 86 LYS A CE 1 ATOM 631 N NZ . LYS A 1 86 ? 6.564 -49.785 -64.591 1.00 104.37 ? 86 LYS A NZ 1 ATOM 632 N N . MET A 1 87 ? 2.416 -56.796 -64.762 1.00 91.97 ? 87 MET A N 1 ATOM 633 C CA . MET A 1 87 ? 1.978 -57.933 -63.954 1.00 93.68 ? 87 MET A CA 1 ATOM 634 C C . MET A 1 87 ? 2.298 -59.243 -64.660 1.00 95.03 ? 87 MET A C 1 ATOM 635 O O . MET A 1 87 ? 2.866 -60.161 -64.063 1.00 98.62 ? 87 MET A O 1 ATOM 636 C CB . MET A 1 87 ? 0.473 -57.878 -63.687 1.00 90.72 ? 87 MET A CB 1 ATOM 637 C CG . MET A 1 87 ? -0.007 -56.663 -62.928 1.00 90.33 ? 87 MET A CG 1 ATOM 638 S SD . MET A 1 87 ? -1.472 -57.014 -61.935 1.00 90.17 ? 87 MET A SD 1 ATOM 639 C CE . MET A 1 87 ? -2.657 -57.508 -63.183 1.00 86.51 ? 87 MET A CE 1 ATOM 640 N N . MET A 1 88 ? 1.937 -59.303 -65.941 1.00 92.63 ? 88 MET A N 1 ATOM 641 C CA . MET A 1 88 ? 2.007 -60.523 -66.738 1.00 93.69 ? 88 MET A CA 1 ATOM 642 C C . MET A 1 88 ? 3.426 -60.823 -67.203 1.00 97.06 ? 88 MET A C 1 ATOM 643 O O . MET A 1 88 ? 4.104 -59.961 -67.760 1.00 97.06 ? 88 MET A O 1 ATOM 644 C CB . MET A 1 88 ? 1.054 -60.422 -67.937 1.00 90.10 ? 88 MET A CB 1 ATOM 645 C CG . MET A 1 88 ? -0.402 -60.115 -67.558 1.00 87.87 ? 88 MET A CG 1 ATOM 646 S SD . MET A 1 88 ? -1.174 -61.414 -66.561 1.00 91.71 ? 88 MET A SD 1 ATOM 647 C CE . MET A 1 88 ? -1.869 -60.457 -65.217 1.00 90.64 ? 88 MET A CE 1 ATOM 648 N N . PRO A 1 90 ? 6.195 -62.172 -67.451 1.00 109.93 ? 90 PRO A N 1 ATOM 649 C CA . PRO A 1 90 ? 6.596 -62.441 -68.828 1.00 110.34 ? 90 PRO A CA 1 ATOM 650 C C . PRO A 1 90 ? 5.428 -62.830 -69.742 1.00 106.63 ? 90 PRO A C 1 ATOM 651 O O . PRO A 1 90 ? 5.548 -62.715 -70.969 1.00 105.82 ? 90 PRO A O 1 ATOM 652 C CB . PRO A 1 90 ? 7.559 -63.620 -68.677 1.00 115.84 ? 90 PRO A CB 1 ATOM 653 C CG . PRO A 1 90 ? 8.188 -63.411 -67.337 1.00 118.98 ? 90 PRO A CG 1 ATOM 654 C CD . PRO A 1 90 ? 7.195 -62.651 -66.481 1.00 115.19 ? 90 PRO A CD 1 ATOM 655 N N . LYS A 1 91 ? 4.319 -63.271 -69.139 1.00 104.79 ? 91 LYS A N 1 ATOM 656 C CA . LYS A 1 91 ? 3.161 -63.837 -69.855 1.00 102.17 ? 91 LYS A CA 1 ATOM 657 C C . LYS A 1 91 ? 2.827 -63.157 -71.187 1.00 98.76 ? 91 LYS A C 1 ATOM 658 O O . LYS A 1 91 ? 3.021 -63.757 -72.247 1.00 99.89 ? 91 LYS A O 1 ATOM 659 C CB . LYS A 1 91 ? 1.928 -63.890 -68.942 1.00 100.19 ? 91 LYS A CB 1 ATOM 660 N N . GLU A 1 92 ? 2.337 -61.918 -71.128 1.00 94.98 ? 92 GLU A N 1 ATOM 661 C CA . GLU A 1 92 ? 2.054 -61.127 -72.334 1.00 91.94 ? 92 GLU A CA 1 ATOM 662 C C . GLU A 1 92 ? 3.208 -60.167 -72.649 1.00 93.04 ? 92 GLU A C 1 ATOM 663 O O . GLU A 1 92 ? 3.911 -59.716 -71.738 1.00 94.96 ? 92 GLU A O 1 ATOM 664 C CB . GLU A 1 92 ? 0.738 -60.356 -72.185 1.00 87.60 ? 92 GLU A CB 1 ATOM 665 N N . ASP A 1 93 ? 3.396 -59.865 -73.934 1.00 92.27 ? 93 ASP A N 1 ATOM 666 C CA . ASP A 1 93 ? 4.509 -59.027 -74.398 1.00 93.95 ? 93 ASP A CA 1 ATOM 667 C C . ASP A 1 93 ? 4.069 -57.930 -75.377 1.00 90.85 ? 93 ASP A C 1 ATOM 668 O O . ASP A 1 93 ? 2.994 -58.011 -75.978 1.00 87.73 ? 93 ASP A O 1 ATOM 669 C CB . ASP A 1 93 ? 5.596 -59.898 -75.040 1.00 98.33 ? 93 ASP A CB 1 ATOM 670 N N . TYR A 1 94 ? 4.911 -56.908 -75.528 1.00 92.14 ? 94 TYR A N 1 ATOM 671 C CA . TYR A 1 94 ? 4.670 -55.808 -76.466 1.00 89.99 ? 94 TYR A CA 1 ATOM 672 C C . TYR A 1 94 ? 4.963 -56.220 -77.915 1.00 91.12 ? 94 TYR A C 1 ATOM 673 O O . TYR A 1 94 ? 5.745 -57.148 -78.138 1.00 94.72 ? 94 TYR A O 1 ATOM 674 C CB . TYR A 1 94 ? 5.527 -54.598 -76.079 1.00 92.11 ? 94 TYR A CB 1 ATOM 675 C CG . TYR A 1 94 ? 5.038 -53.864 -74.852 1.00 90.17 ? 94 TYR A CG 1 ATOM 676 C CD1 . TYR A 1 94 ? 5.721 -53.960 -73.643 1.00 92.74 ? 94 TYR A CD1 1 ATOM 677 C CD2 . TYR A 1 94 ? 3.891 -53.072 -74.901 1.00 85.89 ? 94 TYR A CD2 1 ATOM 678 C CE1 . TYR A 1 94 ? 5.275 -53.287 -72.515 1.00 91.58 ? 94 TYR A CE1 1 ATOM 679 C CE2 . TYR A 1 94 ? 3.436 -52.399 -73.778 1.00 84.62 ? 94 TYR A CE2 1 ATOM 680 C CZ . TYR A 1 94 ? 4.133 -52.510 -72.591 1.00 87.58 ? 94 TYR A CZ 1 ATOM 681 O OH . TYR A 1 94 ? 3.686 -51.843 -71.480 1.00 87.41 ? 94 TYR A OH 1 ATOM 682 N N . PRO A 1 95 ? 4.354 -55.530 -78.907 1.00 88.51 ? 95 PRO A N 1 ATOM 683 C CA . PRO A 1 95 ? 3.422 -54.403 -78.813 1.00 84.82 ? 95 PRO A CA 1 ATOM 684 C C . PRO A 1 95 ? 1.956 -54.842 -78.765 1.00 80.90 ? 95 PRO A C 1 ATOM 685 O O . PRO A 1 95 ? 1.606 -55.885 -79.314 1.00 81.05 ? 95 PRO A O 1 ATOM 686 C CB . PRO A 1 95 ? 3.703 -53.603 -80.095 1.00 85.45 ? 95 PRO A CB 1 ATOM 687 C CG . PRO A 1 95 ? 4.606 -54.470 -80.951 1.00 89.00 ? 95 PRO A CG 1 ATOM 688 C CD . PRO A 1 95 ? 4.679 -55.821 -80.312 1.00 90.06 ? 95 PRO A CD 1 ATOM 689 N N . ILE A 1 96 ? 1.110 -54.038 -78.124 1.00 78.07 ? 96 ILE A N 1 ATOM 690 C CA . ILE A 1 96 ? -0.273 -54.433 -77.828 1.00 74.88 ? 96 ILE A CA 1 ATOM 691 C C . ILE A 1 96 ? -1.299 -53.467 -78.431 1.00 72.03 ? 96 ILE A C 1 ATOM 692 O O . ILE A 1 96 ? -1.055 -52.258 -78.499 1.00 72.12 ? 96 ILE A O 1 ATOM 693 C CB . ILE A 1 96 ? -0.482 -54.563 -76.303 1.00 74.75 ? 96 ILE A CB 1 ATOM 694 C CG1 . ILE A 1 96 ? 0.455 -55.637 -75.740 1.00 77.78 ? 96 ILE A CG1 1 ATOM 695 C CG2 . ILE A 1 96 ? -1.926 -54.903 -75.975 1.00 72.03 ? 96 ILE A CG2 1 ATOM 696 C CD1 . ILE A 1 96 ? 0.979 -55.345 -74.356 1.00 79.26 ? 96 ILE A CD1 1 ATOM 697 N N . GLU A 1 97 ? -2.439 -54.008 -78.864 1.00 69.92 ? 97 GLU A N 1 ATOM 698 C CA . GLU A 1 97 ? -3.483 -53.211 -79.511 1.00 67.38 ? 97 GLU A CA 1 ATOM 699 C C . GLU A 1 97 ? -4.837 -53.304 -78.810 1.00 65.03 ? 97 GLU A C 1 ATOM 700 O O . GLU A 1 97 ? -5.543 -54.310 -78.928 1.00 64.78 ? 97 GLU A O 1 ATOM 701 C CB . GLU A 1 97 ? -3.628 -53.608 -80.983 1.00 67.77 ? 97 GLU A CB 1 ATOM 702 C CG . GLU A 1 97 ? -2.383 -53.362 -81.837 1.00 71.17 ? 97 GLU A CG 1 ATOM 703 C CD . GLU A 1 97 ? -2.015 -51.888 -81.951 1.00 72.63 ? 97 GLU A CD 1 ATOM 704 O OE1 . GLU A 1 97 ? -2.928 -51.024 -81.879 1.00 71.04 ? 97 GLU A OE1 1 ATOM 705 O OE2 . GLU A 1 97 ? -0.808 -51.600 -82.122 1.00 75.45 ? 97 GLU A OE2 1 ATOM 706 N N . ILE A 1 98 ? -5.192 -52.240 -78.091 1.00 63.69 ? 98 ILE A N 1 ATOM 707 C CA . ILE A 1 98 ? -6.472 -52.165 -77.384 1.00 61.98 ? 98 ILE A CA 1 ATOM 708 C C . ILE A 1 98 ? -7.566 -51.510 -78.234 1.00 60.06 ? 98 ILE A C 1 ATOM 709 O O . ILE A 1 98 ? -7.365 -50.449 -78.823 1.00 59.60 ? 98 ILE A O 1 ATOM 710 C CB . ILE A 1 98 ? -6.339 -51.426 -76.034 1.00 62.33 ? 98 ILE A CB 1 ATOM 711 N N . GLN A 1 99 ? -8.721 -52.165 -78.293 1.00 59.25 ? 99 GLN A N 1 ATOM 712 C CA . GLN A 1 99 ? -9.856 -51.672 -79.058 1.00 58.06 ? 99 GLN A CA 1 ATOM 713 C C . GLN A 1 99 ? -11.146 -51.688 -78.243 1.00 58.02 ? 99 GLN A C 1 ATOM 714 O O . GLN A 1 99 ? -11.676 -52.750 -77.900 1.00 58.64 ? 99 GLN A O 1 ATOM 715 C CB . GLN A 1 99 ? -10.045 -52.503 -80.319 1.00 58.32 ? 99 GLN A CB 1 ATOM 716 C CG . GLN A 1 99 ? -9.195 -52.085 -81.484 1.00 58.22 ? 99 GLN A CG 1 ATOM 717 C CD . GLN A 1 99 ? -9.405 -52.998 -82.659 1.00 59.10 ? 99 GLN A CD 1 ATOM 718 O OE1 . GLN A 1 99 ? -8.904 -54.123 -82.678 1.00 61.00 ? 99 GLN A OE1 1 ATOM 719 N NE2 . GLN A 1 99 ? -10.163 -52.533 -83.643 1.00 58.59 ? 99 GLN A NE2 1 ATOM 720 N N . LEU A 1 100 ? -11.652 -50.500 -77.936 1.00 57.62 ? 100 LEU A N 1 ATOM 721 C CA . LEU A 1 100 ? -12.890 -50.388 -77.188 1.00 57.99 ? 100 LEU A CA 1 ATOM 722 C C . LEU A 1 100 ? -14.024 -49.987 -78.117 1.00 57.71 ? 100 LEU A C 1 ATOM 723 O O . LEU A 1 100 ? -13.880 -49.088 -78.947 1.00 56.99 ? 100 LEU A O 1 ATOM 724 C CB . LEU A 1 100 ? -12.745 -49.411 -76.016 1.00 58.56 ? 100 LEU A CB 1 ATOM 725 C CG . LEU A 1 100 ? -11.939 -49.927 -74.819 1.00 59.26 ? 100 LEU A CG 1 ATOM 726 N N . SER A 1 101 ? -15.140 -50.693 -77.975 1.00 58.68 ? 101 SER A N 1 ATOM 727 C CA . SER A 1 101 ? -16.334 -50.468 -78.766 1.00 59.16 ? 101 SER A CA 1 ATOM 728 C C . SER A 1 101 ? -17.507 -50.315 -77.822 1.00 60.81 ? 101 SER A C 1 ATOM 729 O O . SER A 1 101 ? -18.096 -51.306 -77.378 1.00 62.34 ? 101 SER A O 1 ATOM 730 C CB . SER A 1 101 ? -16.571 -51.647 -79.703 1.00 59.80 ? 101 SER A CB 1 ATOM 731 O OG . SER A 1 101 ? -17.907 -51.672 -80.168 1.00 61.36 ? 101 SER A OG 1 ATOM 732 N N . ALA A 1 102 ? -17.828 -49.064 -77.509 1.00 61.05 ? 102 ALA A N 1 ATOM 733 C CA . ALA A 1 102 ? -18.931 -48.743 -76.611 1.00 63.12 ? 102 ALA A CA 1 ATOM 734 C C . ALA A 1 102 ? -20.151 -48.324 -77.410 1.00 64.37 ? 102 ALA A C 1 ATOM 735 O O . ALA A 1 102 ? -20.162 -48.424 -78.640 1.00 63.77 ? 102 ALA A O 1 ATOM 736 C CB . ALA A 1 102 ? -18.524 -47.640 -75.646 1.00 63.38 ? 102 ALA A CB 1 ATOM 737 N N . GLY A 1 103 ? -21.179 -47.863 -76.706 1.00 66.66 ? 103 GLY A N 1 ATOM 738 C CA . GLY A 1 103 ? -22.363 -47.314 -77.348 1.00 68.41 ? 103 GLY A CA 1 ATOM 739 C C . GLY A 1 103 ? -23.650 -48.023 -76.993 1.00 71.62 ? 103 GLY A C 1 ATOM 740 O O . GLY A 1 103 ? -23.674 -48.913 -76.136 1.00 72.75 ? 103 GLY A O 1 ATOM 741 N N . CYS A 1 104 ? -24.721 -47.614 -77.667 1.00 73.59 ? 104 CYS A N 1 ATOM 742 C CA . CYS A 1 104 ? -26.056 -48.147 -77.437 1.00 77.45 ? 104 CYS A CA 1 ATOM 743 C C . CYS A 1 104 ? -26.934 -47.907 -78.648 1.00 79.03 ? 104 CYS A C 1 ATOM 744 O O . CYS A 1 104 ? -26.846 -46.856 -79.287 1.00 78.14 ? 104 CYS A O 1 ATOM 745 C CB . CYS A 1 104 ? -26.693 -47.489 -76.216 1.00 80.19 ? 104 CYS A CB 1 ATOM 746 S SG . CYS A 1 104 ? -26.458 -45.695 -76.106 1.00 79.77 ? 104 CYS A SG 1 ATOM 747 N N . GLU A 1 105 ? -27.776 -48.889 -78.958 1.00 81.90 ? 105 GLU A N 1 ATOM 748 C CA . GLU A 1 105 ? -28.761 -48.764 -80.027 1.00 84.51 ? 105 GLU A CA 1 ATOM 749 C C . GLU A 1 105 ? -30.067 -48.220 -79.462 1.00 89.05 ? 105 GLU A C 1 ATOM 750 O O . GLU A 1 105 ? -30.541 -48.693 -78.430 1.00 91.85 ? 105 GLU A O 1 ATOM 751 C CB . GLU A 1 105 ? -29.003 -50.118 -80.703 1.00 86.04 ? 105 GLU A CB 1 ATOM 752 N N . MET A 1 106 ? -30.633 -47.216 -80.128 1.00 90.28 ? 106 MET A N 1 ATOM 753 C CA . MET A 1 106 ? -31.943 -46.685 -79.748 1.00 95.39 ? 106 MET A CA 1 ATOM 754 C C . MET A 1 106 ? -33.027 -47.349 -80.592 1.00 99.60 ? 106 MET A C 1 ATOM 755 O O . MET A 1 106 ? -32.912 -47.419 -81.819 1.00 98.57 ? 106 MET A O 1 ATOM 756 C CB . MET A 1 106 ? -31.989 -45.162 -79.899 1.00 95.13 ? 106 MET A CB 1 ATOM 757 N N . TYR A 1 107 ? -34.069 -47.843 -79.924 1.00 104.83 ? 107 TYR A N 1 ATOM 758 C CA . TYR A 1 107 ? -35.153 -48.579 -80.579 1.00 109.94 ? 107 TYR A CA 1 ATOM 759 C C . TYR A 1 107 ? -36.407 -47.716 -80.714 1.00 115.15 ? 107 TYR A C 1 ATOM 760 O O . TYR A 1 107 ? -36.970 -47.257 -79.718 1.00 118.26 ? 107 TYR A O 1 ATOM 761 C CB . TYR A 1 107 ? -35.486 -49.857 -79.798 1.00 113.22 ? 107 TYR A CB 1 ATOM 762 C CG . TYR A 1 107 ? -34.431 -50.951 -79.845 1.00 109.65 ? 107 TYR A CG 1 ATOM 763 C CD1 . TYR A 1 107 ? -34.758 -52.239 -80.277 1.00 112.78 ? 107 TYR A CD1 1 ATOM 764 C CD2 . TYR A 1 107 ? -33.112 -50.706 -79.444 1.00 103.75 ? 107 TYR A CD2 1 ATOM 765 C CE1 . TYR A 1 107 ? -33.801 -53.252 -80.315 1.00 110.11 ? 107 TYR A CE1 1 ATOM 766 C CE2 . TYR A 1 107 ? -32.148 -51.708 -79.483 1.00 100.93 ? 107 TYR A CE2 1 ATOM 767 C CZ . TYR A 1 107 ? -32.499 -52.976 -79.917 1.00 104.23 ? 107 TYR A CZ 1 ATOM 768 O OH . TYR A 1 107 ? -31.547 -53.967 -79.952 1.00 102.01 ? 107 TYR A OH 1 ATOM 769 N N . ASN A 1 110 ? -38.439 -45.824 -77.021 1.00 129.19 ? 110 ASN A N 1 ATOM 770 C CA . ASN A 1 110 ? -37.698 -45.391 -75.837 1.00 126.70 ? 110 ASN A CA 1 ATOM 771 C C . ASN A 1 110 ? -36.888 -46.524 -75.185 1.00 123.65 ? 110 ASN A C 1 ATOM 772 O O . ASN A 1 110 ? -36.444 -46.408 -74.037 1.00 123.06 ? 110 ASN A O 1 ATOM 773 C CB . ASN A 1 110 ? -38.652 -44.740 -74.821 1.00 133.07 ? 110 ASN A CB 1 ATOM 774 C CG . ASN A 1 110 ? -37.966 -43.689 -73.949 1.00 130.93 ? 110 ASN A CG 1 ATOM 775 O OD1 . ASN A 1 110 ? -36.738 -43.516 -73.995 1.00 124.74 ? 110 ASN A OD1 1 ATOM 776 N ND2 . ASN A 1 110 ? -38.766 -42.981 -73.146 1.00 136.69 ? 110 ASN A ND2 1 ATOM 777 N N . ALA A 1 111 ? -36.696 -47.615 -75.925 1.00 122.07 ? 111 ALA A N 1 ATOM 778 C CA . ALA A 1 111 ? -35.931 -48.760 -75.433 1.00 119.43 ? 111 ALA A CA 1 ATOM 779 C C . ALA A 1 111 ? -34.511 -48.722 -75.982 1.00 111.89 ? 111 ALA A C 1 ATOM 780 O O . ALA A 1 111 ? -34.297 -48.348 -77.140 1.00 109.52 ? 111 ALA A O 1 ATOM 781 C CB . ALA A 1 111 ? -36.615 -50.063 -75.817 1.00 123.53 ? 111 ALA A CB 1 ATOM 782 N N . SER A 1 112 ? -33.544 -49.100 -75.149 1.00 108.48 ? 112 SER A N 1 ATOM 783 C CA . SER A 1 112 ? -32.143 -49.132 -75.575 1.00 101.68 ? 112 SER A CA 1 ATOM 784 C C . SER A 1 112 ? -31.358 -50.315 -75.010 1.00 99.76 ? 112 SER A C 1 ATOM 785 O O . SER A 1 112 ? -31.624 -50.792 -73.908 1.00 102.56 ? 112 SER A O 1 ATOM 786 C CB . SER A 1 112 ? -31.434 -47.807 -75.253 1.00 98.50 ? 112 SER A CB 1 ATOM 787 O OG . SER A 1 112 ? -31.186 -47.663 -73.866 1.00 99.21 ? 112 SER A OG 1 ATOM 788 N N . GLU A 1 113 ? -30.396 -50.783 -75.795 1.00 95.23 ? 113 GLU A N 1 ATOM 789 C CA . GLU A 1 113 ? -29.463 -51.808 -75.367 1.00 93.02 ? 113 GLU A CA 1 ATOM 790 C C . GLU A 1 113 ? -28.056 -51.242 -75.455 1.00 87.11 ? 113 GLU A C 1 ATOM 791 O O . GLU A 1 113 ? -27.513 -51.091 -76.548 1.00 84.20 ? 113 GLU A O 1 ATOM 792 C CB . GLU A 1 113 ? -29.593 -53.050 -76.250 1.00 94.31 ? 113 GLU A CB 1 ATOM 793 C CG . GLU A 1 113 ? -30.331 -54.222 -75.605 1.00 99.79 ? 113 GLU A CG 1 ATOM 794 C CD . GLU A 1 113 ? -29.397 -55.175 -74.865 1.00 98.85 ? 113 GLU A CD 1 ATOM 795 O OE1 . GLU A 1 113 ? -28.287 -55.456 -75.378 1.00 94.69 ? 113 GLU A OE1 1 ATOM 796 O OE2 . GLU A 1 113 ? -29.781 -55.652 -73.773 1.00 102.35 ? 113 GLU A OE2 1 ATOM 797 N N . SER A 1 114 ? -27.481 -50.906 -74.304 1.00 85.83 ? 114 SER A N 1 ATOM 798 C CA . SER A 1 114 ? -26.109 -50.406 -74.247 1.00 80.84 ? 114 SER A CA 1 ATOM 799 C C . SER A 1 114 ? -25.127 -51.567 -74.212 1.00 78.77 ? 114 SER A C 1 ATOM 800 O O . SER A 1 114 ? -25.460 -52.659 -73.746 1.00 81.29 ? 114 SER A O 1 ATOM 801 C CB . SER A 1 114 ? -25.905 -49.505 -73.030 1.00 81.22 ? 114 SER A CB 1 ATOM 802 O OG . SER A 1 114 ? -26.789 -48.402 -73.059 1.00 83.11 ? 114 SER A OG 1 ATOM 803 N N . PHE A 1 115 ? -23.919 -51.323 -74.708 1.00 74.58 ? 115 PHE A N 1 ATOM 804 C CA . PHE A 1 115 ? -22.880 -52.350 -74.769 1.00 72.82 ? 115 PHE A CA 1 ATOM 805 C C . PHE A 1 115 ? -21.494 -51.729 -74.630 1.00 69.14 ? 115 PHE A C 1 ATOM 806 O O . PHE A 1 115 ? -21.271 -50.585 -75.039 1.00 67.43 ? 115 PHE A O 1 ATOM 807 C CB . PHE A 1 115 ? -22.971 -53.124 -76.092 1.00 72.80 ? 115 PHE A CB 1 ATOM 808 C CG . PHE A 1 115 ? -22.846 -52.250 -77.311 1.00 71.02 ? 115 PHE A CG 1 ATOM 809 C CD1 . PHE A 1 115 ? -23.976 -51.679 -77.891 1.00 72.80 ? 115 PHE A CD1 1 ATOM 810 C CD2 . PHE A 1 115 ? -21.595 -51.980 -77.867 1.00 67.94 ? 115 PHE A CD2 1 ATOM 811 C CE1 . PHE A 1 115 ? -23.863 -50.856 -79.005 1.00 71.51 ? 115 PHE A CE1 1 ATOM 812 C CE2 . PHE A 1 115 ? -21.472 -51.160 -78.980 1.00 66.48 ? 115 PHE A CE2 1 ATOM 813 C CZ . PHE A 1 115 ? -22.607 -50.593 -79.551 1.00 68.23 ? 115 PHE A CZ 1 ATOM 814 N N . LEU A 1 116 ? -20.567 -52.484 -74.052 1.00 68.29 ? 116 LEU A N 1 ATOM 815 C CA . LEU A 1 116 ? -19.171 -52.075 -74.029 1.00 65.42 ? 116 LEU A CA 1 ATOM 816 C C . LEU A 1 116 ? -18.273 -53.285 -74.260 1.00 64.77 ? 116 LEU A C 1 ATOM 817 O O . LEU A 1 116 ? -18.020 -54.066 -73.341 1.00 66.18 ? 116 LEU A O 1 ATOM 818 C CB . LEU A 1 116 ? -18.821 -51.364 -72.720 1.00 65.84 ? 116 LEU A CB 1 ATOM 819 C CG . LEU A 1 116 ? -17.665 -50.361 -72.799 1.00 64.01 ? 116 LEU A CG 1 ATOM 820 C CD1 . LEU A 1 116 ? -17.892 -49.190 -71.853 1.00 65.63 ? 116 LEU A CD1 1 ATOM 821 C CD2 . LEU A 1 116 ? -16.316 -51.019 -72.530 1.00 63.23 ? 116 LEU A CD2 1 ATOM 822 N N . HIS A 1 117 ? -17.804 -53.429 -75.498 1.00 62.91 ? 117 HIS A N 1 ATOM 823 C CA . HIS A 1 117 ? -16.956 -54.547 -75.890 1.00 62.55 ? 117 HIS A CA 1 ATOM 824 C C . HIS A 1 117 ? -15.488 -54.137 -75.974 1.00 60.22 ? 117 HIS A C 1 ATOM 825 O O . HIS A 1 117 ? -15.162 -53.065 -76.480 1.00 58.57 ? 117 HIS A O 1 ATOM 826 C CB . HIS A 1 117 ? -17.407 -55.106 -77.238 1.00 63.18 ? 117 HIS A CB 1 ATOM 827 C CG . HIS A 1 117 ? -18.811 -55.622 -77.246 1.00 66.17 ? 117 HIS A CG 1 ATOM 828 N ND1 . HIS A 1 117 ? -19.176 -56.800 -76.632 1.00 69.18 ? 117 HIS A ND1 1 ATOM 829 C CD2 . HIS A 1 117 ? -19.938 -55.129 -77.813 1.00 67.33 ? 117 HIS A CD2 1 ATOM 830 C CE1 . HIS A 1 117 ? -20.468 -57.008 -76.812 1.00 71.92 ? 117 HIS A CE1 1 ATOM 831 N NE2 . HIS A 1 117 ? -20.955 -56.007 -77.525 1.00 70.96 ? 117 HIS A NE2 1 ATOM 832 N N . VAL A 1 118 ? -14.608 -55.005 -75.484 1.00 60.58 ? 118 VAL A N 1 ATOM 833 C CA . VAL A 1 118 ? -13.165 -54.776 -75.530 1.00 59.15 ? 118 VAL A CA 1 ATOM 834 C C . VAL A 1 118 ? -12.483 -55.914 -76.281 1.00 59.66 ? 118 VAL A C 1 ATOM 835 O O . VAL A 1 118 ? -12.765 -57.090 -76.034 1.00 61.55 ? 118 VAL A O 1 ATOM 836 C CB . VAL A 1 118 ? -12.561 -54.621 -74.108 1.00 59.80 ? 118 VAL A CB 1 ATOM 837 C CG1 . VAL A 1 118 ? -11.035 -54.621 -74.151 1.00 59.50 ? 118 VAL A CG1 1 ATOM 838 C CG2 . VAL A 1 118 ? -13.065 -53.344 -73.455 1.00 59.42 ? 118 VAL A CG2 1 ATOM 839 N N . ALA A 1 119 ? -11.594 -55.541 -77.201 1.00 58.36 ? 119 ALA A N 1 ATOM 840 C CA . ALA A 1 119 ? -10.871 -56.485 -78.044 1.00 59.18 ? 119 ALA A CA 1 ATOM 841 C C . ALA A 1 119 ? -9.369 -56.393 -77.808 1.00 59.41 ? 119 ALA A C 1 ATOM 842 O O . ALA A 1 119 ? -8.805 -55.293 -77.734 1.00 58.27 ? 119 ALA A O 1 ATOM 843 C CB . ALA A 1 119 ? -11.192 -56.239 -79.505 1.00 58.51 ? 119 ALA A CB 1 ATOM 844 N N . PHE A 1 120 ? -8.732 -57.557 -77.695 1.00 61.35 ? 120 PHE A N 1 ATOM 845 C CA . PHE A 1 120 ? -7.295 -57.655 -77.437 1.00 62.35 ? 120 PHE A CA 1 ATOM 846 C C . PHE A 1 120 ? -6.569 -58.292 -78.622 1.00 63.86 ? 120 PHE A C 1 ATOM 847 O O . PHE A 1 120 ? -6.753 -59.478 -78.906 1.00 66.02 ? 120 PHE A O 1 ATOM 848 C CB . PHE A 1 120 ? -7.048 -58.458 -76.156 1.00 64.07 ? 120 PHE A CB 1 ATOM 849 C CG . PHE A 1 120 ? -5.618 -58.461 -75.698 1.00 65.28 ? 120 PHE A CG 1 ATOM 850 C CD1 . PHE A 1 120 ? -5.118 -57.415 -74.929 1.00 64.16 ? 120 PHE A CD1 1 ATOM 851 C CD2 . PHE A 1 120 ? -4.775 -59.521 -76.017 1.00 67.78 ? 120 PHE A CD2 1 ATOM 852 C CE1 . PHE A 1 120 ? -3.799 -57.418 -74.493 1.00 65.70 ? 120 PHE A CE1 1 ATOM 853 C CE2 . PHE A 1 120 ? -3.450 -59.528 -75.590 1.00 69.52 ? 120 PHE A CE2 1 ATOM 854 C CZ . PHE A 1 120 ? -2.963 -58.473 -74.826 1.00 68.52 ? 120 PHE A CZ 1 ATOM 855 N N . GLN A 1 121 ? -5.747 -57.492 -79.304 1.00 63.39 ? 121 GLN A N 1 ATOM 856 C CA . GLN A 1 121 ? -4.998 -57.914 -80.501 1.00 65.13 ? 121 GLN A CA 1 ATOM 857 C C . GLN A 1 121 ? -5.895 -58.308 -81.677 1.00 64.96 ? 121 GLN A C 1 ATOM 858 O O . GLN A 1 121 ? -5.491 -59.090 -82.535 1.00 67.32 ? 121 GLN A O 1 ATOM 859 C CB . GLN A 1 121 ? -3.995 -59.043 -80.188 1.00 68.34 ? 121 GLN A CB 1 ATOM 860 C CG . GLN A 1 121 ? -3.002 -58.753 -79.064 1.00 69.55 ? 121 GLN A CG 1 ATOM 861 C CD . GLN A 1 121 ? -1.913 -57.769 -79.455 1.00 70.76 ? 121 GLN A CD 1 ATOM 862 O OE1 . GLN A 1 121 ? -2.180 -56.595 -79.745 1.00 68.84 ? 121 GLN A OE1 1 ATOM 863 N NE2 . GLN A 1 121 ? -0.670 -58.240 -79.444 1.00 74.01 ? 121 GLN A NE2 1 ATOM 864 N N . GLY A 1 122 ? -7.105 -57.765 -81.717 1.00 62.82 ? 122 GLY A N 1 ATOM 865 C CA . GLY A 1 122 ? -8.036 -58.063 -82.800 1.00 63.09 ? 122 GLY A CA 1 ATOM 866 C C . GLY A 1 122 ? -9.155 -59.009 -82.411 1.00 64.09 ? 122 GLY A C 1 ATOM 867 O O . GLY A 1 122 ? -10.227 -58.997 -83.021 1.00 64.06 ? 122 GLY A O 1 ATOM 868 N N . LYS A 1 123 ? -8.907 -59.839 -81.403 1.00 65.46 ? 123 LYS A N 1 ATOM 869 C CA . LYS A 1 123 ? -9.935 -60.734 -80.894 1.00 66.94 ? 123 LYS A CA 1 ATOM 870 C C . LYS A 1 123 ? -10.703 -60.072 -79.747 1.00 65.15 ? 123 LYS A C 1 ATOM 871 O O . LYS A 1 123 ? -10.107 -59.490 -78.837 1.00 63.85 ? 123 LYS A O 1 ATOM 872 C CB . LYS A 1 123 ? -9.326 -62.068 -80.453 1.00 70.14 ? 123 LYS A CB 1 ATOM 873 C CG . LYS A 1 123 ? -10.337 -63.199 -80.346 1.00 73.09 ? 123 LYS A CG 1 ATOM 874 N N . TYR A 1 124 ? -12.029 -60.159 -79.813 1.00 65.46 ? 124 TYR A N 1 ATOM 875 C CA . TYR A 1 124 ? -12.909 -59.651 -78.761 1.00 64.52 ? 124 TYR A CA 1 ATOM 876 C C . TYR A 1 124 ? -12.932 -60.628 -77.591 1.00 67.01 ? 124 TYR A C 1 ATOM 877 O O . TYR A 1 124 ? -13.325 -61.791 -77.748 1.00 70.10 ? 124 TYR A O 1 ATOM 878 C CB . TYR A 1 124 ? -14.309 -59.405 -79.334 1.00 64.66 ? 124 TYR A CB 1 ATOM 879 C CG . TYR A 1 124 ? -15.456 -59.487 -78.355 1.00 65.57 ? 124 TYR A CG 1 ATOM 880 C CD1 . TYR A 1 124 ? -15.722 -58.449 -77.466 1.00 63.60 ? 124 TYR A CD1 1 ATOM 881 C CD2 . TYR A 1 124 ? -16.295 -60.599 -78.343 1.00 68.75 ? 124 TYR A CD2 1 ATOM 882 C CE1 . TYR A 1 124 ? -16.786 -58.528 -76.575 1.00 65.37 ? 124 TYR A CE1 1 ATOM 883 C CE2 . TYR A 1 124 ? -17.359 -60.686 -77.462 1.00 70.50 ? 124 TYR A CE2 1 ATOM 884 C CZ . TYR A 1 124 ? -17.604 -59.650 -76.582 1.00 68.70 ? 124 TYR A CZ 1 ATOM 885 O OH . TYR A 1 124 ? -18.663 -59.748 -75.709 1.00 70.49 ? 124 TYR A OH 1 ATOM 886 N N . VAL A 1 125 ? -12.501 -60.148 -76.426 1.00 66.08 ? 125 VAL A N 1 ATOM 887 C CA . VAL A 1 125 ? -12.302 -61.004 -75.250 1.00 68.51 ? 125 VAL A CA 1 ATOM 888 C C . VAL A 1 125 ? -13.040 -60.549 -73.994 1.00 68.64 ? 125 VAL A C 1 ATOM 889 O O . VAL A 1 125 ? -13.458 -61.369 -73.177 1.00 71.44 ? 125 VAL A O 1 ATOM 890 C CB . VAL A 1 125 ? -10.804 -61.152 -74.896 1.00 68.57 ? 125 VAL A CB 1 ATOM 891 C CG1 . VAL A 1 125 ? -10.129 -62.173 -75.812 1.00 70.81 ? 125 VAL A CG1 1 ATOM 892 C CG2 . VAL A 1 125 ? -10.098 -59.799 -74.951 1.00 65.54 ? 125 VAL A CG2 1 ATOM 893 N N . VAL A 1 126 ? -13.176 -59.238 -73.831 1.00 66.16 ? 126 VAL A N 1 ATOM 894 C CA . VAL A 1 126 ? -13.750 -58.681 -72.613 1.00 66.41 ? 126 VAL A CA 1 ATOM 895 C C . VAL A 1 126 ? -14.913 -57.754 -72.939 1.00 65.38 ? 126 VAL A C 1 ATOM 896 O O . VAL A 1 126 ? -14.898 -57.051 -73.946 1.00 63.33 ? 126 VAL A O 1 ATOM 897 C CB . VAL A 1 126 ? -12.672 -57.957 -71.757 1.00 65.29 ? 126 VAL A CB 1 ATOM 898 C CG1 . VAL A 1 126 ? -13.293 -57.233 -70.575 1.00 65.77 ? 126 VAL A CG1 1 ATOM 899 C CG2 . VAL A 1 126 ? -11.630 -58.951 -71.263 1.00 67.10 ? 126 VAL A CG2 1 ATOM 900 N N . ARG A 1 127 ? -15.931 -57.797 -72.091 1.00 67.33 ? 127 ARG A N 1 ATOM 901 C CA . ARG A 1 127 ? -17.057 -56.886 -72.167 1.00 67.16 ? 127 ARG A CA 1 ATOM 902 C C . ARG A 1 127 ? -17.399 -56.419 -70.762 1.00 68.63 ? 127 ARG A C 1 ATOM 903 O O . ARG A 1 127 ? -16.908 -56.973 -69.778 1.00 70.07 ? 127 ARG A O 1 ATOM 904 C CB . ARG A 1 127 ? -18.275 -57.574 -72.796 1.00 69.55 ? 127 ARG A CB 1 ATOM 905 C CG . ARG A 1 127 ? -18.846 -58.734 -71.975 1.00 73.56 ? 127 ARG A CG 1 ATOM 906 C CD . ARG A 1 127 ? -20.310 -58.976 -72.295 1.00 76.53 ? 127 ARG A CD 1 ATOM 907 N NE . ARG A 1 127 ? -20.830 -60.155 -71.604 1.00 81.26 ? 127 ARG A NE 1 ATOM 908 C CZ . ARG A 1 127 ? -22.062 -60.635 -71.745 1.00 85.03 ? 127 ARG A CZ 1 ATOM 909 N NH1 . ARG A 1 127 ? -22.930 -60.042 -72.557 1.00 84.90 ? 127 ARG A NH1 1 ATOM 910 N NH2 . ARG A 1 127 ? -22.428 -61.715 -71.070 1.00 89.28 ? 127 ARG A NH2 1 ATOM 911 N N . PHE A 1 128 ? -18.235 -55.393 -70.673 1.00 68.60 ? 128 PHE A N 1 ATOM 912 C CA . PHE A 1 128 ? -18.820 -55.020 -69.404 1.00 70.93 ? 128 PHE A CA 1 ATOM 913 C C . PHE A 1 128 ? -20.196 -55.653 -69.343 1.00 74.55 ? 128 PHE A C 1 ATOM 914 O O . PHE A 1 128 ? -20.949 -55.600 -70.316 1.00 74.65 ? 128 PHE A O 1 ATOM 915 C CB . PHE A 1 128 ? -18.924 -53.502 -69.267 1.00 69.64 ? 128 PHE A CB 1 ATOM 916 C CG . PHE A 1 128 ? -19.242 -53.048 -67.874 1.00 71.91 ? 128 PHE A CG 1 ATOM 917 C CD1 . PHE A 1 128 ? -18.221 -52.709 -66.993 1.00 71.31 ? 128 PHE A CD1 1 ATOM 918 C CD2 . PHE A 1 128 ? -20.559 -52.972 -67.436 1.00 75.04 ? 128 PHE A CD2 1 ATOM 919 C CE1 . PHE A 1 128 ? -18.503 -52.300 -65.704 1.00 73.97 ? 128 PHE A CE1 1 ATOM 920 C CE2 . PHE A 1 128 ? -20.853 -52.565 -66.146 1.00 78.14 ? 128 PHE A CE2 1 ATOM 921 C CZ . PHE A 1 128 ? -19.821 -52.226 -65.277 1.00 77.64 ? 128 PHE A CZ 1 ATOM 922 N N . TRP A 1 129 ? -20.515 -56.260 -68.206 1.00 78.16 ? 129 TRP A N 1 ATOM 923 C CA . TRP A 1 129 ? -21.822 -56.873 -68.006 1.00 82.66 ? 129 TRP A CA 1 ATOM 924 C C . TRP A 1 129 ? -22.259 -56.779 -66.555 1.00 86.34 ? 129 TRP A C 1 ATOM 925 O O . TRP A 1 129 ? -21.466 -57.017 -65.639 1.00 86.61 ? 129 TRP A O 1 ATOM 926 C CB . TRP A 1 129 ? -21.819 -58.329 -68.474 1.00 84.50 ? 129 TRP A CB 1 ATOM 927 C CG . TRP A 1 129 ? -23.190 -58.875 -68.740 1.00 88.96 ? 129 TRP A CG 1 ATOM 928 C CD1 . TRP A 1 129 ? -23.730 -60.019 -68.224 1.00 94.18 ? 129 TRP A CD1 1 ATOM 929 C CD2 . TRP A 1 129 ? -24.200 -58.299 -69.582 1.00 89.41 ? 129 TRP A CD2 1 ATOM 930 N NE1 . TRP A 1 129 ? -25.009 -60.196 -68.696 1.00 97.53 ? 129 TRP A NE1 1 ATOM 931 C CE2 . TRP A 1 129 ? -25.323 -59.155 -69.531 1.00 94.74 ? 129 TRP A CE2 1 ATOM 932 C CE3 . TRP A 1 129 ? -24.265 -57.146 -70.377 1.00 86.21 ? 129 TRP A CE3 1 ATOM 933 C CZ2 . TRP A 1 129 ? -26.500 -58.893 -70.242 1.00 96.87 ? 129 TRP A CZ2 1 ATOM 934 C CZ3 . TRP A 1 129 ? -25.436 -56.887 -71.085 1.00 88.29 ? 129 TRP A CZ3 1 ATOM 935 C CH2 . TRP A 1 129 ? -26.536 -57.757 -71.011 1.00 93.38 ? 129 TRP A CH2 1 ATOM 936 N N . GLY A 1 130 ? -23.526 -56.427 -66.359 1.00 89.71 ? 130 GLY A N 1 ATOM 937 C CA . GLY A 1 130 ? -24.083 -56.218 -65.026 1.00 93.89 ? 130 GLY A CA 1 ATOM 938 C C . GLY A 1 130 ? -23.405 -55.070 -64.297 1.00 92.12 ? 130 GLY A C 1 ATOM 939 O O . GLY A 1 130 ? -23.636 -53.895 -64.605 1.00 90.66 ? 130 GLY A O 1 ATOM 940 N N . THR A 1 131 ? -22.552 -55.421 -63.340 1.00 92.58 ? 131 THR A N 1 ATOM 941 C CA . THR A 1 131 ? -21.869 -54.436 -62.507 1.00 91.84 ? 131 THR A CA 1 ATOM 942 C C . THR A 1 131 ? -20.352 -54.600 -62.531 1.00 88.54 ? 131 THR A C 1 ATOM 943 O O . THR A 1 131 ? -19.658 -54.090 -61.647 1.00 88.95 ? 131 THR A O 1 ATOM 944 C CB . THR A 1 131 ? -22.346 -54.512 -61.037 1.00 96.93 ? 131 THR A CB 1 ATOM 945 O OG1 . THR A 1 131 ? -22.364 -55.879 -60.606 1.00 99.56 ? 131 THR A OG1 1 ATOM 946 C CG2 . THR A 1 131 ? -23.738 -53.914 -60.884 1.00 100.68 ? 131 THR A CG2 1 ATOM 947 N N . SER A 1 132 ? -19.839 -55.304 -63.539 1.00 85.85 ? 132 SER A N 1 ATOM 948 C CA . SER A 1 132 ? -18.407 -55.595 -63.616 1.00 83.30 ? 132 SER A CA 1 ATOM 949 C C . SER A 1 132 ? -17.935 -55.895 -65.034 1.00 79.85 ? 132 SER A C 1 ATOM 950 O O . SER A 1 132 ? -18.735 -55.950 -65.968 1.00 79.46 ? 132 SER A O 1 ATOM 951 C CB . SER A 1 132 ? -18.061 -56.772 -62.699 1.00 86.26 ? 132 SER A CB 1 ATOM 952 O OG . SER A 1 132 ? -18.795 -57.926 -63.067 1.00 88.50 ? 132 SER A OG 1 ATOM 953 N N . TRP A 1 133 ? -16.624 -56.076 -65.177 1.00 77.87 ? 133 TRP A N 1 ATOM 954 C CA . TRP A 1 133 ? -16.018 -56.558 -66.413 1.00 75.37 ? 133 TRP A CA 1 ATOM 955 C C . TRP A 1 133 ? -16.155 -58.078 -66.491 1.00 77.88 ? 133 TRP A C 1 ATOM 956 O O . TRP A 1 133 ? -16.222 -58.758 -65.463 1.00 81.02 ? 133 TRP A O 1 ATOM 957 C CB . TRP A 1 133 ? -14.540 -56.164 -66.479 1.00 73.05 ? 133 TRP A CB 1 ATOM 958 C CG . TRP A 1 133 ? -14.294 -54.681 -66.472 1.00 70.96 ? 133 TRP A CG 1 ATOM 959 C CD1 . TRP A 1 133 ? -13.762 -53.944 -65.454 0.70 71.72 ? 133 TRP A CD1 1 ATOM 960 C CD2 . TRP A 1 133 ? -14.566 -53.761 -67.532 0.70 68.32 ? 133 TRP A CD2 1 ATOM 961 N NE1 . TRP A 1 133 ? -13.685 -52.622 -65.814 0.70 69.91 ? 133 TRP A NE1 1 ATOM 962 C CE2 . TRP A 1 133 ? -14.174 -52.481 -67.085 0.70 67.91 ? 133 TRP A CE2 1 ATOM 963 C CE3 . TRP A 1 133 ? -15.103 -53.894 -68.820 0.70 66.68 ? 133 TRP A CE3 1 ATOM 964 C CZ2 . TRP A 1 133 ? -14.305 -51.339 -67.876 0.70 66.31 ? 133 TRP A CZ2 1 ATOM 965 C CZ3 . TRP A 1 133 ? -15.231 -52.761 -69.607 0.70 64.89 ? 133 TRP A CZ3 1 ATOM 966 C CH2 . TRP A 1 133 ? -14.831 -51.498 -69.133 0.70 64.82 ? 133 TRP A CH2 1 ATOM 967 N N . GLN A 1 134 ? -16.192 -58.604 -67.713 1.00 76.99 ? 134 GLN A N 1 ATOM 968 C CA . GLN A 1 134 ? -16.398 -60.031 -67.938 1.00 79.88 ? 134 GLN A CA 1 ATOM 969 C C . GLN A 1 134 ? -15.517 -60.591 -69.046 1.00 78.42 ? 134 GLN A C 1 ATOM 970 O O . GLN A 1 134 ? -15.345 -59.956 -70.084 1.00 75.66 ? 134 GLN A O 1 ATOM 971 C CB . GLN A 1 134 ? -17.863 -60.301 -68.292 1.00 82.21 ? 134 GLN A CB 1 ATOM 972 C CG . GLN A 1 134 ? -18.814 -60.307 -67.100 1.00 86.09 ? 134 GLN A CG 1 ATOM 973 C CD . GLN A 1 134 ? -19.908 -61.359 -67.225 1.00 90.52 ? 134 GLN A CD 1 ATOM 974 O OE1 . GLN A 1 134 ? -19.800 -62.303 -68.014 1.00 90.86 ? 134 GLN A OE1 1 ATOM 975 N NE2 . GLN A 1 134 ? -20.965 -61.202 -66.435 1.00 93.87 ? 134 GLN A NE2 1 ATOM 976 N N . THR A 1 135 ? -14.962 -61.781 -68.824 1.00 80.89 ? 135 THR A N 1 ATOM 977 C CA . THR A 1 135 ? -14.388 -62.556 -69.918 1.00 80.93 ? 135 THR A CA 1 ATOM 978 C C . THR A 1 135 ? -15.536 -63.241 -70.643 1.00 83.45 ? 135 THR A C 1 ATOM 979 O O . THR A 1 135 ? -16.593 -63.478 -70.054 1.00 86.25 ? 135 THR A O 1 ATOM 980 C CB . THR A 1 135 ? -13.379 -63.627 -69.450 1.00 83.30 ? 135 THR A CB 1 ATOM 981 O OG1 . THR A 1 135 ? -14.013 -64.534 -68.539 1.00 87.74 ? 135 THR A OG1 1 ATOM 982 C CG2 . THR A 1 135 ? -12.168 -62.987 -68.790 1.00 81.47 ? 135 THR A CG2 1 ATOM 983 N N . VAL A 1 136 ? -15.327 -63.547 -71.920 1.00 83.04 ? 136 VAL A N 1 ATOM 984 C CA . VAL A 1 136 ? -16.359 -64.152 -72.755 1.00 85.79 ? 136 VAL A CA 1 ATOM 985 C C . VAL A 1 136 ? -16.200 -65.676 -72.820 1.00 90.63 ? 136 VAL A C 1 ATOM 986 O O . VAL A 1 136 ? -15.238 -66.222 -72.275 1.00 91.68 ? 136 VAL A O 1 ATOM 987 C CB . VAL A 1 136 ? -16.347 -63.553 -74.188 1.00 82.87 ? 136 VAL A CB 1 ATOM 988 C CG1 . VAL A 1 136 ? -16.613 -62.057 -74.143 1.00 79.34 ? 136 VAL A CG1 1 ATOM 989 C CG2 . VAL A 1 136 ? -15.031 -63.849 -74.899 1.00 81.51 ? 136 VAL A CG2 1 ATOM 990 N N . PRO A 1 137 ? -17.168 -66.373 -73.444 1.00 94.28 ? 137 PRO A N 1 ATOM 991 C CA . PRO A 1 137 ? -16.888 -67.725 -73.910 1.00 98.59 ? 137 PRO A CA 1 ATOM 992 C C . PRO A 1 137 ? -15.789 -67.714 -74.978 1.00 96.52 ? 137 PRO A C 1 ATOM 993 O O . PRO A 1 137 ? -15.782 -66.838 -75.847 1.00 93.02 ? 137 PRO A O 1 ATOM 994 C CB . PRO A 1 137 ? -18.224 -68.172 -74.529 1.00 102.45 ? 137 PRO A CB 1 ATOM 995 C CG . PRO A 1 137 ? -19.077 -66.924 -74.613 1.00 99.22 ? 137 PRO A CG 1 ATOM 996 C CD . PRO A 1 137 ? -18.610 -66.073 -73.492 1.00 95.86 ? 137 PRO A CD 1 ATOM 997 N N . GLY A 1 138 ? -14.864 -68.671 -74.898 1.00 99.16 ? 138 GLY A N 1 ATOM 998 C CA . GLY A 1 138 ? -13.777 -68.790 -75.873 1.00 98.28 ? 138 GLY A CA 1 ATOM 999 C C . GLY A 1 138 ? -12.543 -67.968 -75.543 1.00 94.40 ? 138 GLY A C 1 ATOM 1000 O O . GLY A 1 138 ? -11.482 -68.171 -76.138 1.00 94.39 ? 138 GLY A O 1 ATOM 1001 N N . ALA A 1 139 ? -12.687 -67.038 -74.598 1.00 91.74 ? 139 ALA A N 1 ATOM 1002 C CA . ALA A 1 139 ? -11.588 -66.188 -74.123 1.00 88.52 ? 139 ALA A CA 1 ATOM 1003 C C . ALA A 1 139 ? -10.493 -67.000 -73.416 1.00 91.19 ? 139 ALA A C 1 ATOM 1004 O O . ALA A 1 139 ? -10.771 -68.076 -72.872 1.00 95.36 ? 139 ALA A O 1 ATOM 1005 C CB . ALA A 1 139 ? -12.129 -65.102 -73.192 1.00 85.85 ? 139 ALA A CB 1 ATOM 1006 N N . PRO A 1 140 ? -9.241 -66.494 -73.431 1.00 89.33 ? 140 PRO A N 1 ATOM 1007 C CA . PRO A 1 140 ? -8.155 -67.172 -72.722 1.00 92.02 ? 140 PRO A CA 1 ATOM 1008 C C . PRO A 1 140 ? -8.149 -66.879 -71.217 1.00 92.18 ? 140 PRO A C 1 ATOM 1009 O O . PRO A 1 140 ? -8.610 -65.817 -70.781 1.00 89.20 ? 140 PRO A O 1 ATOM 1010 C CB . PRO A 1 140 ? -6.889 -66.614 -73.391 1.00 90.21 ? 140 PRO A CB 1 ATOM 1011 C CG . PRO A 1 140 ? -7.368 -65.799 -74.567 1.00 87.04 ? 140 PRO A CG 1 ATOM 1012 C CD . PRO A 1 140 ? -8.738 -65.355 -74.214 1.00 85.40 ? 140 PRO A CD 1 ATOM 1013 N N . SER A 1 141 ? -7.614 -67.821 -70.444 1.00 96.05 ? 141 SER A N 1 ATOM 1014 C CA . SER A 1 141 ? -7.671 -67.779 -68.979 1.00 97.32 ? 141 SER A CA 1 ATOM 1015 C C . SER A 1 141 ? -6.665 -66.833 -68.313 1.00 95.29 ? 141 SER A C 1 ATOM 1016 O O . SER A 1 141 ? -6.810 -66.517 -67.131 1.00 95.68 ? 141 SER A O 1 ATOM 1017 C CB . SER A 1 141 ? -7.527 -69.193 -68.398 1.00 102.74 ? 141 SER A CB 1 ATOM 1018 O OG . SER A 1 141 ? -6.243 -69.729 -68.665 1.00 104.59 ? 141 SER A OG 1 ATOM 1019 N N . TRP A 1 142 ? -5.657 -66.383 -69.060 1.00 93.64 ? 142 TRP A N 1 ATOM 1020 C CA . TRP A 1 142 ? -4.677 -65.436 -68.522 1.00 92.36 ? 142 TRP A CA 1 ATOM 1021 C C . TRP A 1 142 ? -5.274 -64.028 -68.386 1.00 88.30 ? 142 TRP A C 1 ATOM 1022 O O . TRP A 1 142 ? -4.667 -63.138 -67.784 1.00 87.34 ? 142 TRP A O 1 ATOM 1023 C CB . TRP A 1 142 ? -3.392 -65.420 -69.362 1.00 92.79 ? 142 TRP A CB 1 ATOM 1024 C CG . TRP A 1 142 ? -3.571 -64.847 -70.732 1.00 90.45 ? 142 TRP A CG 1 ATOM 1025 C CD1 . TRP A 1 142 ? -3.876 -65.532 -71.871 1.00 91.74 ? 142 TRP A CD1 1 ATOM 1026 C CD2 . TRP A 1 142 ? -3.458 -63.467 -71.112 1.00 87.32 ? 142 TRP A CD2 1 ATOM 1027 N NE1 . TRP A 1 142 ? -3.965 -64.666 -72.938 1.00 89.08 ? 142 TRP A NE1 1 ATOM 1028 C CE2 . TRP A 1 142 ? -3.713 -63.393 -72.498 1.00 86.18 ? 142 TRP A CE2 1 ATOM 1029 C CE3 . TRP A 1 142 ? -3.168 -62.287 -70.415 1.00 85.80 ? 142 TRP A CE3 1 ATOM 1030 C CZ2 . TRP A 1 142 ? -3.684 -62.185 -73.200 1.00 82.99 ? 142 TRP A CZ2 1 ATOM 1031 C CZ3 . TRP A 1 142 ? -3.144 -61.086 -71.115 1.00 82.69 ? 142 TRP A CZ3 1 ATOM 1032 C CH2 . TRP A 1 142 ? -3.398 -61.047 -72.490 1.00 81.23 ? 142 TRP A CH2 1 ATOM 1033 N N . LEU A 1 143 ? -6.467 -63.842 -68.945 1.00 86.41 ? 143 LEU A N 1 ATOM 1034 C CA . LEU A 1 143 ? -7.208 -62.591 -68.805 1.00 83.25 ? 143 LEU A CA 1 ATOM 1035 C C . LEU A 1 143 ? -8.039 -62.548 -67.513 1.00 84.55 ? 143 LEU A C 1 ATOM 1036 O O . LEU A 1 143 ? -8.748 -61.576 -67.260 1.00 82.68 ? 143 LEU A O 1 ATOM 1037 C CB . LEU A 1 143 ? -8.098 -62.359 -70.033 1.00 80.93 ? 143 LEU A CB 1 ATOM 1038 N N . ASP A 1 144 ? -7.936 -63.594 -66.695 1.00 88.30 ? 144 ASP A N 1 ATOM 1039 C CA . ASP A 1 144 ? -8.712 -63.702 -65.455 1.00 90.44 ? 144 ASP A CA 1 ATOM 1040 C C . ASP A 1 144 ? -8.210 -62.760 -64.356 1.00 90.13 ? 144 ASP A C 1 ATOM 1041 O O . ASP A 1 144 ? -8.971 -61.925 -63.859 1.00 89.20 ? 144 ASP A O 1 ATOM 1042 C CB . ASP A 1 144 ? -8.737 -65.151 -64.951 1.00 94.96 ? 144 ASP A CB 1 ATOM 1043 N N . LEU A 1 145 ? -6.934 -62.894 -63.988 1.00 91.33 ? 145 LEU A N 1 ATOM 1044 C CA . LEU A 1 145 ? -6.323 -62.048 -62.953 1.00 91.66 ? 145 LEU A CA 1 ATOM 1045 C C . LEU A 1 145 ? -6.440 -60.546 -63.250 1.00 88.14 ? 145 LEU A C 1 ATOM 1046 O O . LEU A 1 145 ? -6.694 -59.766 -62.331 1.00 88.61 ? 145 LEU A O 1 ATOM 1047 C CB . LEU A 1 145 ? -4.863 -62.446 -62.696 1.00 93.90 ? 145 LEU A CB 1 ATOM 1048 N N . PRO A 1 146 ? -6.255 -60.134 -64.525 1.00 85.06 ? 146 PRO A N 1 ATOM 1049 C CA . PRO A 1 146 ? -6.528 -58.747 -64.902 1.00 82.00 ? 146 PRO A CA 1 ATOM 1050 C C . PRO A 1 146 ? -7.960 -58.311 -64.602 1.00 81.25 ? 146 PRO A C 1 ATOM 1051 O O . PRO A 1 146 ? -8.177 -57.173 -64.183 1.00 80.65 ? 146 PRO A O 1 ATOM 1052 C CB . PRO A 1 146 ? -6.292 -58.750 -66.411 1.00 79.62 ? 146 PRO A CB 1 ATOM 1053 C CG . PRO A 1 146 ? -5.263 -59.776 -66.612 1.00 81.74 ? 146 PRO A CG 1 ATOM 1054 C CD . PRO A 1 146 ? -5.579 -60.857 -65.620 1.00 84.93 ? 146 PRO A CD 1 ATOM 1055 N N . ILE A 1 147 ? -8.921 -59.207 -64.820 1.00 81.90 ? 147 ILE A N 1 ATOM 1056 C CA . ILE A 1 147 ? -10.327 -58.932 -64.523 1.00 81.96 ? 147 ILE A CA 1 ATOM 1057 C C . ILE A 1 147 ? -10.543 -58.830 -63.021 1.00 84.80 ? 147 ILE A C 1 ATOM 1058 O O . ILE A 1 147 ? -11.193 -57.896 -62.553 1.00 84.72 ? 147 ILE A O 1 ATOM 1059 C CB . ILE A 1 147 ? -11.277 -59.993 -65.161 1.00 82.89 ? 147 ILE A CB 1 ATOM 1060 C CG1 . ILE A 1 147 ? -11.411 -59.764 -66.675 1.00 79.83 ? 147 ILE A CG1 1 ATOM 1061 C CG2 . ILE A 1 147 ? -12.653 -60.016 -64.485 1.00 84.92 ? 147 ILE A CG2 1 ATOM 1062 C CD1 . ILE A 1 147 ? -11.546 -58.312 -67.099 1.00 76.73 ? 147 ILE A CD1 1 ATOM 1063 N N . LYS A 1 148 ? -9.978 -59.777 -62.273 1.00 87.72 ? 148 LYS A N 1 ATOM 1064 C CA . LYS A 1 148 ? -10.075 -59.779 -60.809 1.00 91.00 ? 148 LYS A CA 1 ATOM 1065 C C . LYS A 1 148 ? -9.471 -58.516 -60.194 1.00 90.41 ? 148 LYS A C 1 ATOM 1066 O O . LYS A 1 148 ? -9.949 -58.032 -59.167 1.00 92.50 ? 148 LYS A O 1 ATOM 1067 C CB . LYS A 1 148 ? -9.419 -61.031 -60.216 1.00 94.41 ? 148 LYS A CB 1 ATOM 1068 N N . VAL A 1 149 ? -8.429 -57.987 -60.833 1.00 88.12 ? 149 VAL A N 1 ATOM 1069 C CA . VAL A 1 149 ? -7.796 -56.741 -60.405 1.00 87.82 ? 149 VAL A CA 1 ATOM 1070 C C . VAL A 1 149 ? -8.684 -55.534 -60.722 1.00 85.77 ? 149 VAL A C 1 ATOM 1071 O O . VAL A 1 149 ? -8.800 -54.615 -59.911 1.00 87.19 ? 149 VAL A O 1 ATOM 1072 C CB . VAL A 1 149 ? -6.383 -56.574 -61.033 1.00 86.83 ? 149 VAL A CB 1 ATOM 1073 C CG1 . VAL A 1 149 ? -5.873 -55.138 -60.903 1.00 86.30 ? 149 VAL A CG1 1 ATOM 1074 C CG2 . VAL A 1 149 ? -5.401 -57.545 -60.391 1.00 89.88 ? 149 VAL A CG2 1 ATOM 1075 N N . LEU A 1 150 ? -9.314 -55.550 -61.894 1.00 82.92 ? 150 LEU A N 1 ATOM 1076 C CA . LEU A 1 150 ? -10.140 -54.429 -62.346 1.00 80.99 ? 150 LEU A CA 1 ATOM 1077 C C . LEU A 1 150 ? -11.511 -54.402 -61.672 1.00 82.76 ? 150 LEU A C 1 ATOM 1078 O O . LEU A 1 150 ? -12.094 -53.334 -61.487 1.00 82.82 ? 150 LEU A O 1 ATOM 1079 C CB . LEU A 1 150 ? -10.291 -54.444 -63.871 1.00 77.64 ? 150 LEU A CB 1 ATOM 1080 N N . ASN A 1 151 ? -12.017 -55.576 -61.305 1.00 84.79 ? 151 ASN A N 1 ATOM 1081 C CA . ASN A 1 151 ? -13.318 -55.682 -60.647 1.00 87.37 ? 151 ASN A CA 1 ATOM 1082 C C . ASN A 1 151 ? -13.262 -55.272 -59.176 1.00 90.89 ? 151 ASN A C 1 ATOM 1083 O O . ASN A 1 151 ? -14.299 -55.107 -58.530 1.00 93.49 ? 151 ASN A O 1 ATOM 1084 C CB . ASN A 1 151 ? -13.900 -57.093 -60.802 1.00 89.03 ? 151 ASN A CB 1 ATOM 1085 C CG . ASN A 1 151 ? -14.355 -57.386 -62.220 1.00 86.10 ? 151 ASN A CG 1 ATOM 1086 N N . ALA A 1 152 ? -12.044 -55.104 -58.659 1.00 91.48 ? 152 ALA A N 1 ATOM 1087 C CA . ALA A 1 152 ? -11.820 -54.622 -57.295 1.00 94.95 ? 152 ALA A CA 1 ATOM 1088 C C . ALA A 1 152 ? -12.223 -53.156 -57.142 1.00 95.00 ? 152 ALA A C 1 ATOM 1089 O O . ALA A 1 152 ? -12.673 -52.745 -56.073 1.00 98.58 ? 152 ALA A O 1 ATOM 1090 C CB . ALA A 1 152 ? -10.365 -54.821 -56.891 1.00 95.65 ? 152 ALA A CB 1 ATOM 1091 N N . ASP A 1 153 ? -12.061 -52.379 -58.212 1.00 91.64 ? 153 ASP A N 1 ATOM 1092 C CA . ASP A 1 153 ? -12.461 -50.971 -58.229 1.00 91.82 ? 153 ASP A CA 1 ATOM 1093 C C . ASP A 1 153 ? -13.963 -50.814 -58.472 1.00 92.11 ? 153 ASP A C 1 ATOM 1094 O O . ASP A 1 153 ? -14.426 -50.874 -59.614 1.00 89.32 ? 153 ASP A O 1 ATOM 1095 C CB . ASP A 1 153 ? -11.663 -50.197 -59.293 1.00 88.64 ? 153 ASP A CB 1 ATOM 1096 C CG . ASP A 1 153 ? -12.010 -48.698 -59.338 1.00 89.16 ? 153 ASP A CG 1 ATOM 1097 O OD1 . ASP A 1 153 ? -13.042 -48.276 -58.772 1.00 91.21 ? 153 ASP A OD1 1 ATOM 1098 O OD2 . ASP A 1 153 ? -11.239 -47.937 -59.960 1.00 87.73 ? 153 ASP A OD2 1 ATOM 1099 N N . GLN A 1 154 ? -14.713 -50.593 -57.394 1.00 96.03 ? 154 GLN A N 1 ATOM 1100 C CA . GLN A 1 154 ? -16.150 -50.343 -57.489 1.00 97.31 ? 154 GLN A CA 1 ATOM 1101 C C . GLN A 1 154 ? -16.448 -48.924 -57.974 1.00 96.43 ? 154 GLN A C 1 ATOM 1102 O O . GLN A 1 154 ? -17.438 -48.701 -58.669 1.00 95.80 ? 154 GLN A O 1 ATOM 1103 C CB . GLN A 1 154 ? -16.834 -50.599 -56.147 1.00 102.45 ? 154 GLN A CB 1 ATOM 1104 C CG . GLN A 1 154 ? -16.939 -52.067 -55.784 1.00 104.09 ? 154 GLN A CG 1 ATOM 1105 N N . GLY A 1 155 ? -15.584 -47.978 -57.608 1.00 96.89 ? 155 GLY A N 1 ATOM 1106 C CA . GLY A 1 155 ? -15.733 -46.573 -58.000 1.00 96.59 ? 155 GLY A CA 1 ATOM 1107 C C . GLY A 1 155 ? -15.810 -46.343 -59.500 1.00 92.25 ? 155 GLY A C 1 ATOM 1108 O O . GLY A 1 155 ? -16.600 -45.518 -59.961 1.00 92.48 ? 155 GLY A O 1 ATOM 1109 N N . THR A 1 156 ? -14.981 -47.063 -60.257 1.00 88.68 ? 156 THR A N 1 ATOM 1110 C CA . THR A 1 156 ? -15.021 -47.025 -61.721 1.00 84.60 ? 156 THR A CA 1 ATOM 1111 C C . THR A 1 156 ? -16.246 -47.784 -62.210 1.00 84.08 ? 156 THR A C 1 ATOM 1112 O O . THR A 1 156 ? -17.002 -47.290 -63.050 1.00 83.07 ? 156 THR A O 1 ATOM 1113 C CB . THR A 1 156 ? -13.749 -47.639 -62.355 1.00 81.65 ? 156 THR A CB 1 ATOM 1114 O OG1 . THR A 1 156 ? -12.615 -46.819 -62.053 1.00 82.59 ? 156 THR A OG1 1 ATOM 1115 C CG2 . THR A 1 156 ? -13.885 -47.737 -63.859 1.00 77.82 ? 156 THR A CG2 1 ATOM 1116 N N . SER A 1 157 ? -16.436 -48.982 -61.662 1.00 85.31 ? 157 SER A N 1 ATOM 1117 C CA . SER A 1 157 ? -17.563 -49.838 -62.007 1.00 85.75 ? 157 SER A CA 1 ATOM 1118 C C . SER A 1 157 ? -18.891 -49.093 -61.853 1.00 88.19 ? 157 SER A C 1 ATOM 1119 O O . SER A 1 157 ? -19.849 -49.357 -62.581 1.00 88.00 ? 157 SER A O 1 ATOM 1120 C CB . SER A 1 157 ? -17.548 -51.091 -61.135 1.00 88.13 ? 157 SER A CB 1 ATOM 1121 O OG . SER A 1 157 ? -17.863 -52.240 -61.899 1.00 87.10 ? 157 SER A OG 1 ATOM 1122 N N . ALA A 1 158 ? -18.927 -48.155 -60.911 1.00 90.86 ? 158 ALA A N 1 ATOM 1123 C CA . ALA A 1 158 ? -20.090 -47.306 -60.700 1.00 93.77 ? 158 ALA A CA 1 ATOM 1124 C C . ALA A 1 158 ? -20.256 -46.316 -61.848 1.00 91.38 ? 158 ALA A C 1 ATOM 1125 O O . ALA A 1 158 ? -21.287 -46.308 -62.523 1.00 91.64 ? 158 ALA A O 1 ATOM 1126 C CB . ALA A 1 158 ? -19.975 -46.570 -59.374 1.00 97.83 ? 158 ALA A CB 1 ATOM 1127 N N . THR A 1 159 ? -19.227 -45.501 -62.072 1.00 89.48 ? 159 THR A N 1 ATOM 1128 C CA . THR A 1 159 ? -19.265 -44.435 -63.078 1.00 87.75 ? 159 THR A CA 1 ATOM 1129 C C . THR A 1 159 ? -19.513 -44.939 -64.502 1.00 84.06 ? 159 THR A C 1 ATOM 1130 O O . THR A 1 159 ? -20.047 -44.204 -65.334 1.00 83.63 ? 159 THR A O 1 ATOM 1131 C CB . THR A 1 159 ? -17.994 -43.544 -63.033 1.00 87.03 ? 159 THR A CB 1 ATOM 1132 O OG1 . THR A 1 159 ? -16.878 -44.314 -62.567 1.00 86.16 ? 159 THR A OG1 1 ATOM 1133 C CG2 . THR A 1 159 ? -18.201 -42.363 -62.090 1.00 91.42 ? 159 THR A CG2 1 ATOM 1134 N N . VAL A 1 160 ? -19.134 -46.189 -64.771 1.00 81.87 ? 160 VAL A N 1 ATOM 1135 C CA . VAL A 1 160 ? -19.419 -46.832 -66.059 1.00 78.96 ? 160 VAL A CA 1 ATOM 1136 C C . VAL A 1 160 ? -20.918 -47.088 -66.199 1.00 81.23 ? 160 VAL A C 1 ATOM 1137 O O . VAL A 1 160 ? -21.523 -46.704 -67.201 1.00 80.45 ? 160 VAL A O 1 ATOM 1138 C CB . VAL A 1 160 ? -18.608 -48.147 -66.252 1.00 76.89 ? 160 VAL A CB 1 ATOM 1139 C CG1 . VAL A 1 160 ? -19.217 -49.030 -67.345 1.00 75.05 ? 160 VAL A CG1 1 ATOM 1140 C CG2 . VAL A 1 160 ? -17.152 -47.829 -66.568 1.00 74.23 ? 160 VAL A CG2 1 ATOM 1141 N N . GLN A 1 161 ? -21.505 -47.719 -65.181 1.00 84.50 ? 161 GLN A N 1 ATOM 1142 C CA . GLN A 1 161 ? -22.938 -48.029 -65.159 1.00 87.73 ? 161 GLN A CA 1 ATOM 1143 C C . GLN A 1 161 ? -23.798 -46.785 -65.369 1.00 89.51 ? 161 GLN A C 1 ATOM 1144 O O . GLN A 1 161 ? -24.814 -46.839 -66.065 1.00 90.52 ? 161 GLN A O 1 ATOM 1145 C CB . GLN A 1 161 ? -23.321 -48.717 -63.846 1.00 91.82 ? 161 GLN A CB 1 ATOM 1146 C CG . GLN A 1 161 ? -22.836 -50.155 -63.728 1.00 91.18 ? 161 GLN A CG 1 ATOM 1147 C CD . GLN A 1 161 ? -22.907 -50.680 -62.306 1.00 95.21 ? 161 GLN A CD 1 ATOM 1148 O OE1 . GLN A 1 161 ? -23.966 -50.662 -61.673 1.00 99.58 ? 161 GLN A OE1 1 ATOM 1149 N NE2 . GLN A 1 161 ? -21.776 -51.156 -61.797 1.00 93.85 ? 161 GLN A NE2 1 ATOM 1150 N N . MET A 1 162 ? -23.377 -45.672 -64.769 1.00 90.25 ? 162 MET A N 1 ATOM 1151 C CA . MET A 1 162 ? -24.036 -44.381 -64.946 1.00 92.22 ? 162 MET A CA 1 ATOM 1152 C C . MET A 1 162 ? -24.162 -44.023 -66.429 1.00 89.31 ? 162 MET A C 1 ATOM 1153 O O . MET A 1 162 ? -25.257 -43.714 -66.907 1.00 91.37 ? 162 MET A O 1 ATOM 1154 C CB . MET A 1 162 ? -23.276 -43.285 -64.192 1.00 93.17 ? 162 MET A CB 1 ATOM 1155 N N . LEU A 1 163 ? -23.043 -44.090 -67.149 1.00 84.93 ? 163 LEU A N 1 ATOM 1156 C CA . LEU A 1 163 ? -22.999 -43.773 -68.578 1.00 82.11 ? 163 LEU A CA 1 ATOM 1157 C C . LEU A 1 163 ? -23.802 -44.765 -69.429 1.00 81.66 ? 163 LEU A C 1 ATOM 1158 O O . LEU A 1 163 ? -24.525 -44.363 -70.344 1.00 81.97 ? 163 LEU A O 1 ATOM 1159 C CB . LEU A 1 163 ? -21.548 -43.688 -69.067 1.00 78.08 ? 163 LEU A CB 1 ATOM 1160 N N . LEU A 1 164 ? -23.679 -46.052 -69.108 1.00 81.46 ? 164 LEU A N 1 ATOM 1161 C CA . LEU A 1 164 ? -24.338 -47.117 -69.863 1.00 81.55 ? 164 LEU A CA 1 ATOM 1162 C C . LEU A 1 164 ? -25.850 -47.179 -69.618 1.00 86.18 ? 164 LEU A C 1 ATOM 1163 O O . LEU A 1 164 ? -26.629 -47.084 -70.566 1.00 86.78 ? 164 LEU A O 1 ATOM 1164 C CB . LEU A 1 164 ? -23.685 -48.472 -69.568 1.00 80.41 ? 164 LEU A CB 1 ATOM 1165 N N . ASN A 1 165 ? -26.254 -47.327 -68.355 1.00 89.92 ? 165 ASN A N 1 ATOM 1166 C CA . ASN A 1 165 ? -27.671 -47.492 -67.995 1.00 95.35 ? 165 ASN A CA 1 ATOM 1167 C C . ASN A 1 165 ? -28.565 -46.283 -68.276 1.00 97.93 ? 165 ASN A C 1 ATOM 1168 O O . ASN A 1 165 ? -29.731 -46.453 -68.637 1.00 101.40 ? 165 ASN A O 1 ATOM 1169 C CB . ASN A 1 165 ? -27.837 -47.870 -66.516 1.00 99.15 ? 165 ASN A CB 1 ATOM 1170 C CG . ASN A 1 165 ? -27.278 -49.244 -66.177 1.00 98.63 ? 165 ASN A CG 1 ATOM 1171 O OD1 . ASN A 1 165 ? -26.206 -49.627 -66.649 1.00 94.62 ? 165 ASN A OD1 1 ATOM 1172 N ND2 . ASN A 1 165 ? -28.007 -49.986 -65.336 1.00 103.87 ? 165 ASN A ND2 1 ATOM 1173 N N . ASP A 1 166 ? -28.031 -45.073 -68.100 1.00 96.91 ? 166 ASP A N 1 ATOM 1174 C CA . ASP A 1 166 ? -28.875 -43.872 -68.097 1.00 100.39 ? 166 ASP A CA 1 ATOM 1175 C C . ASP A 1 166 ? -28.396 -42.680 -68.939 1.00 97.87 ? 166 ASP A C 1 ATOM 1176 O O . ASP A 1 166 ? -29.226 -41.957 -69.503 1.00 100.19 ? 166 ASP A O 1 ATOM 1177 C CB . ASP A 1 166 ? -29.154 -43.420 -66.658 1.00 104.90 ? 166 ASP A CB 1 ATOM 1178 N N . THR A 1 167 ? -27.083 -42.470 -69.023 1.00 93.66 ? 167 THR A N 1 ATOM 1179 C CA . THR A 1 167 ? -26.549 -41.276 -69.697 1.00 91.92 ? 167 THR A CA 1 ATOM 1180 C C . THR A 1 167 ? -26.581 -41.352 -71.226 1.00 89.06 ? 167 THR A C 1 ATOM 1181 O O . THR A 1 167 ? -27.006 -40.394 -71.876 1.00 90.28 ? 167 THR A O 1 ATOM 1182 C CB . THR A 1 167 ? -25.132 -40.902 -69.202 1.00 89.55 ? 167 THR A CB 1 ATOM 1183 O OG1 . THR A 1 167 ? -25.143 -40.792 -67.774 1.00 92.75 ? 167 THR A OG1 1 ATOM 1184 C CG2 . THR A 1 167 ? -24.669 -39.572 -69.798 1.00 88.90 ? 167 THR A CG2 1 ATOM 1185 N N . CYS A 1 168 ? -26.148 -42.481 -71.794 1.00 85.72 ? 168 CYS A N 1 ATOM 1186 C CA . CYS A 1 168 ? -26.109 -42.638 -73.257 1.00 83.16 ? 168 CYS A CA 1 ATOM 1187 C C . CYS A 1 168 ? -27.451 -42.333 -73.941 1.00 85.91 ? 168 CYS A C 1 ATOM 1188 O O . CYS A 1 168 ? -27.469 -41.589 -74.915 1.00 85.17 ? 168 CYS A O 1 ATOM 1189 C CB . CYS A 1 168 ? -25.541 -44.004 -73.694 1.00 80.25 ? 168 CYS A CB 1 ATOM 1190 S SG . CYS A 1 168 ? -26.762 -45.304 -74.118 1.00 83.67 ? 168 CYS A SG 1 ATOM 1191 N N . PRO A 1 169 ? -28.573 -42.894 -73.431 1.00 89.52 ? 169 PRO A N 1 ATOM 1192 C CA . PRO A 1 169 ? -29.844 -42.621 -74.106 1.00 92.88 ? 169 PRO A CA 1 ATOM 1193 C C . PRO A 1 169 ? -30.353 -41.191 -73.893 1.00 95.94 ? 169 PRO A C 1 ATOM 1194 O O . PRO A 1 169 ? -30.993 -40.631 -74.787 1.00 97.47 ? 169 PRO A O 1 ATOM 1195 C CB . PRO A 1 169 ? -30.802 -43.637 -73.475 1.00 96.77 ? 169 PRO A CB 1 ATOM 1196 C CG . PRO A 1 169 ? -30.242 -43.892 -72.126 1.00 96.84 ? 169 PRO A CG 1 ATOM 1197 C CD . PRO A 1 169 ? -28.752 -43.820 -72.293 1.00 91.35 ? 169 PRO A CD 1 ATOM 1198 N N . LEU A 1 170 ? -30.069 -40.613 -72.723 1.00 97.05 ? 170 LEU A N 1 ATOM 1199 C CA . LEU A 1 170 ? -30.420 -39.220 -72.430 1.00 100.08 ? 170 LEU A CA 1 ATOM 1200 C C . LEU A 1 170 ? -29.621 -38.280 -73.333 1.00 96.86 ? 170 LEU A C 1 ATOM 1201 O O . LEU A 1 170 ? -29.979 -37.113 -73.518 1.00 99.71 ? 170 LEU A O 1 ATOM 1202 C CB . LEU A 1 170 ? -30.168 -38.894 -70.954 1.00 102.31 ? 170 LEU A CB 1 ATOM 1203 N N . PHE A 1 171 ? -28.544 -38.817 -73.898 1.00 91.22 ? 171 PHE A N 1 ATOM 1204 C CA . PHE A 1 171 ? -27.682 -38.093 -74.813 1.00 87.98 ? 171 PHE A CA 1 ATOM 1205 C C . PHE A 1 171 ? -28.067 -38.383 -76.260 1.00 86.49 ? 171 PHE A C 1 ATOM 1206 O O . PHE A 1 171 ? -28.323 -37.457 -77.028 1.00 87.79 ? 171 PHE A O 1 ATOM 1207 C CB . PHE A 1 171 ? -26.222 -38.463 -74.544 1.00 83.74 ? 171 PHE A CB 1 ATOM 1208 C CG . PHE A 1 171 ? -25.240 -37.780 -75.446 1.00 81.13 ? 171 PHE A CG 1 ATOM 1209 C CD1 . PHE A 1 171 ? -25.229 -36.392 -75.569 1.00 83.32 ? 171 PHE A CD1 1 ATOM 1210 C CD2 . PHE A 1 171 ? -24.304 -38.526 -76.155 1.00 76.97 ? 171 PHE A CD2 1 ATOM 1211 C CE1 . PHE A 1 171 ? -24.310 -35.755 -76.400 1.00 81.65 ? 171 PHE A CE1 1 ATOM 1212 C CE2 . PHE A 1 171 ? -23.378 -37.901 -76.992 1.00 75.35 ? 171 PHE A CE2 1 ATOM 1213 C CZ . PHE A 1 171 ? -23.380 -36.510 -77.112 1.00 77.95 ? 171 PHE A CZ 1 ATOM 1214 N N . VAL A 1 172 ? -28.118 -39.669 -76.615 1.00 84.19 ? 172 VAL A N 1 ATOM 1215 C CA . VAL A 1 172 ? -28.431 -40.120 -77.981 1.00 82.79 ? 172 VAL A CA 1 ATOM 1216 C C . VAL A 1 172 ? -29.803 -39.635 -78.466 1.00 86.96 ? 172 VAL A C 1 ATOM 1217 O O . VAL A 1 172 ? -29.911 -39.099 -79.573 1.00 86.91 ? 172 VAL A O 1 ATOM 1218 C CB . VAL A 1 172 ? -28.317 -41.664 -78.129 1.00 80.82 ? 172 VAL A CB 1 ATOM 1219 C CG1 . VAL A 1 172 ? -28.808 -42.125 -79.501 1.00 80.82 ? 172 VAL A CG1 1 ATOM 1220 C CG2 . VAL A 1 172 ? -26.881 -42.119 -77.900 1.00 76.38 ? 172 VAL A CG2 1 ATOM 1221 N N . ARG A 1 173 ? -30.836 -39.818 -77.640 1.00 90.78 ? 173 ARG A N 1 ATOM 1222 C CA . ARG A 1 173 ? -32.182 -39.324 -77.958 1.00 95.63 ? 173 ARG A CA 1 ATOM 1223 C C . ARG A 1 173 ? -32.150 -37.821 -78.202 1.00 96.96 ? 173 ARG A C 1 ATOM 1224 O O . ARG A 1 173 ? -32.992 -37.280 -78.923 1.00 100.06 ? 173 ARG A O 1 ATOM 1225 C CB . ARG A 1 173 ? -33.176 -39.658 -76.844 1.00 100.41 ? 173 ARG A CB 1 ATOM 1226 N N . GLY A 1 174 ? -31.160 -37.165 -77.600 1.00 94.85 ? 174 GLY A N 1 ATOM 1227 C CA . GLY A 1 174 ? -30.886 -35.756 -77.840 1.00 95.93 ? 174 GLY A CA 1 ATOM 1228 C C . GLY A 1 174 ? -30.335 -35.499 -79.230 1.00 92.96 ? 174 GLY A C 1 ATOM 1229 O O . GLY A 1 174 ? -30.779 -34.571 -79.905 1.00 95.68 ? 174 GLY A O 1 ATOM 1230 N N . LEU A 1 175 ? -29.378 -36.320 -79.663 1.00 87.84 ? 175 LEU A N 1 ATOM 1231 C CA . LEU A 1 175 ? -28.766 -36.169 -80.991 1.00 85.12 ? 175 LEU A CA 1 ATOM 1232 C C . LEU A 1 175 ? -29.755 -36.389 -82.137 1.00 87.06 ? 175 LEU A C 1 ATOM 1233 O O . LEU A 1 175 ? -29.838 -35.567 -83.054 1.00 88.24 ? 175 LEU A O 1 ATOM 1234 C CB . LEU A 1 175 ? -27.551 -37.089 -81.150 1.00 79.94 ? 175 LEU A CB 1 ATOM 1235 C CG . LEU A 1 175 ? -26.248 -36.691 -80.449 1.00 77.42 ? 175 LEU A CG 1 ATOM 1236 C CD1 . LEU A 1 175 ? -25.297 -37.883 -80.376 1.00 72.80 ? 175 LEU A CD1 1 ATOM 1237 C CD2 . LEU A 1 175 ? -25.580 -35.500 -81.128 1.00 77.05 ? 175 LEU A CD2 1 ATOM 1238 N N . LEU A 1 176 ? -30.498 -37.495 -82.076 1.00 87.82 ? 176 LEU A N 1 ATOM 1239 C CA . LEU A 1 176 ? -31.539 -37.804 -83.063 1.00 90.50 ? 176 LEU A CA 1 ATOM 1240 C C . LEU A 1 176 ? -32.482 -36.628 -83.258 1.00 95.52 ? 176 LEU A C 1 ATOM 1241 O O . LEU A 1 176 ? -32.773 -36.245 -84.389 1.00 96.71 ? 176 LEU A O 1 ATOM 1242 C CB . LEU A 1 176 ? -32.345 -39.041 -82.652 1.00 92.08 ? 176 LEU A CB 1 ATOM 1243 C CG . LEU A 1 176 ? -31.682 -40.410 -82.793 1.00 88.37 ? 176 LEU A CG 1 ATOM 1244 N N . GLU A 1 177 ? -32.946 -36.059 -82.147 1.00 98.90 ? 177 GLU A N 1 ATOM 1245 C CA . GLU A 1 177 ? -33.828 -34.894 -82.177 1.00 104.50 ? 177 GLU A CA 1 ATOM 1246 C C . GLU A 1 177 ? -33.115 -33.640 -82.690 1.00 104.00 ? 177 GLU A C 1 ATOM 1247 O O . GLU A 1 177 ? -33.749 -32.768 -83.294 1.00 108.00 ? 177 GLU A O 1 ATOM 1248 C CB . GLU A 1 177 ? -34.432 -34.633 -80.793 1.00 108.44 ? 177 GLU A CB 1 ATOM 1249 N N . ALA A 1 178 ? -31.806 -33.557 -82.451 1.00 99.64 ? 178 ALA A N 1 ATOM 1250 C CA . ALA A 1 178 ? -31.018 -32.401 -82.871 1.00 99.34 ? 178 ALA A CA 1 ATOM 1251 C C . ALA A 1 178 ? -30.799 -32.412 -84.376 1.00 97.86 ? 178 ALA A C 1 ATOM 1252 O O . ALA A 1 178 ? -31.295 -31.534 -85.085 1.00 101.28 ? 178 ALA A O 1 ATOM 1253 C CB . ALA A 1 178 ? -29.687 -32.356 -82.134 1.00 95.86 ? 178 ALA A CB 1 ATOM 1254 N N . GLY A 1 179 ? -30.075 -33.419 -84.859 1.00 93.13 ? 179 GLY A N 1 ATOM 1255 C CA . GLY A 1 179 ? -29.750 -33.522 -86.278 1.00 91.67 ? 179 GLY A CA 1 ATOM 1256 C C . GLY A 1 179 ? -30.777 -34.272 -87.106 1.00 93.21 ? 179 GLY A C 1 ATOM 1257 O O . GLY A 1 179 ? -30.420 -35.122 -87.922 1.00 90.61 ? 179 GLY A O 1 ATOM 1258 N N . LYS A 1 180 ? -32.053 -33.958 -86.900 1.00 98.00 ? 180 LYS A N 1 ATOM 1259 C CA . LYS A 1 180 ? -33.124 -34.567 -87.676 1.00 100.54 ? 180 LYS A CA 1 ATOM 1260 C C . LYS A 1 180 ? -32.992 -34.166 -89.140 1.00 101.01 ? 180 LYS A C 1 ATOM 1261 O O . LYS A 1 180 ? -33.142 -35.002 -90.030 1.00 100.41 ? 180 LYS A O 1 ATOM 1262 C CB . LYS A 1 180 ? -34.492 -34.161 -87.125 1.00 106.44 ? 180 LYS A CB 1 ATOM 1263 N N . SER A 1 181 ? -32.680 -32.890 -89.374 1.00 102.49 ? 181 SER A N 1 ATOM 1264 C CA . SER A 1 181 ? -32.554 -32.337 -90.726 1.00 103.62 ? 181 SER A CA 1 ATOM 1265 C C . SER A 1 181 ? -31.353 -32.897 -91.496 1.00 98.83 ? 181 SER A C 1 ATOM 1266 O O . SER A 1 181 ? -31.443 -33.132 -92.705 1.00 99.29 ? 181 SER A O 1 ATOM 1267 C CB . SER A 1 181 ? -32.500 -30.805 -90.682 1.00 106.92 ? 181 SER A CB 1 ATOM 1268 N N . ASP A 1 182 ? -30.237 -33.104 -90.796 1.00 94.74 ? 182 ASP A N 1 ATOM 1269 C CA . ASP A 1 182 ? -29.042 -33.706 -91.400 1.00 90.52 ? 182 ASP A CA 1 ATOM 1270 C C . ASP A 1 182 ? -29.185 -35.202 -91.660 1.00 88.31 ? 182 ASP A C 1 ATOM 1271 O O . ASP A 1 182 ? -28.738 -35.695 -92.694 1.00 86.97 ? 182 ASP A O 1 ATOM 1272 C CB . ASP A 1 182 ? -27.788 -33.439 -90.556 1.00 87.44 ? 182 ASP A CB 1 ATOM 1273 C CG . ASP A 1 182 ? -26.801 -32.507 -91.245 1.00 87.45 ? 182 ASP A CG 1 ATOM 1274 O OD1 . ASP A 1 182 ? -26.998 -32.189 -92.438 1.00 89.39 ? 182 ASP A OD1 1 ATOM 1275 O OD2 . ASP A 1 182 ? -25.817 -32.098 -90.592 1.00 85.86 ? 182 ASP A OD2 1 ATOM 1276 N N . LEU A 1 183 ? -29.803 -35.918 -90.723 1.00 88.44 ? 183 LEU A N 1 ATOM 1277 C CA . LEU A 1 183 ? -29.982 -37.363 -90.858 1.00 87.12 ? 183 LEU A CA 1 ATOM 1278 C C . LEU A 1 183 ? -31.039 -37.724 -91.909 1.00 90.65 ? 183 LEU A C 1 ATOM 1279 O O . LEU A 1 183 ? -31.010 -38.824 -92.472 1.00 89.80 ? 183 LEU A O 1 ATOM 1280 C CB . LEU A 1 183 ? -30.308 -38.006 -89.504 1.00 86.68 ? 183 LEU A CB 1 ATOM 1281 N N . GLU A 1 184 ? -31.955 -36.793 -92.180 1.00 82.79 ? 184 GLU A N 1 ATOM 1282 C CA . GLU A 1 184 ? -33.012 -37.014 -93.173 1.00 83.45 ? 184 GLU A CA 1 ATOM 1283 C C . GLU A 1 184 ? -32.657 -36.521 -94.588 1.00 81.98 ? 184 GLU A C 1 ATOM 1284 O O . GLU A 1 184 ? -33.477 -36.613 -95.504 1.00 82.71 ? 184 GLU A O 1 ATOM 1285 C CB . GLU A 1 184 ? -34.331 -36.394 -92.698 1.00 88.87 ? 184 GLU A CB 1 ATOM 1286 N N . LYS A 1 185 ? -31.434 -36.016 -94.758 1.00 80.26 ? 185 LYS A N 1 ATOM 1287 C CA . LYS A 1 185 ? -30.982 -35.426 -96.024 1.00 79.44 ? 185 LYS A CA 1 ATOM 1288 C C . LYS A 1 185 ? -30.940 -36.434 -97.173 1.00 75.76 ? 185 LYS A C 1 ATOM 1289 O O . LYS A 1 185 ? -30.302 -37.488 -97.069 1.00 72.20 ? 185 LYS A O 1 ATOM 1290 C CB . LYS A 1 185 ? -29.612 -34.761 -95.847 1.00 78.64 ? 185 LYS A CB 1 ATOM 1291 C CG . LYS A 1 185 ? -29.279 -33.708 -96.899 1.00 80.06 ? 185 LYS A CG 1 ATOM 1292 C CD . LYS A 1 185 ? -27.950 -33.027 -96.604 1.00 80.00 ? 185 LYS A CD 1 ATOM 1293 N N . GLN A 1 186 ? -31.619 -36.091 -98.267 1.00 77.13 ? 186 GLN A N 1 ATOM 1294 C CA . GLN A 1 186 ? -31.736 -36.961 -99.440 1.00 74.38 ? 186 GLN A CA 1 ATOM 1295 C C . GLN A 1 186 ? -30.803 -36.514 -100.560 1.00 72.76 ? 186 GLN A C 1 ATOM 1296 O O . GLN A 1 186 ? -30.733 -35.327 -100.880 1.00 75.42 ? 186 GLN A O 1 ATOM 1297 C CB . GLN A 1 186 ? -33.183 -36.979 -99.945 1.00 77.45 ? 186 GLN A CB 1 ATOM 1298 C CG . GLN A 1 186 ? -34.208 -37.546 -98.963 1.00 79.40 ? 186 GLN A CG 1 ATOM 1299 C CD . GLN A 1 186 ? -34.063 -39.045 -98.739 1.00 76.21 ? 186 GLN A CD 1 ATOM 1300 O OE1 . GLN A 1 186 ? -33.713 -39.797 -99.651 1.00 73.15 ? 186 GLN A OE1 1 ATOM 1301 N NE2 . GLN A 1 186 ? -34.340 -39.485 -97.517 1.00 77.32 ? 186 GLN A NE2 1 ATOM 1302 N N . GLU A 1 187 ? -30.085 -37.466 -101.151 1.00 68.83 ? 187 GLU A N 1 ATOM 1303 C CA . GLU A 1 187 ? -29.135 -37.155 -102.224 1.00 67.54 ? 187 GLU A CA 1 ATOM 1304 C C . GLU A 1 187 ? -29.362 -37.991 -103.477 1.00 65.60 ? 187 GLU A C 1 ATOM 1305 O O . GLU A 1 187 ? -29.596 -39.200 -103.394 1.00 63.71 ? 187 GLU A O 1 ATOM 1306 C CB . GLU A 1 187 ? -27.682 -37.306 -101.751 1.00 64.96 ? 187 GLU A CB 1 ATOM 1307 C CG . GLU A 1 187 ? -27.264 -36.371 -100.617 1.00 67.83 ? 187 GLU A CG 1 ATOM 1308 C CD . GLU A 1 187 ? -27.509 -34.897 -100.917 1.00 72.73 ? 187 GLU A CD 1 ATOM 1309 O OE1 . GLU A 1 187 ? -27.910 -34.160 -99.988 1.00 76.08 ? 187 GLU A OE1 1 ATOM 1310 O OE2 . GLU A 1 187 ? -27.307 -34.473 -102.078 1.00 73.72 ? 187 GLU A OE2 1 ATOM 1311 N N . LYS A 1 188 ? -29.276 -37.335 -104.633 1.00 66.56 ? 188 LYS A N 1 ATOM 1312 C CA . LYS A 1 188 ? -29.468 -37.983 -105.932 1.00 65.07 ? 188 LYS A CA 1 ATOM 1313 C C . LYS A 1 188 ? -28.240 -38.818 -106.349 1.00 61.00 ? 188 LYS A C 1 ATOM 1314 O O . LYS A 1 188 ? -27.120 -38.306 -106.424 1.00 60.41 ? 188 LYS A O 1 ATOM 1315 C CB . LYS A 1 188 ? -29.793 -36.937 -107.009 1.00 68.16 ? 188 LYS A CB 1 ATOM 1316 C CG . LYS A 1 188 ? -30.835 -35.900 -106.605 1.00 72.63 ? 188 LYS A CG 1 ATOM 1317 N N . PRO A 1 189 ? -28.440 -40.117 -106.605 1.00 58.54 ? 189 PRO A N 1 ATOM 1318 C CA . PRO A 1 189 ? -27.326 -40.853 -107.181 1.00 55.46 ? 189 PRO A CA 1 ATOM 1319 C C . PRO A 1 189 ? -27.100 -40.484 -108.650 1.00 56.06 ? 189 PRO A C 1 ATOM 1320 O O . PRO A 1 189 ? -28.043 -40.128 -109.362 1.00 58.26 ? 189 PRO A O 1 ATOM 1321 C CB . PRO A 1 189 ? -27.763 -42.316 -107.050 1.00 53.55 ? 189 PRO A CB 1 ATOM 1322 C CG . PRO A 1 189 ? -29.235 -42.272 -106.947 1.00 56.00 ? 189 PRO A CG 1 ATOM 1323 C CD . PRO A 1 189 ? -29.561 -41.000 -106.239 1.00 58.77 ? 189 PRO A CD 1 ATOM 1324 N N . VAL A 1 190 ? -25.844 -40.554 -109.079 1.00 54.39 ? 190 VAL A N 1 ATOM 1325 C CA . VAL A 1 190 ? -25.473 -40.365 -110.480 1.00 54.53 ? 190 VAL A CA 1 ATOM 1326 C C . VAL A 1 190 ? -24.940 -41.712 -110.957 1.00 51.74 ? 190 VAL A C 1 ATOM 1327 O O . VAL A 1 190 ? -24.286 -42.424 -110.188 1.00 49.71 ? 190 VAL A O 1 ATOM 1328 C CB . VAL A 1 190 ? -24.368 -39.287 -110.652 1.00 55.50 ? 190 VAL A CB 1 ATOM 1329 C CG1 . VAL A 1 190 ? -24.494 -38.624 -112.005 1.00 57.39 ? 190 VAL A CG1 1 ATOM 1330 C CG2 . VAL A 1 190 ? -24.418 -38.244 -109.531 1.00 56.78 ? 190 VAL A CG2 1 ATOM 1331 N N . ALA A 1 191 ? -25.208 -42.070 -112.209 1.00 51.92 ? 191 ALA A N 1 ATOM 1332 C CA . ALA A 1 191 ? -24.824 -43.389 -112.687 1.00 49.87 ? 191 ALA A CA 1 ATOM 1333 C C . ALA A 1 191 ? -24.205 -43.423 -114.085 1.00 50.38 ? 191 ALA A C 1 ATOM 1334 O O . ALA A 1 191 ? -24.519 -42.589 -114.932 1.00 52.53 ? 191 ALA A O 1 ATOM 1335 C CB . ALA A 1 191 ? -26.003 -44.350 -112.586 1.00 49.93 ? 191 ALA A CB 1 ATOM 1336 N N . TRP A 1 192 ? -23.318 -44.400 -114.298 1.00 48.83 ? 192 TRP A N 1 ATOM 1337 C CA . TRP A 1 192 ? -22.631 -44.623 -115.580 1.00 49.49 ? 192 TRP A CA 1 ATOM 1338 C C . TRP A 1 192 ? -22.195 -46.081 -115.774 1.00 47.99 ? 192 TRP A C 1 ATOM 1339 O O . TRP A 1 192 ? -22.089 -46.839 -114.800 1.00 46.63 ? 192 TRP A O 1 ATOM 1340 C CB . TRP A 1 192 ? -21.444 -43.658 -115.765 1.00 50.45 ? 192 TRP A CB 1 ATOM 1341 C CG . TRP A 1 192 ? -20.252 -43.848 -114.854 1.00 48.87 ? 192 TRP A CG 1 ATOM 1342 C CD1 . TRP A 1 192 ? -19.070 -44.455 -115.170 1.00 48.44 ? 192 TRP A CD1 1 ATOM 1343 C CD2 . TRP A 1 192 ? -20.112 -43.381 -113.506 1.00 48.73 ? 192 TRP A CD2 1 ATOM 1344 N NE1 . TRP A 1 192 ? -18.209 -44.414 -114.096 1.00 47.79 ? 192 TRP A NE1 1 ATOM 1345 C CE2 . TRP A 1 192 ? -18.826 -43.760 -113.063 1.00 48.11 ? 192 TRP A CE2 1 ATOM 1346 C CE3 . TRP A 1 192 ? -20.953 -42.691 -112.624 1.00 49.39 ? 192 TRP A CE3 1 ATOM 1347 C CZ2 . TRP A 1 192 ? -18.363 -43.468 -111.779 1.00 47.99 ? 192 TRP A CZ2 1 ATOM 1348 C CZ3 . TRP A 1 192 ? -20.494 -42.406 -111.351 1.00 48.76 ? 192 TRP A CZ3 1 ATOM 1349 C CH2 . TRP A 1 192 ? -19.210 -42.789 -110.942 1.00 48.32 ? 192 TRP A CH2 1 ATOM 1350 N N . LEU A 1 193 ? -21.952 -46.468 -117.028 1.00 48.74 ? 193 LEU A N 1 ATOM 1351 C CA . LEU A 1 193 ? -21.579 -47.850 -117.360 1.00 47.65 ? 193 LEU A CA 1 ATOM 1352 C C . LEU A 1 193 ? -20.144 -47.984 -117.880 1.00 47.73 ? 193 LEU A C 1 ATOM 1353 O O . LEU A 1 193 ? -19.492 -46.996 -118.218 1.00 49.02 ? 193 LEU A O 1 ATOM 1354 C CB . LEU A 1 193 ? -22.552 -48.444 -118.387 1.00 48.79 ? 193 LEU A CB 1 ATOM 1355 C CG . LEU A 1 193 ? -24.064 -48.299 -118.188 1.00 49.79 ? 193 LEU A CG 1 ATOM 1356 C CD1 . LEU A 1 193 ? -24.821 -48.935 -119.337 1.00 51.38 ? 193 LEU A CD1 1 ATOM 1357 C CD2 . LEU A 1 193 ? -24.505 -48.914 -116.880 1.00 48.88 ? 193 LEU A CD2 1 ATOM 1358 N N . SER A 1 194 ? -19.664 -49.223 -117.926 1.00 46.86 ? 194 SER A N 1 ATOM 1359 C CA . SER A 1 194 ? -18.384 -49.566 -118.524 1.00 47.51 ? 194 SER A CA 1 ATOM 1360 C C . SER A 1 194 ? -18.326 -51.075 -118.628 1.00 47.11 ? 194 SER A C 1 ATOM 1361 O O . SER A 1 194 ? -19.255 -51.759 -118.207 1.00 46.51 ? 194 SER A O 1 ATOM 1362 C CB . SER A 1 194 ? -17.237 -49.091 -117.652 1.00 47.19 ? 194 SER A CB 1 ATOM 1363 O OG . SER A 1 194 ? -17.055 -49.987 -116.575 1.00 46.42 ? 194 SER A OG 1 ATOM 1364 N N . SER A 1 195 ? -17.238 -51.597 -119.182 1.00 48.10 ? 195 SER A N 1 ATOM 1365 C CA . SER A 1 195 ? -17.039 -53.042 -119.222 1.00 48.25 ? 195 SER A CA 1 ATOM 1366 C C . SER A 1 195 ? -15.574 -53.433 -119.141 1.00 49.13 ? 195 SER A C 1 ATOM 1367 O O . SER A 1 195 ? -14.675 -52.647 -119.456 1.00 50.24 ? 195 SER A O 1 ATOM 1368 C CB . SER A 1 195 ? -17.696 -53.669 -120.461 1.00 49.73 ? 195 SER A CB 1 ATOM 1369 O OG . SER A 1 195 ? -16.843 -53.656 -121.594 1.00 51.74 ? 195 SER A OG 1 ATOM 1370 N N . VAL A 1 196 ? -15.354 -54.665 -118.711 1.00 49.26 ? 196 VAL A N 1 ATOM 1371 C CA . VAL A 1 196 ? -14.023 -55.215 -118.540 1.00 50.66 ? 196 VAL A CA 1 ATOM 1372 C C . VAL A 1 196 ? -14.086 -56.640 -119.057 1.00 51.84 ? 196 VAL A C 1 ATOM 1373 O O . VAL A 1 196 ? -15.155 -57.256 -119.014 1.00 51.15 ? 196 VAL A O 1 ATOM 1374 C CB . VAL A 1 196 ? -13.608 -55.203 -117.040 1.00 49.90 ? 196 VAL A CB 1 ATOM 1375 C CG1 . VAL A 1 196 ? -12.217 -55.818 -116.830 1.00 51.88 ? 196 VAL A CG1 1 ATOM 1376 C CG2 . VAL A 1 196 ? -13.646 -53.770 -116.477 1.00 49.01 ? 196 VAL A CG2 1 ATOM 1377 N N . PRO A 1 197 ? -12.956 -57.163 -119.576 1.00 54.09 ? 197 PRO A N 1 ATOM 1378 C CA . PRO A 1 197 ? -12.919 -58.592 -119.899 1.00 55.67 ? 197 PRO A CA 1 ATOM 1379 C C . PRO A 1 197 ? -13.110 -59.425 -118.639 1.00 54.98 ? 197 PRO A C 1 ATOM 1380 O O . PRO A 1 197 ? -12.388 -59.242 -117.662 1.00 54.87 ? 197 PRO A O 1 ATOM 1381 C CB . PRO A 1 197 ? -11.508 -58.796 -120.470 1.00 58.41 ? 197 PRO A CB 1 ATOM 1382 C CG . PRO A 1 197 ? -10.730 -57.578 -120.069 1.00 57.98 ? 197 PRO A CG 1 ATOM 1383 C CD . PRO A 1 197 ? -11.723 -56.471 -120.001 1.00 55.62 ? 197 PRO A CD 1 ATOM 1384 N N . SER A 1 198 ? -14.099 -60.310 -118.656 1.00 54.99 ? 198 SER A N 1 ATOM 1385 C CA . SER A 1 198 ? -14.345 -61.217 -117.538 1.00 54.98 ? 198 SER A CA 1 ATOM 1386 C C . SER A 1 198 ? -13.136 -62.120 -117.277 1.00 57.48 ? 198 SER A C 1 ATOM 1387 O O . SER A 1 198 ? -12.264 -62.274 -118.140 1.00 59.46 ? 198 SER A O 1 ATOM 1388 C CB . SER A 1 198 ? -15.596 -62.059 -117.821 1.00 55.45 ? 198 SER A CB 1 ATOM 1389 O OG . SER A 1 198 ? -15.702 -63.186 -116.964 1.00 56.63 ? 198 SER A OG 1 ATOM 1390 N N . SER A 1 199 ? -13.087 -62.705 -116.081 1.00 57.65 ? 199 SER A N 1 ATOM 1391 C CA . SER A 1 199 ? -12.099 -63.739 -115.763 1.00 60.67 ? 199 SER A CA 1 ATOM 1392 C C . SER A 1 199 ? -12.294 -65.008 -116.612 1.00 63.36 ? 199 SER A C 1 ATOM 1393 O O . SER A 1 199 ? -11.448 -65.900 -116.596 1.00 66.48 ? 199 SER A O 1 ATOM 1394 C CB . SER A 1 199 ? -12.136 -64.081 -114.271 1.00 60.53 ? 199 SER A CB 1 ATOM 1395 N N . ALA A 1 200 ? -13.401 -65.062 -117.354 1.00 62.47 ? 200 ALA A N 1 ATOM 1396 C CA . ALA A 1 200 ? -13.713 -66.171 -118.257 1.00 65.43 ? 200 ALA A CA 1 ATOM 1397 C C . ALA A 1 200 ? -13.413 -65.851 -119.732 1.00 66.68 ? 200 ALA A C 1 ATOM 1398 O O . ALA A 1 200 ? -13.299 -64.682 -120.118 1.00 65.00 ? 200 ALA A O 1 ATOM 1399 C CB . ALA A 1 200 ? -15.165 -66.575 -118.093 1.00 64.49 ? 200 ALA A CB 1 ATOM 1400 N N . HIS A 1 201 ? -13.291 -66.895 -120.550 1.00 70.16 ? 201 HIS A N 1 ATOM 1401 C CA . HIS A 1 201 ? -13.042 -66.743 -121.985 1.00 71.90 ? 201 HIS A CA 1 ATOM 1402 C C . HIS A 1 201 ? -14.321 -66.399 -122.746 1.00 70.73 ? 201 HIS A C 1 ATOM 1403 O O . HIS A 1 201 ? -15.322 -67.108 -122.644 1.00 71.31 ? 201 HIS A O 1 ATOM 1404 C CB . HIS A 1 201 ? -12.412 -68.021 -122.557 1.00 76.45 ? 201 HIS A CB 1 ATOM 1405 C CG . HIS A 1 201 ? -12.271 -68.020 -124.049 1.00 78.42 ? 201 HIS A CG 1 ATOM 1406 N ND1 . HIS A 1 201 ? -11.111 -67.633 -124.687 1.00 80.03 ? 201 HIS A ND1 1 ATOM 1407 C CD2 . HIS A 1 201 ? -13.139 -68.369 -125.029 1.00 79.41 ? 201 HIS A CD2 1 ATOM 1408 C CE1 . HIS A 1 201 ? -11.273 -67.739 -125.994 1.00 81.94 ? 201 HIS A CE1 1 ATOM 1409 N NE2 . HIS A 1 201 ? -12.496 -68.180 -126.228 1.00 81.43 ? 201 HIS A NE2 1 ATOM 1410 N N . GLY A 1 202 ? -14.274 -65.317 -123.520 1.00 69.69 ? 202 GLY A N 1 ATOM 1411 C CA . GLY A 1 202 ? -15.399 -64.914 -124.365 1.00 69.12 ? 202 GLY A CA 1 ATOM 1412 C C . GLY A 1 202 ? -16.533 -64.269 -123.595 1.00 65.94 ? 202 GLY A C 1 ATOM 1413 O O . GLY A 1 202 ? -17.678 -64.251 -124.060 1.00 65.89 ? 202 GLY A O 1 ATOM 1414 N N . HIS A 1 203 ? -16.207 -63.743 -122.415 1.00 63.64 ? 203 HIS A N 1 ATOM 1415 C CA . HIS A 1 203 ? -17.176 -63.065 -121.561 1.00 60.87 ? 203 HIS A CA 1 ATOM 1416 C C . HIS A 1 203 ? -16.778 -61.611 -121.273 1.00 58.67 ? 203 HIS A C 1 ATOM 1417 O O . HIS A 1 203 ? -15.628 -61.210 -121.469 1.00 59.14 ? 203 HIS A O 1 ATOM 1418 C CB . HIS A 1 203 ? -17.378 -63.833 -120.255 1.00 60.37 ? 203 HIS A CB 1 ATOM 1419 C CG . HIS A 1 203 ? -18.055 -65.159 -120.424 1.00 62.90 ? 203 HIS A CG 1 ATOM 1420 N ND1 . HIS A 1 203 ? -19.382 -65.363 -120.110 1.00 62.58 ? 203 HIS A ND1 1 ATOM 1421 C CD2 . HIS A 1 203 ? -17.585 -66.353 -120.856 1.00 66.02 ? 203 HIS A CD2 1 ATOM 1422 C CE1 . HIS A 1 203 ? -19.699 -66.624 -120.345 1.00 65.43 ? 203 HIS A CE1 1 ATOM 1423 N NE2 . HIS A 1 203 ? -18.627 -67.246 -120.800 1.00 67.27 ? 203 HIS A NE2 1 ATOM 1424 N N . ARG A 1 204 ? -17.753 -60.833 -120.814 1.00 56.69 ? 204 ARG A N 1 ATOM 1425 C CA . ARG A 1 204 ? -17.567 -59.428 -120.490 1.00 54.91 ? 204 ARG A CA 1 ATOM 1426 C C . ARG A 1 204 ? -18.309 -59.106 -119.201 1.00 53.01 ? 204 ARG A C 1 ATOM 1427 O O . ARG A 1 204 ? -19.444 -59.529 -119.018 1.00 53.35 ? 204 ARG A O 1 ATOM 1428 C CB . ARG A 1 204 ? -18.115 -58.563 -121.625 1.00 55.34 ? 204 ARG A CB 1 ATOM 1429 C CG . ARG A 1 204 ? -17.124 -58.261 -122.736 1.00 56.97 ? 204 ARG A CG 1 ATOM 1430 C CD . ARG A 1 204 ? -16.466 -56.915 -122.514 1.00 55.79 ? 204 ARG A CD 1 ATOM 1431 N NE . ARG A 1 204 ? -15.107 -56.874 -123.042 1.00 57.64 ? 204 ARG A NE 1 ATOM 1432 C CZ . ARG A 1 204 ? -14.226 -55.913 -122.776 1.00 57.85 ? 204 ARG A CZ 1 ATOM 1433 N NH1 . ARG A 1 204 ? -14.554 -54.904 -121.982 1.00 56.19 ? 204 ARG A NH1 1 ATOM 1434 N NH2 . ARG A 1 204 ? -13.010 -55.960 -123.301 1.00 60.51 ? 204 ARG A NH2 1 ATOM 1435 N N . GLN A 1 205 ? -17.668 -58.374 -118.298 1.00 51.65 ? 205 GLN A N 1 ATOM 1436 C CA . GLN A 1 205 ? -18.338 -57.912 -117.087 1.00 49.83 ? 205 GLN A CA 1 ATOM 1437 C C . GLN A 1 205 ? -18.839 -56.509 -117.366 1.00 48.86 ? 205 GLN A C 1 ATOM 1438 O O . GLN A 1 205 ? -18.088 -55.670 -117.863 1.00 49.29 ? 205 GLN A O 1 ATOM 1439 C CB . GLN A 1 205 ? -17.371 -57.899 -115.898 1.00 49.42 ? 205 GLN A CB 1 ATOM 1440 C CG . GLN A 1 205 ? -18.024 -57.808 -114.515 1.00 48.04 ? 205 GLN A CG 1 ATOM 1441 N N . LEU A 1 206 ? -20.106 -56.254 -117.064 1.00 48.06 ? 206 LEU A N 1 ATOM 1442 C CA . LEU A 1 206 ? -20.661 -54.923 -117.253 1.00 47.24 ? 206 LEU A CA 1 ATOM 1443 C C . LEU A 1 206 ? -20.760 -54.207 -115.921 1.00 45.97 ? 206 LEU A C 1 ATOM 1444 O O . LEU A 1 206 ? -21.705 -54.396 -115.164 1.00 45.97 ? 206 LEU A O 1 ATOM 1445 C CB . LEU A 1 206 ? -22.036 -54.979 -117.925 1.00 48.04 ? 206 LEU A CB 1 ATOM 1446 C CG . LEU A 1 206 ? -22.274 -55.794 -119.193 1.00 48.89 ? 206 LEU A CG 1 ATOM 1447 C CD1 . LEU A 1 206 ? -23.712 -55.603 -119.609 1.00 49.54 ? 206 LEU A CD1 1 ATOM 1448 C CD2 . LEU A 1 206 ? -21.339 -55.411 -120.317 1.00 48.74 ? 206 LEU A CD2 1 ATOM 1449 N N . VAL A 1 207 ? -19.765 -53.390 -115.627 1.00 45.63 ? 207 VAL A N 1 ATOM 1450 C CA . VAL A 1 207 ? -19.828 -52.502 -114.477 1.00 44.84 ? 207 VAL A CA 1 ATOM 1451 C C . VAL A 1 207 ? -20.948 -51.461 -114.661 1.00 45.14 ? 207 VAL A C 1 ATOM 1452 O O . VAL A 1 207 ? -21.120 -50.897 -115.738 1.00 46.15 ? 207 VAL A O 1 ATOM 1453 C CB . VAL A 1 207 ? -18.480 -51.777 -114.266 1.00 44.81 ? 207 VAL A CB 1 ATOM 1454 C CG1 . VAL A 1 207 ? -18.624 -50.683 -113.253 1.00 44.18 ? 207 VAL A CG1 1 ATOM 1455 C CG2 . VAL A 1 207 ? -17.402 -52.762 -113.836 1.00 44.99 ? 207 VAL A CG2 1 ATOM 1456 N N . CYS A 1 208 ? -21.725 -51.250 -113.610 1.00 44.67 ? 208 CYS A N 1 ATOM 1457 C CA . CYS A 1 208 ? -22.634 -50.128 -113.530 1.00 45.35 ? 208 CYS A CA 1 ATOM 1458 C C . CYS A 1 208 ? -22.277 -49.401 -112.250 1.00 44.76 ? 208 CYS A C 1 ATOM 1459 O O . CYS A 1 208 ? -22.224 -50.011 -111.180 1.00 43.86 ? 208 CYS A O 1 ATOM 1460 C CB . CYS A 1 208 ? -24.088 -50.587 -113.485 1.00 46.24 ? 208 CYS A CB 1 ATOM 1461 S SG . CYS A 1 208 ? -25.259 -49.234 -113.205 1.00 48.12 ? 208 CYS A SG 1 ATOM 1462 N N . HIS A 1 209 ? -22.022 -48.101 -112.367 1.00 45.37 ? 209 HIS A N 1 ATOM 1463 C CA . HIS A 1 209 ? -21.568 -47.305 -111.239 1.00 45.10 ? 209 HIS A CA 1 ATOM 1464 C C . HIS A 1 209 ? -22.709 -46.469 -110.691 1.00 46.24 ? 209 HIS A C 1 ATOM 1465 O O . HIS A 1 209 ? -23.477 -45.901 -111.459 1.00 47.75 ? 209 HIS A O 1 ATOM 1466 C CB . HIS A 1 209 ? -20.433 -46.382 -111.672 1.00 45.60 ? 209 HIS A CB 1 ATOM 1467 C CG . HIS A 1 209 ? -19.207 -47.098 -112.147 1.00 44.79 ? 209 HIS A CG 1 ATOM 1468 N ND1 . HIS A 1 209 ? -18.843 -47.152 -113.475 1.00 45.43 ? 209 HIS A ND1 1 ATOM 1469 C CD2 . HIS A 1 209 ? -18.253 -47.778 -111.470 1.00 43.83 ? 209 HIS A CD2 1 ATOM 1470 C CE1 . HIS A 1 209 ? -17.716 -47.829 -113.596 1.00 44.74 ? 209 HIS A CE1 1 ATOM 1471 N NE2 . HIS A 1 209 ? -17.339 -48.224 -112.394 1.00 44.10 ? 209 HIS A NE2 1 ATOM 1472 N N . VAL A 1 210 ? -22.823 -46.404 -109.365 1.00 45.92 ? 210 VAL A N 1 ATOM 1473 C CA . VAL A 1 210 ? -23.746 -45.477 -108.703 1.00 47.30 ? 210 VAL A CA 1 ATOM 1474 C C . VAL A 1 210 ? -22.976 -44.668 -107.652 1.00 47.59 ? 210 VAL A C 1 ATOM 1475 O O . VAL A 1 210 ? -22.313 -45.235 -106.788 1.00 46.56 ? 210 VAL A O 1 ATOM 1476 C CB . VAL A 1 210 ? -24.951 -46.202 -108.044 1.00 47.54 ? 210 VAL A CB 1 ATOM 1477 C CG1 . VAL A 1 210 ? -26.009 -45.205 -107.651 1.00 49.61 ? 210 VAL A CG1 1 ATOM 1478 C CG2 . VAL A 1 210 ? -25.560 -47.242 -108.979 1.00 47.37 ? 210 VAL A CG2 1 ATOM 1479 N N . SER A 1 211 ? -23.055 -43.344 -107.730 1.00 49.56 ? 211 SER A N 1 ATOM 1480 C CA . SER A 1 211 ? -22.248 -42.493 -106.856 1.00 50.32 ? 211 SER A CA 1 ATOM 1481 C C . SER A 1 211 ? -22.959 -41.220 -106.423 1.00 52.94 ? 211 SER A C 1 ATOM 1482 O O . SER A 1 211 ? -23.627 -40.562 -107.227 1.00 54.71 ? 211 SER A O 1 ATOM 1483 C CB . SER A 1 211 ? -20.924 -42.132 -107.541 1.00 50.33 ? 211 SER A CB 1 ATOM 1484 O OG . SER A 1 211 ? -19.998 -41.573 -106.627 1.00 50.59 ? 211 SER A OG 1 ATOM 1485 N N . GLY A 1 212 ? -22.811 -40.894 -105.141 1.00 53.64 ? 212 GLY A N 1 ATOM 1486 C CA . GLY A 1 212 ? -23.207 -39.591 -104.601 1.00 56.40 ? 212 GLY A CA 1 ATOM 1487 C C . GLY A 1 212 ? -24.536 -39.515 -103.881 1.00 57.82 ? 212 GLY A C 1 ATOM 1488 O O . GLY A 1 212 ? -25.067 -38.420 -103.677 1.00 60.75 ? 212 GLY A O 1 ATOM 1489 N N . PHE A 1 213 ? -25.066 -40.666 -103.479 1.00 56.16 ? 213 PHE A N 1 ATOM 1490 C CA . PHE A 1 213 ? -26.389 -40.716 -102.871 1.00 57.74 ? 213 PHE A CA 1 ATOM 1491 C C . PHE A 1 213 ? -26.350 -40.799 -101.349 1.00 58.12 ? 213 PHE A C 1 ATOM 1492 O O . PHE A 1 213 ? -25.335 -41.178 -100.762 1.00 56.72 ? 213 PHE A O 1 ATOM 1493 C CB . PHE A 1 213 ? -27.193 -41.886 -103.445 1.00 56.87 ? 213 PHE A CB 1 ATOM 1494 C CG . PHE A 1 213 ? -26.574 -43.230 -103.195 1.00 54.20 ? 213 PHE A CG 1 ATOM 1495 C CD1 . PHE A 1 213 ? -25.570 -43.709 -104.018 1.00 52.31 ? 213 PHE A CD1 1 ATOM 1496 C CD2 . PHE A 1 213 ? -27.001 -44.013 -102.141 1.00 54.32 ? 213 PHE A CD2 1 ATOM 1497 C CE1 . PHE A 1 213 ? -24.995 -44.948 -103.792 1.00 51.06 ? 213 PHE A CE1 1 ATOM 1498 C CE2 . PHE A 1 213 ? -26.427 -45.249 -101.906 1.00 53.53 ? 213 PHE A CE2 1 ATOM 1499 C CZ . PHE A 1 213 ? -25.420 -45.720 -102.736 1.00 51.28 ? 213 PHE A CZ 1 ATOM 1500 N N . TYR A 1 214 ? -27.474 -40.433 -100.732 1.00 60.49 ? 214 TYR A N 1 ATOM 1501 C CA . TYR A 1 214 ? -27.709 -40.553 -99.290 1.00 61.43 ? 214 TYR A CA 1 ATOM 1502 C C . TYR A 1 214 ? -29.225 -40.553 -99.081 1.00 63.91 ? 214 TYR A C 1 ATOM 1503 O O . TYR A 1 214 ? -29.933 -39.807 -99.757 1.00 66.18 ? 214 TYR A O 1 ATOM 1504 C CB . TYR A 1 214 ? -27.059 -39.395 -98.519 1.00 63.22 ? 214 TYR A CB 1 ATOM 1505 C CG . TYR A 1 214 ? -26.986 -39.599 -97.018 1.00 63.81 ? 214 TYR A CG 1 ATOM 1506 N N . PRO A 1 215 ? -29.739 -41.390 -98.161 1.00 63.99 ? 215 PRO A N 1 ATOM 1507 C CA . PRO A 1 215 ? -29.079 -42.389 -97.310 1.00 61.98 ? 215 PRO A CA 1 ATOM 1508 C C . PRO A 1 215 ? -28.528 -43.625 -98.039 1.00 58.57 ? 215 PRO A C 1 ATOM 1509 O O . PRO A 1 215 ? -28.525 -43.686 -99.269 1.00 57.35 ? 215 PRO A O 1 ATOM 1510 C CB . PRO A 1 215 ? -30.187 -42.798 -96.331 1.00 64.49 ? 215 PRO A CB 1 ATOM 1511 C CG . PRO A 1 215 ? -31.454 -42.450 -97.019 1.00 66.94 ? 215 PRO A CG 1 ATOM 1512 C CD . PRO A 1 215 ? -31.148 -41.204 -97.777 1.00 67.29 ? 215 PRO A CD 1 ATOM 1513 N N . LYS A 1 216 ? -28.076 -44.598 -97.252 1.00 57.35 ? 216 LYS A N 1 ATOM 1514 C CA . LYS A 1 216 ? -27.357 -45.769 -97.744 1.00 54.55 ? 216 LYS A CA 1 ATOM 1515 C C . LYS A 1 216 ? -28.180 -46.742 -98.594 1.00 54.08 ? 216 LYS A C 1 ATOM 1516 O O . LYS A 1 216 ? -27.690 -47.193 -99.634 1.00 52.12 ? 216 LYS A O 1 ATOM 1517 C CB . LYS A 1 216 ? -26.715 -46.515 -96.577 1.00 54.29 ? 216 LYS A CB 1 ATOM 1518 C CG . LYS A 1 216 ? -25.367 -47.116 -96.890 1.00 52.33 ? 216 LYS A CG 1 ATOM 1519 C CD . LYS A 1 216 ? -24.669 -47.512 -95.601 1.00 53.99 ? 216 LYS A CD 1 ATOM 1520 C CE . LYS A 1 216 ? -23.374 -48.251 -95.861 1.00 52.65 ? 216 LYS A CE 1 ATOM 1521 N NZ . LYS A 1 216 ? -23.359 -49.551 -95.128 1.00 53.10 ? 216 LYS A NZ 1 ATOM 1522 N N . PRO A 1 217 ? -29.421 -47.078 -98.167 1.00 56.17 ? 217 PRO A N 1 ATOM 1523 C CA . PRO A 1 217 ? -30.128 -48.141 -98.880 1.00 56.02 ? 217 PRO A CA 1 ATOM 1524 C C . PRO A 1 217 ? -30.509 -47.757 -100.312 1.00 55.80 ? 217 PRO A C 1 ATOM 1525 O O . PRO A 1 217 ? -31.305 -46.831 -100.532 1.00 57.95 ? 217 PRO A O 1 ATOM 1526 C CB . PRO A 1 217 ? -31.373 -48.378 -98.015 1.00 59.06 ? 217 PRO A CB 1 ATOM 1527 C CG . PRO A 1 217 ? -31.029 -47.805 -96.683 1.00 60.06 ? 217 PRO A CG 1 ATOM 1528 C CD . PRO A 1 217 ? -30.214 -46.604 -97.020 1.00 59.09 ? 217 PRO A CD 1 ATOM 1529 N N . VAL A 1 218 ? -29.911 -48.475 -101.263 1.00 53.39 ? 218 VAL A N 1 ATOM 1530 C CA . VAL A 1 218 ? -30.140 -48.289 -102.690 1.00 52.74 ? 218 VAL A CA 1 ATOM 1531 C C . VAL A 1 218 ? -30.377 -49.653 -103.342 1.00 52.25 ? 218 VAL A C 1 ATOM 1532 O O . VAL A 1 218 ? -29.957 -50.684 -102.817 1.00 51.11 ? 218 VAL A O 1 ATOM 1533 C CB . VAL A 1 218 ? -28.963 -47.516 -103.372 1.00 50.81 ? 218 VAL A CB 1 ATOM 1534 C CG1 . VAL A 1 218 ? -27.647 -48.245 -103.202 1.00 48.33 ? 218 VAL A CG1 1 ATOM 1535 C CG2 . VAL A 1 218 ? -29.243 -47.252 -104.849 1.00 50.72 ? 218 VAL A CG2 1 ATOM 1536 N N . TRP A 1 219 ? -31.056 -49.630 -104.486 1.00 53.33 ? 219 TRP A N 1 ATOM 1537 C CA . TRP A 1 219 ? -31.484 -50.821 -105.205 1.00 53.65 ? 219 TRP A CA 1 ATOM 1538 C C . TRP A 1 219 ? -30.989 -50.717 -106.638 1.00 52.53 ? 219 TRP A C 1 ATOM 1539 O O . TRP A 1 219 ? -31.364 -49.801 -107.364 1.00 53.66 ? 219 TRP A O 1 ATOM 1540 C CB . TRP A 1 219 ? -33.013 -50.897 -105.178 1.00 56.85 ? 219 TRP A CB 1 ATOM 1541 C CG . TRP A 1 219 ? -33.594 -52.160 -105.721 1.00 57.89 ? 219 TRP A CG 1 ATOM 1542 C CD1 . TRP A 1 219 ? -33.913 -53.287 -105.016 1.00 59.20 ? 219 TRP A CD1 1 ATOM 1543 C CD2 . TRP A 1 219 ? -33.955 -52.425 -107.080 1.00 58.56 ? 219 TRP A CD2 1 ATOM 1544 N NE1 . TRP A 1 219 ? -34.442 -54.240 -105.852 1.00 60.27 ? 219 TRP A NE1 1 ATOM 1545 C CE2 . TRP A 1 219 ? -34.478 -53.738 -107.126 1.00 60.03 ? 219 TRP A CE2 1 ATOM 1546 C CE3 . TRP A 1 219 ? -33.884 -51.683 -108.267 1.00 58.30 ? 219 TRP A CE3 1 ATOM 1547 C CZ2 . TRP A 1 219 ? -34.930 -54.323 -108.311 1.00 61.12 ? 219 TRP A CZ2 1 ATOM 1548 C CZ3 . TRP A 1 219 ? -34.330 -52.267 -109.446 1.00 59.54 ? 219 TRP A CZ3 1 ATOM 1549 C CH2 . TRP A 1 219 ? -34.849 -53.574 -109.457 1.00 60.91 ? 219 TRP A CH2 1 ATOM 1550 N N . VAL A 1 220 ? -30.128 -51.644 -107.037 1.00 50.92 ? 220 VAL A N 1 ATOM 1551 C CA . VAL A 1 220 ? -29.604 -51.668 -108.399 1.00 50.19 ? 220 VAL A CA 1 ATOM 1552 C C . VAL A 1 220 ? -29.758 -53.069 -108.988 1.00 50.86 ? 220 VAL A C 1 ATOM 1553 O O . VAL A 1 220 ? -29.331 -54.055 -108.382 1.00 50.21 ? 220 VAL A O 1 ATOM 1554 C CB . VAL A 1 220 ? -28.113 -51.262 -108.469 1.00 47.71 ? 220 VAL A CB 1 ATOM 1555 C CG1 . VAL A 1 220 ? -27.739 -50.904 -109.886 1.00 47.28 ? 220 VAL A CG1 1 ATOM 1556 C CG2 . VAL A 1 220 ? -27.814 -50.097 -107.549 1.00 47.60 ? 220 VAL A CG2 1 ATOM 1557 N N . MET A 1 221 ? -30.372 -53.147 -110.165 1.00 52.51 ? 221 MET A N 1 ATOM 1558 C CA . MET A 1 221 ? -30.527 -54.409 -110.871 1.00 53.76 ? 221 MET A CA 1 ATOM 1559 C C . MET A 1 221 ? -30.402 -54.209 -112.368 1.00 54.36 ? 221 MET A C 1 ATOM 1560 O O . MET A 1 221 ? -31.005 -53.287 -112.922 1.00 56.11 ? 221 MET A O 1 ATOM 1561 C CB . MET A 1 221 ? -31.885 -55.032 -110.559 1.00 56.62 ? 221 MET A CB 1 ATOM 1562 C CG . MET A 1 221 ? -31.937 -55.751 -109.238 1.00 57.58 ? 221 MET A CG 1 ATOM 1563 S SD . MET A 1 221 ? -31.084 -57.326 -109.333 1.00 58.90 ? 221 MET A SD 1 ATOM 1564 C CE . MET A 1 221 ? -32.472 -58.468 -109.336 1.00 62.55 ? 221 MET A CE 1 ATOM 1565 N N . TRP A 1 222 ? -29.616 -55.064 -113.024 1.00 53.65 ? 222 TRP A N 1 ATOM 1566 C CA . TRP A 1 222 ? -29.601 -55.110 -114.485 1.00 54.42 ? 222 TRP A CA 1 ATOM 1567 C C . TRP A 1 222 ? -30.892 -55.776 -114.968 1.00 57.33 ? 222 TRP A C 1 ATOM 1568 O O . TRP A 1 222 ? -31.409 -56.696 -114.325 1.00 58.32 ? 222 TRP A O 1 ATOM 1569 C CB . TRP A 1 222 ? -28.358 -55.830 -115.012 1.00 53.14 ? 222 TRP A CB 1 ATOM 1570 C CG . TRP A 1 222 ? -27.078 -55.020 -114.910 1.00 51.14 ? 222 TRP A CG 1 ATOM 1571 C CD1 . TRP A 1 222 ? -26.254 -54.933 -113.829 1.00 49.42 ? 222 TRP A CD1 1 ATOM 1572 C CD2 . TRP A 1 222 ? -26.482 -54.198 -115.932 1.00 51.00 ? 222 TRP A CD2 1 ATOM 1573 N NE1 . TRP A 1 222 ? -25.188 -54.107 -114.104 1.00 48.17 ? 222 TRP A NE1 1 ATOM 1574 C CE2 . TRP A 1 222 ? -25.301 -53.644 -115.389 1.00 49.16 ? 222 TRP A CE2 1 ATOM 1575 C CE3 . TRP A 1 222 ? -26.836 -53.870 -117.250 1.00 52.16 ? 222 TRP A CE3 1 ATOM 1576 C CZ2 . TRP A 1 222 ? -24.466 -52.781 -116.119 1.00 48.29 ? 222 TRP A CZ2 1 ATOM 1577 C CZ3 . TRP A 1 222 ? -26.003 -53.010 -117.974 1.00 51.44 ? 222 TRP A CZ3 1 ATOM 1578 C CH2 . TRP A 1 222 ? -24.836 -52.479 -117.405 1.00 49.29 ? 222 TRP A CH2 1 ATOM 1579 N N . MET A 1 223 ? -31.421 -55.288 -116.088 1.00 59.08 ? 223 MET A N 1 ATOM 1580 C CA . MET A 1 223 ? -32.754 -55.673 -116.551 1.00 62.32 ? 223 MET A CA 1 ATOM 1581 C C . MET A 1 223 ? -32.789 -55.988 -118.041 1.00 63.85 ? 223 MET A C 1 ATOM 1582 O O . MET A 1 223 ? -32.087 -55.357 -118.833 1.00 62.98 ? 223 MET A O 1 ATOM 1583 C CB . MET A 1 223 ? -33.756 -54.542 -116.267 1.00 64.20 ? 223 MET A CB 1 ATOM 1584 C CG . MET A 1 223 ? -33.871 -54.120 -114.798 1.00 63.48 ? 223 MET A CG 1 ATOM 1585 S SD . MET A 1 223 ? -35.002 -55.151 -113.840 1.00 66.53 ? 223 MET A SD 1 ATOM 1586 C CE . MET A 1 223 ? -36.562 -54.312 -114.106 1.00 70.76 ? 223 MET A CE 1 ATOM 1587 N N . ARG A 1 224 ? -33.601 -56.981 -118.404 1.00 66.50 ? 224 ARG A N 1 ATOM 1588 C CA . ARG A 1 224 ? -34.071 -57.162 -119.778 1.00 69.15 ? 224 ARG A CA 1 ATOM 1589 C C . ARG A 1 224 ? -35.555 -56.858 -119.774 1.00 72.73 ? 224 ARG A C 1 ATOM 1590 O O . ARG A 1 224 ? -36.380 -57.772 -119.797 1.00 75.57 ? 224 ARG A O 1 ATOM 1591 C CB . ARG A 1 224 ? -33.875 -58.594 -120.274 1.00 70.21 ? 224 ARG A CB 1 ATOM 1592 C CG . ARG A 1 224 ? -32.445 -59.039 -120.420 1.00 67.74 ? 224 ARG A CG 1 ATOM 1593 C CD . ARG A 1 224 ? -32.295 -60.046 -121.546 1.00 70.23 ? 224 ARG A CD 1 ATOM 1594 N NE . ARG A 1 224 ? -31.669 -59.423 -122.702 1.00 70.44 ? 224 ARG A NE 1 ATOM 1595 C CZ . ARG A 1 224 ? -30.363 -59.451 -122.957 1.00 69.04 ? 224 ARG A CZ 1 ATOM 1596 N NH1 . ARG A 1 224 ? -29.525 -60.095 -122.148 1.00 66.73 ? 224 ARG A NH1 1 ATOM 1597 N NH2 . ARG A 1 224 ? -29.892 -58.837 -124.032 1.00 69.97 ? 224 ARG A NH2 1 ATOM 1598 N N . GLY A 1 225 ? -35.887 -55.570 -119.723 1.00 72.97 ? 225 GLY A N 1 ATOM 1599 C CA . GLY A 1 225 ? -37.278 -55.131 -119.656 1.00 76.74 ? 225 GLY A CA 1 ATOM 1600 C C . GLY A 1 225 ? -37.891 -55.409 -118.298 1.00 77.04 ? 225 GLY A C 1 ATOM 1601 O O . GLY A 1 225 ? -37.467 -54.843 -117.291 1.00 74.49 ? 225 GLY A O 1 ATOM 1602 N N . ASP A 1 226 ? -38.888 -56.288 -118.271 1.00 80.47 ? 226 ASP A N 1 ATOM 1603 C CA . ASP A 1 226 ? -39.554 -56.651 -117.022 1.00 81.56 ? 226 ASP A CA 1 ATOM 1604 C C . ASP A 1 226 ? -38.779 -57.705 -116.229 1.00 78.71 ? 226 ASP A C 1 ATOM 1605 O O . ASP A 1 226 ? -39.085 -57.957 -115.061 1.00 79.02 ? 226 ASP A O 1 ATOM 1606 C CB . ASP A 1 226 ? -41.009 -57.094 -117.273 1.00 87.20 ? 226 ASP A CB 1 ATOM 1607 C CG . ASP A 1 226 ? -41.116 -58.415 -118.037 1.00 89.39 ? 226 ASP A CG 1 ATOM 1608 O OD1 . ASP A 1 226 ? -40.090 -58.925 -118.537 1.00 86.97 ? 226 ASP A OD1 1 ATOM 1609 O OD2 . ASP A 1 226 ? -42.246 -58.945 -118.142 1.00 94.23 ? 226 ASP A OD2 1 ATOM 1610 N N . GLN A 1 227 ? -37.776 -58.309 -116.866 1.00 76.37 ? 227 GLN A N 1 ATOM 1611 C CA . GLN A 1 227 ? -37.005 -59.387 -116.254 1.00 74.30 ? 227 GLN A CA 1 ATOM 1612 C C . GLN A 1 227 ? -35.783 -58.867 -115.514 1.00 69.77 ? 227 GLN A C 1 ATOM 1613 O O . GLN A 1 227 ? -34.964 -58.149 -116.079 1.00 67.54 ? 227 GLN A O 1 ATOM 1614 C CB . GLN A 1 227 ? -36.583 -60.418 -117.302 1.00 74.99 ? 227 GLN A CB 1 ATOM 1615 N N . GLU A 1 228 ? -35.680 -59.235 -114.241 1.00 68.97 ? 228 GLU A N 1 ATOM 1616 C CA . GLU A 1 228 ? -34.523 -58.912 -113.418 1.00 65.12 ? 228 GLU A CA 1 ATOM 1617 C C . GLU A 1 228 ? -33.395 -59.889 -113.712 1.00 63.50 ? 228 GLU A C 1 ATOM 1618 O O . GLU A 1 228 ? -33.584 -61.100 -113.615 1.00 65.28 ? 228 GLU A O 1 ATOM 1619 C CB . GLU A 1 228 ? -34.887 -59.007 -111.941 1.00 65.47 ? 228 GLU A CB 1 ATOM 1620 C CG . GLU A 1 228 ? -35.883 -57.977 -111.454 1.00 67.37 ? 228 GLU A CG 1 ATOM 1621 C CD . GLU A 1 228 ? -36.135 -58.090 -109.960 1.00 68.40 ? 228 GLU A CD 1 ATOM 1622 O OE1 . GLU A 1 228 ? -35.747 -57.161 -109.227 1.00 66.96 ? 228 GLU A OE1 1 ATOM 1623 O OE2 . GLU A 1 228 ? -36.703 -59.111 -109.513 1.00 71.05 ? 228 GLU A OE2 1 ATOM 1624 N N . GLN A 1 229 ? -32.224 -59.365 -114.061 1.00 60.64 ? 229 GLN A N 1 ATOM 1625 C CA . GLN A 1 229 ? -31.061 -60.206 -114.364 1.00 59.49 ? 229 GLN A CA 1 ATOM 1626 C C . GLN A 1 229 ? -30.436 -60.816 -113.104 1.00 58.54 ? 229 GLN A C 1 ATOM 1627 O O . GLN A 1 229 ? -29.855 -60.106 -112.283 1.00 56.30 ? 229 GLN A O 1 ATOM 1628 C CB . GLN A 1 229 ? -30.026 -59.428 -115.184 1.00 57.29 ? 229 GLN A CB 1 ATOM 1629 C CG . GLN A 1 229 ? -30.508 -59.064 -116.585 1.00 58.63 ? 229 GLN A CG 1 ATOM 1630 C CD . GLN A 1 229 ? -31.034 -60.267 -117.352 1.00 61.18 ? 229 GLN A CD 1 ATOM 1631 O OE1 . GLN A 1 229 ? -32.246 -60.461 -117.474 1.00 63.54 ? 229 GLN A OE1 1 ATOM 1632 N NE2 . GLN A 1 229 ? -30.123 -61.090 -117.857 1.00 61.17 ? 229 GLN A NE2 1 ATOM 1633 N N . GLN A 1 230 ? -30.556 -62.138 -112.970 1.00 60.54 ? 230 GLN A N 1 ATOM 1634 C CA . GLN A 1 230 ? -30.242 -62.833 -111.717 1.00 60.56 ? 230 GLN A CA 1 ATOM 1635 C C . GLN A 1 230 ? -28.752 -62.925 -111.392 1.00 58.25 ? 230 GLN A C 1 ATOM 1636 O O . GLN A 1 230 ? -28.381 -63.161 -110.243 1.00 58.09 ? 230 GLN A O 1 ATOM 1637 C CB . GLN A 1 230 ? -30.884 -64.223 -111.698 1.00 64.10 ? 230 GLN A CB 1 ATOM 1638 C CG . GLN A 1 230 ? -32.407 -64.206 -111.565 1.00 67.35 ? 230 GLN A CG 1 ATOM 1639 C CD . GLN A 1 230 ? -32.881 -63.851 -110.161 1.00 68.08 ? 230 GLN A CD 1 ATOM 1640 O OE1 . GLN A 1 230 ? -33.202 -62.694 -109.873 1.00 67.06 ? 230 GLN A OE1 1 ATOM 1641 N NE2 . GLN A 1 230 ? -32.922 -64.847 -109.279 1.00 70.02 ? 230 GLN A NE2 1 ATOM 1642 N N . GLY A 1 231 ? -27.901 -62.732 -112.393 1.00 56.98 ? 231 GLY A N 1 ATOM 1643 C CA . GLY A 1 231 ? -26.461 -62.683 -112.168 1.00 55.09 ? 231 GLY A CA 1 ATOM 1644 C C . GLY A 1 231 ? -25.968 -61.290 -111.805 1.00 52.51 ? 231 GLY A C 1 ATOM 1645 O O . GLY A 1 231 ? -24.767 -61.023 -111.863 1.00 51.28 ? 231 GLY A O 1 ATOM 1646 N N . THR A 1 232 ? -26.888 -60.393 -111.448 1.00 52.08 ? 232 THR A N 1 ATOM 1647 C CA . THR A 1 232 ? -26.516 -59.067 -110.981 1.00 50.01 ? 232 THR A CA 1 ATOM 1648 C C . THR A 1 232 ? -25.849 -59.242 -109.638 1.00 49.49 ? 232 THR A C 1 ATOM 1649 O O . THR A 1 232 ? -26.396 -59.902 -108.756 1.00 50.92 ? 232 THR A O 1 ATOM 1650 C CB . THR A 1 232 ? -27.730 -58.150 -110.807 1.00 50.45 ? 232 THR A CB 1 ATOM 1651 O OG1 . THR A 1 232 ? -28.500 -58.145 -112.008 1.00 51.99 ? 232 THR A OG1 1 ATOM 1652 C CG2 . THR A 1 232 ? -27.291 -56.726 -110.504 1.00 48.79 ? 232 THR A CG2 1 ATOM 1653 N N . HIS A 1 233 ? -24.664 -58.658 -109.494 1.00 48.05 ? 233 HIS A N 1 ATOM 1654 C CA . HIS A 1 233 ? -23.891 -58.790 -108.269 1.00 47.90 ? 233 HIS A CA 1 ATOM 1655 C C . HIS A 1 233 ? -23.691 -57.439 -107.604 1.00 46.59 ? 233 HIS A C 1 ATOM 1656 O O . HIS A 1 233 ? -23.033 -56.551 -108.150 1.00 45.53 ? 233 HIS A O 1 ATOM 1657 C CB . HIS A 1 233 ? -22.545 -59.473 -108.543 1.00 48.03 ? 233 HIS A CB 1 ATOM 1658 C CG . HIS A 1 233 ? -21.639 -59.524 -107.350 1.00 48.44 ? 233 HIS A CG 1 ATOM 1659 N ND1 . HIS A 1 233 ? -20.363 -59.000 -107.360 1.00 48.25 ? 233 HIS A ND1 1 ATOM 1660 C CD2 . HIS A 1 233 ? -21.828 -60.029 -106.108 1.00 49.38 ? 233 HIS A CD2 1 ATOM 1661 C CE1 . HIS A 1 233 ? -19.803 -59.188 -106.178 1.00 48.33 ? 233 HIS A CE1 1 ATOM 1662 N NE2 . HIS A 1 233 ? -20.670 -59.810 -105.401 1.00 49.20 ? 233 HIS A NE2 1 ATOM 1663 N N . ARG A 1 234 ? -24.277 -57.294 -106.422 1.00 47.17 ? 234 ARG A N 1 ATOM 1664 C CA . ARG A 1 234 ? -24.130 -56.086 -105.630 1.00 46.37 ? 234 ARG A CA 1 ATOM 1665 C C . ARG A 1 234 ? -22.684 -55.957 -105.157 1.00 45.71 ? 234 ARG A C 1 ATOM 1666 O O . ARG A 1 234 ? -22.065 -56.941 -104.741 1.00 46.35 ? 234 ARG A O 1 ATOM 1667 C CB . ARG A 1 234 ? -25.091 -56.107 -104.438 1.00 47.50 ? 234 ARG A CB 1 ATOM 1668 N N . GLY A 1 235 ? -22.144 -54.742 -105.251 1.00 44.83 ? 235 GLY A N 1 ATOM 1669 C CA . GLY A 1 235 ? -20.813 -54.443 -104.725 1.00 44.44 ? 235 GLY A CA 1 ATOM 1670 C C . GLY A 1 235 ? -20.909 -54.195 -103.236 1.00 45.05 ? 235 GLY A C 1 ATOM 1671 O O . GLY A 1 235 ? -21.953 -54.441 -102.626 1.00 45.84 ? 235 GLY A O 1 ATOM 1672 N N . ASP A 1 236 ? -19.820 -53.721 -102.644 1.00 45.11 ? 236 ASP A N 1 ATOM 1673 C CA . ASP A 1 236 ? -19.859 -53.253 -101.263 1.00 45.95 ? 236 ASP A CA 1 ATOM 1674 C C . ASP A 1 236 ? -19.900 -51.715 -101.255 1.00 45.66 ? 236 ASP A C 1 ATOM 1675 O O . ASP A 1 236 ? -19.144 -51.075 -101.990 1.00 45.25 ? 236 ASP A O 1 ATOM 1676 C CB . ASP A 1 236 ? -18.663 -53.795 -100.476 1.00 46.79 ? 236 ASP A CB 1 ATOM 1677 N N . PHE A 1 237 ? -20.790 -51.128 -100.451 1.00 46.30 ? 237 PHE A N 1 ATOM 1678 C CA . PHE A 1 237 ? -20.866 -49.660 -100.327 1.00 46.63 ? 237 PHE A CA 1 ATOM 1679 C C . PHE A 1 237 ? -19.488 -49.032 -100.049 1.00 46.81 ? 237 PHE A C 1 ATOM 1680 O O . PHE A 1 237 ? -18.726 -49.536 -99.234 1.00 47.43 ? 237 PHE A O 1 ATOM 1681 C CB . PHE A 1 237 ? -21.863 -49.230 -99.238 1.00 47.79 ? 237 PHE A CB 1 ATOM 1682 C CG . PHE A 1 237 ? -23.274 -49.749 -99.432 1.00 47.77 ? 237 PHE A CG 1 ATOM 1683 C CD1 . PHE A 1 237 ? -23.973 -49.511 -100.607 1.00 46.97 ? 237 PHE A CD1 1 ATOM 1684 C CD2 . PHE A 1 237 ? -23.919 -50.434 -98.407 1.00 49.08 ? 237 PHE A CD2 1 ATOM 1685 C CE1 . PHE A 1 237 ? -25.279 -49.975 -100.774 1.00 46.99 ? 237 PHE A CE1 1 ATOM 1686 C CE2 . PHE A 1 237 ? -25.227 -50.889 -98.560 1.00 49.63 ? 237 PHE A CE2 1 ATOM 1687 C CZ . PHE A 1 237 ? -25.904 -50.662 -99.752 1.00 48.40 ? 237 PHE A CZ 1 ATOM 1688 N N . LEU A 1 238 ? -19.173 -47.944 -100.739 1.00 46.81 ? 238 LEU A N 1 ATOM 1689 C CA . LEU A 1 238 ? -17.893 -47.266 -100.551 1.00 47.86 ? 238 LEU A CA 1 ATOM 1690 C C . LEU A 1 238 ? -18.079 -45.771 -100.257 1.00 49.27 ? 238 LEU A C 1 ATOM 1691 O O . LEU A 1 238 ? -18.871 -45.098 -100.916 1.00 49.28 ? 238 LEU A O 1 ATOM 1692 C CB . LEU A 1 238 ? -16.991 -47.453 -101.775 1.00 47.32 ? 238 LEU A CB 1 ATOM 1693 C CG . LEU A 1 238 ? -16.643 -48.837 -102.341 1.00 46.66 ? 238 LEU A CG 1 ATOM 1694 C CD1 . LEU A 1 238 ? -15.709 -48.699 -103.534 1.00 45.96 ? 238 LEU A CD1 1 ATOM 1695 C CD2 . LEU A 1 238 ? -16.018 -49.752 -101.297 1.00 48.27 ? 238 LEU A CD2 1 ATOM 1696 N N . PRO A 1 239 ? -17.341 -45.244 -99.267 1.00 50.99 ? 239 PRO A N 1 ATOM 1697 C CA . PRO A 1 239 ? -17.464 -43.841 -98.834 1.00 52.79 ? 239 PRO A CA 1 ATOM 1698 C C . PRO A 1 239 ? -16.835 -42.819 -99.789 1.00 53.47 ? 239 PRO A C 1 ATOM 1699 O O . PRO A 1 239 ? -15.884 -43.139 -100.501 1.00 53.06 ? 239 PRO A O 1 ATOM 1700 C CB . PRO A 1 239 ? -16.708 -43.833 -97.510 1.00 54.47 ? 239 PRO A CB 1 ATOM 1701 C CG . PRO A 1 239 ? -15.667 -44.910 -97.678 1.00 53.75 ? 239 PRO A CG 1 ATOM 1702 C CD . PRO A 1 239 ? -16.339 -45.984 -98.471 1.00 51.66 ? 239 PRO A CD 1 ATOM 1703 N N . ASN A 1 240 ? -17.359 -41.594 -99.787 1.00 54.99 ? 240 ASN A N 1 ATOM 1704 C CA . ASN A 1 240 ? -16.817 -40.527 -100.640 1.00 56.37 ? 240 ASN A CA 1 ATOM 1705 C C . ASN A 1 240 ? -16.204 -39.356 -99.868 1.00 59.13 ? 240 ASN A C 1 ATOM 1706 O O . ASN A 1 240 ? -16.621 -39.035 -98.756 1.00 60.25 ? 240 ASN A O 1 ATOM 1707 C CB . ASN A 1 240 ? -17.872 -40.012 -101.624 1.00 56.37 ? 240 ASN A CB 1 ATOM 1708 C CG . ASN A 1 240 ? -18.565 -41.133 -102.386 1.00 54.10 ? 240 ASN A CG 1 ATOM 1709 O OD1 . ASN A 1 240 ? -19.152 -42.035 -101.787 1.00 53.29 ? 240 ASN A OD1 1 ATOM 1710 N ND2 . ASN A 1 240 ? -18.523 -41.063 -103.712 1.00 53.16 ? 240 ASN A ND2 1 ATOM 1711 N N . ASP A 1 242 ? -18.366 -35.978 -99.728 1.00 65.79 ? 242 ASP A N 1 ATOM 1712 C CA . ASP A 1 242 ? -18.235 -36.210 -98.294 1.00 66.37 ? 242 ASP A CA 1 ATOM 1713 C C . ASP A 1 242 ? -19.533 -36.768 -97.708 1.00 65.71 ? 242 ASP A C 1 ATOM 1714 O O . ASP A 1 242 ? -20.599 -36.166 -97.862 1.00 67.29 ? 242 ASP A O 1 ATOM 1715 C CB . ASP A 1 242 ? -17.837 -34.920 -97.572 0.43 70.11 ? 242 ASP A CB 1 ATOM 1716 N N . GLU A 1 243 ? -19.425 -37.926 -97.053 1.00 63.80 ? 243 GLU A N 1 ATOM 1717 C CA . GLU A 1 243 ? -20.536 -38.594 -96.357 1.00 63.24 ? 243 GLU A CA 1 ATOM 1718 C C . GLU A 1 243 ? -21.564 -39.223 -97.295 1.00 61.43 ? 243 GLU A C 1 ATOM 1719 O O . GLU A 1 243 ? -22.525 -39.851 -96.841 1.00 61.31 ? 243 GLU A O 1 ATOM 1720 C CB . GLU A 1 243 ? -21.213 -37.655 -95.345 1.00 66.53 ? 243 GLU A CB 1 ATOM 1721 N N . THR A 1 244 ? -21.350 -39.066 -98.598 1.00 60.42 ? 244 THR A N 1 ATOM 1722 C CA . THR A 1 244 ? -22.172 -39.734 -99.612 1.00 58.70 ? 244 THR A CA 1 ATOM 1723 C C . THR A 1 244 ? -21.784 -41.214 -99.762 1.00 55.69 ? 244 THR A C 1 ATOM 1724 O O . THR A 1 244 ? -21.032 -41.750 -98.940 1.00 55.18 ? 244 THR A O 1 ATOM 1725 C CB . THR A 1 244 ? -22.106 -39.000 -100.973 1.00 59.21 ? 244 THR A CB 1 ATOM 1726 O OG1 . THR A 1 244 ? -20.772 -38.523 -101.199 1.00 59.78 ? 244 THR A OG1 1 ATOM 1727 C CG2 . THR A 1 244 ? -23.064 -37.818 -100.982 1.00 62.00 ? 244 THR A CG2 1 ATOM 1728 N N . TRP A 1 245 ? -22.302 -41.870 -100.799 1.00 54.09 ? 245 TRP A N 1 ATOM 1729 C CA . TRP A 1 245 ? -22.112 -43.317 -100.968 1.00 51.96 ? 245 TRP A CA 1 ATOM 1730 C C . TRP A 1 245 ? -21.844 -43.770 -102.401 1.00 50.31 ? 245 TRP A C 1 ATOM 1731 O O . TRP A 1 245 ? -22.472 -43.292 -103.350 1.00 51.12 ? 245 TRP A O 1 ATOM 1732 C CB . TRP A 1 245 ? -23.307 -44.088 -100.411 1.00 52.02 ? 245 TRP A CB 1 ATOM 1733 C CG . TRP A 1 245 ? -23.306 -44.211 -98.925 1.00 53.76 ? 245 TRP A CG 1 ATOM 1734 C CD1 . TRP A 1 245 ? -24.305 -43.837 -98.075 1.00 56.18 ? 245 TRP A CD1 1 ATOM 1735 C CD2 . TRP A 1 245 ? -22.257 -44.745 -98.102 1.00 53.98 ? 245 TRP A CD2 1 ATOM 1736 N NE1 . TRP A 1 245 ? -23.948 -44.108 -96.776 1.00 57.21 ? 245 TRP A NE1 1 ATOM 1737 C CE2 . TRP A 1 245 ? -22.696 -44.666 -96.765 1.00 55.45 ? 245 TRP A CE2 1 ATOM 1738 C CE3 . TRP A 1 245 ? -20.990 -45.285 -98.366 1.00 53.62 ? 245 TRP A CE3 1 ATOM 1739 C CZ2 . TRP A 1 245 ? -21.916 -45.099 -95.694 1.00 55.80 ? 245 TRP A CZ2 1 ATOM 1740 C CZ3 . TRP A 1 245 ? -20.214 -45.719 -97.297 1.00 54.14 ? 245 TRP A CZ3 1 ATOM 1741 C CH2 . TRP A 1 245 ? -20.684 -45.623 -95.978 1.00 55.33 ? 245 TRP A CH2 1 ATOM 1742 N N . TYR A 1 246 ? -20.913 -44.704 -102.546 1.00 48.39 ? 246 TYR A N 1 ATOM 1743 C CA . TYR A 1 246 ? -20.586 -45.251 -103.849 1.00 46.95 ? 246 TYR A CA 1 ATOM 1744 C C . TYR A 1 246 ? -20.838 -46.760 -103.885 1.00 45.66 ? 246 TYR A C 1 ATOM 1745 O O . TYR A 1 246 ? -20.541 -47.480 -102.933 1.00 45.39 ? 246 TYR A O 1 ATOM 1746 C CB . TYR A 1 246 ? -19.144 -44.905 -104.237 1.00 46.97 ? 246 TYR A CB 1 ATOM 1747 C CG . TYR A 1 246 ? -18.661 -45.631 -105.465 1.00 45.99 ? 246 TYR A CG 1 ATOM 1748 C CD1 . TYR A 1 246 ? -18.794 -45.074 -106.735 1.00 45.92 ? 246 TYR A CD1 1 ATOM 1749 C CD2 . TYR A 1 246 ? -18.082 -46.895 -105.355 1.00 45.38 ? 246 TYR A CD2 1 ATOM 1750 C CE1 . TYR A 1 246 ? -18.348 -45.764 -107.867 1.00 45.55 ? 246 TYR A CE1 1 ATOM 1751 C CE2 . TYR A 1 246 ? -17.644 -47.590 -106.471 1.00 44.71 ? 246 TYR A CE2 1 ATOM 1752 C CZ . TYR A 1 246 ? -17.776 -47.024 -107.718 1.00 44.73 ? 246 TYR A CZ 1 ATOM 1753 O OH . TYR A 1 246 ? -17.331 -47.741 -108.798 1.00 44.58 ? 246 TYR A OH 1 ATOM 1754 N N . LEU A 1 247 ? -21.390 -47.220 -105.000 1.00 45.06 ? 247 LEU A N 1 ATOM 1755 C CA . LEU A 1 247 ? -21.734 -48.613 -105.190 1.00 44.28 ? 247 LEU A CA 1 ATOM 1756 C C . LEU A 1 247 ? -21.638 -48.975 -106.666 1.00 43.94 ? 247 LEU A C 1 ATOM 1757 O O . LEU A 1 247 ? -21.927 -48.142 -107.531 1.00 44.54 ? 247 LEU A O 1 ATOM 1758 C CB . LEU A 1 247 ? -23.156 -48.862 -104.702 1.00 44.87 ? 247 LEU A CB 1 ATOM 1759 C CG . LEU A 1 247 ? -23.579 -50.331 -104.694 1.00 44.99 ? 247 LEU A CG 1 ATOM 1760 C CD1 . LEU A 1 247 ? -22.784 -51.116 -103.634 1.00 45.26 ? 247 LEU A CD1 1 ATOM 1761 C CD2 . LEU A 1 247 ? -25.082 -50.479 -104.485 1.00 45.69 ? 247 LEU A CD2 1 ATOM 1762 N N . GLN A 1 248 ? -21.229 -50.208 -106.959 1.00 43.34 ? 248 GLN A N 1 ATOM 1763 C CA . GLN A 1 248 ? -21.279 -50.708 -108.330 1.00 43.19 ? 248 GLN A CA 1 ATOM 1764 C C . GLN A 1 248 ? -21.940 -52.074 -108.401 1.00 43.04 ? 248 GLN A C 1 ATOM 1765 O O . GLN A 1 248 ? -21.844 -52.860 -107.460 1.00 43.11 ? 248 GLN A O 1 ATOM 1766 C CB . GLN A 1 248 ? -19.903 -50.678 -109.007 1.00 43.18 ? 248 GLN A CB 1 ATOM 1767 C CG . GLN A 1 248 ? -18.927 -51.788 -108.625 1.00 44.48 ? 248 GLN A CG 1 ATOM 1768 C CD . GLN A 1 248 ? -17.575 -51.657 -109.336 1.00 46.26 ? 248 GLN A CD 1 ATOM 1769 O OE1 . GLN A 1 248 ? -17.043 -50.555 -109.499 1.00 47.31 ? 248 GLN A OE1 1 ATOM 1770 N NE2 . GLN A 1 248 ? -17.016 -52.787 -109.753 1.00 46.96 ? 248 GLN A NE2 1 ATOM 1771 N N . ALA A 1 249 ? -22.638 -52.328 -109.508 1.00 43.21 ? 249 ALA A N 1 ATOM 1772 C CA . ALA A 1 249 ? -23.374 -53.575 -109.720 1.00 43.48 ? 249 ALA A CA 1 ATOM 1773 C C . ALA A 1 249 ? -22.966 -54.210 -111.041 1.00 43.70 ? 249 ALA A C 1 ATOM 1774 O O . ALA A 1 249 ? -23.274 -53.702 -112.120 1.00 43.84 ? 249 ALA A O 1 ATOM 1775 C CB . ALA A 1 249 ? -24.872 -53.333 -109.675 1.00 44.31 ? 249 ALA A CB 1 ATOM 1776 N N . THR A 1 250 ? -22.265 -55.332 -110.937 1.00 43.98 ? 250 THR A N 1 ATOM 1777 C CA . THR A 1 250 ? -21.694 -56.001 -112.098 1.00 44.72 ? 250 THR A CA 1 ATOM 1778 C C . THR A 1 250 ? -22.674 -56.998 -112.702 1.00 45.77 ? 250 THR A C 1 ATOM 1779 O O . THR A 1 250 ? -23.596 -57.461 -112.033 1.00 46.29 ? 250 THR A O 1 ATOM 1780 C CB . THR A 1 250 ? -20.365 -56.739 -111.754 1.00 44.89 ? 250 THR A CB 1 ATOM 1781 O OG1 . THR A 1 250 ? -20.658 -58.012 -111.171 1.00 46.64 ? 250 THR A OG1 1 ATOM 1782 C CG2 . THR A 1 250 ? -19.491 -55.920 -110.789 1.00 44.26 ? 250 THR A CG2 1 ATOM 1783 N N . LEU A 1 251 ? -22.469 -57.299 -113.979 1.00 46.54 ? 251 LEU A N 1 ATOM 1784 C CA . LEU A 1 251 ? -23.181 -58.370 -114.662 1.00 48.34 ? 251 LEU A CA 1 ATOM 1785 C C . LEU A 1 251 ? -22.265 -58.994 -115.713 1.00 49.43 ? 251 LEU A C 1 ATOM 1786 O O . LEU A 1 251 ? -21.698 -58.289 -116.553 1.00 49.09 ? 251 LEU A O 1 ATOM 1787 C CB . LEU A 1 251 ? -24.492 -57.877 -115.296 1.00 49.04 ? 251 LEU A CB 1 ATOM 1788 C CG . LEU A 1 251 ? -25.253 -58.881 -116.178 1.00 50.82 ? 251 LEU A CG 1 ATOM 1789 C CD1 . LEU A 1 251 ? -25.572 -60.189 -115.450 1.00 51.73 ? 251 LEU A CD1 1 ATOM 1790 C CD2 . LEU A 1 251 ? -26.521 -58.264 -116.722 1.00 51.90 ? 251 LEU A CD2 1 ATOM 1791 N N . ASP A 1 252 ? -22.123 -60.317 -115.634 1.00 50.90 ? 252 ASP A N 1 ATOM 1792 C CA . ASP A 1 252 ? -21.323 -61.085 -116.567 1.00 52.56 ? 252 ASP A CA 1 ATOM 1793 C C . ASP A 1 252 ? -22.197 -61.484 -117.748 1.00 54.45 ? 252 ASP A C 1 ATOM 1794 O O . ASP A 1 252 ? -23.277 -62.052 -117.570 1.00 55.58 ? 252 ASP A O 1 ATOM 1795 C CB . ASP A 1 252 ? -20.780 -62.327 -115.868 1.00 54.06 ? 252 ASP A CB 1 ATOM 1796 C CG . ASP A 1 252 ? -19.649 -62.989 -116.631 1.00 56.36 ? 252 ASP A CG 1 ATOM 1797 O OD1 . ASP A 1 252 ? -19.845 -63.354 -117.815 1.00 58.83 ? 252 ASP A OD1 1 ATOM 1798 O OD2 . ASP A 1 252 ? -18.562 -63.163 -116.032 1.00 56.83 ? 252 ASP A OD2 1 ATOM 1799 N N . VAL A 1 253 ? -21.721 -61.173 -118.952 1.00 55.23 ? 253 VAL A N 1 ATOM 1800 C CA . VAL A 1 253 ? -22.471 -61.389 -120.189 1.00 57.21 ? 253 VAL A CA 1 ATOM 1801 C C . VAL A 1 253 ? -21.618 -62.124 -121.219 1.00 59.67 ? 253 VAL A C 1 ATOM 1802 O O . VAL A 1 253 ? -20.399 -61.940 -121.275 1.00 59.22 ? 253 VAL A O 1 ATOM 1803 C CB . VAL A 1 253 ? -22.985 -60.055 -120.810 1.00 56.33 ? 253 VAL A CB 1 ATOM 1804 C CG1 . VAL A 1 253 ? -24.008 -59.398 -119.915 1.00 54.94 ? 253 VAL A CG1 1 ATOM 1805 C CG2 . VAL A 1 253 ? -21.845 -59.097 -121.092 1.00 54.82 ? 253 VAL A CG2 1 ATOM 1806 N N . GLU A 1 254 ? -22.266 -62.961 -122.026 1.00 62.69 ? 254 GLU A N 1 ATOM 1807 C CA . GLU A 1 254 ? -21.591 -63.656 -123.112 1.00 65.65 ? 254 GLU A CA 1 ATOM 1808 C C . GLU A 1 254 ? -21.481 -62.675 -124.269 1.00 66.20 ? 254 GLU A C 1 ATOM 1809 O O . GLU A 1 254 ? -22.499 -62.197 -124.778 1.00 66.67 ? 254 GLU A O 1 ATOM 1810 C CB . GLU A 1 254 ? -22.365 -64.918 -123.513 1.00 68.68 ? 254 GLU A CB 1 ATOM 1811 C CG . GLU A 1 254 ? -21.658 -65.803 -124.534 1.00 71.82 ? 254 GLU A CG 1 ATOM 1812 N N . ALA A 1 255 ? -20.244 -62.371 -124.664 1.00 66.82 ? 255 ALA A N 1 ATOM 1813 C CA . ALA A 1 255 ? -19.958 -61.318 -125.647 1.00 67.59 ? 255 ALA A CA 1 ATOM 1814 C C . ALA A 1 255 ? -20.859 -61.423 -126.877 1.00 70.37 ? 255 ALA A C 1 ATOM 1815 O O . ALA A 1 255 ? -20.791 -62.395 -127.633 1.00 73.23 ? 255 ALA A O 1 ATOM 1816 C CB . ALA A 1 255 ? -18.480 -61.330 -126.042 1.00 68.51 ? 255 ALA A CB 1 ATOM 1817 N N . GLY A 1 256 ? -21.713 -60.420 -127.056 1.00 70.04 ? 256 GLY A N 1 ATOM 1818 C CA . GLY A 1 256 ? -22.754 -60.468 -128.077 1.00 72.93 ? 256 GLY A CA 1 ATOM 1819 C C . GLY A 1 256 ? -24.143 -60.268 -127.496 1.00 72.66 ? 256 GLY A C 1 ATOM 1820 O O . GLY A 1 256 ? -25.104 -60.048 -128.240 1.00 74.86 ? 256 GLY A O 1 ATOM 1821 N N . GLU A 1 257 ? -24.245 -60.348 -126.168 1.00 70.39 ? 257 GLU A N 1 ATOM 1822 C CA . GLU A 1 257 ? -25.509 -60.146 -125.455 1.00 70.15 ? 257 GLU A CA 1 ATOM 1823 C C . GLU A 1 257 ? -25.596 -58.782 -124.763 1.00 67.76 ? 257 GLU A C 1 ATOM 1824 O O . GLU A 1 257 ? -26.576 -58.495 -124.065 1.00 67.33 ? 257 GLU A O 1 ATOM 1825 C CB . GLU A 1 257 ? -25.718 -61.253 -124.422 1.00 69.93 ? 257 GLU A CB 1 ATOM 1826 C CG . GLU A 1 257 ? -26.198 -62.576 -124.999 1.00 73.86 ? 257 GLU A CG 1 ATOM 1827 C CD . GLU A 1 257 ? -26.430 -63.639 -123.928 1.00 74.79 ? 257 GLU A CD 1 ATOM 1828 O OE1 . GLU A 1 257 ? -26.085 -63.395 -122.746 1.00 72.12 ? 257 GLU A OE1 1 ATOM 1829 O OE2 . GLU A 1 257 ? -26.957 -64.721 -124.276 1.00 77.81 ? 257 GLU A OE2 1 ATOM 1830 N N . GLU A 1 258 ? -24.570 -57.952 -124.959 1.00 66.56 ? 258 GLU A N 1 ATOM 1831 C CA . GLU A 1 258 ? -24.499 -56.619 -124.354 1.00 64.71 ? 258 GLU A CA 1 ATOM 1832 C C . GLU A 1 258 ? -25.774 -55.824 -124.592 1.00 65.73 ? 258 GLU A C 1 ATOM 1833 O O . GLU A 1 258 ? -26.309 -55.209 -123.672 1.00 64.50 ? 258 GLU A O 1 ATOM 1834 C CB . GLU A 1 258 ? -23.299 -55.830 -124.899 1.00 64.61 ? 258 GLU A CB 1 ATOM 1835 C CG . GLU A 1 258 ? -21.924 -56.254 -124.359 1.00 64.11 ? 258 GLU A CG 1 ATOM 1836 C CD . GLU A 1 258 ? -21.292 -57.401 -125.146 1.00 66.87 ? 258 GLU A CD 1 ATOM 1837 O OE1 . GLU A 1 258 ? -20.197 -57.194 -125.717 1.00 68.00 ? 258 GLU A OE1 1 ATOM 1838 O OE2 . GLU A 1 258 ? -21.890 -58.500 -125.205 1.00 67.57 ? 258 GLU A OE2 1 ATOM 1839 N N . ALA A 1 259 ? -26.259 -55.865 -125.830 1.00 68.39 ? 259 ALA A N 1 ATOM 1840 C CA . ALA A 1 259 ? -27.395 -55.053 -126.264 1.00 70.27 ? 259 ALA A CA 1 ATOM 1841 C C . ALA A 1 259 ? -28.720 -55.499 -125.658 1.00 70.99 ? 259 ALA A C 1 ATOM 1842 O O . ALA A 1 259 ? -28.937 -56.690 -125.416 1.00 71.34 ? 259 ALA A O 1 ATOM 1843 C CB . ALA A 1 259 ? -27.483 -55.049 -127.782 1.00 73.48 ? 259 ALA A CB 1 ATOM 1844 N N . GLY A 1 260 ? -29.599 -54.527 -125.420 1.00 71.56 ? 260 GLY A N 1 ATOM 1845 C CA . GLY A 1 260 ? -30.939 -54.793 -124.898 1.00 72.79 ? 260 GLY A CA 1 ATOM 1846 C C . GLY A 1 260 ? -31.001 -54.793 -123.383 1.00 70.06 ? 260 GLY A C 1 ATOM 1847 O O . GLY A 1 260 ? -32.073 -54.980 -122.804 1.00 71.44 ? 260 GLY A O 1 ATOM 1848 N N . LEU A 1 261 ? -29.848 -54.577 -122.748 1.00 66.47 ? 261 LEU A N 1 ATOM 1849 C CA . LEU A 1 261 ? -29.734 -54.576 -121.290 1.00 63.63 ? 261 LEU A CA 1 ATOM 1850 C C . LEU A 1 261 ? -29.845 -53.174 -120.722 1.00 62.68 ? 261 LEU A C 1 ATOM 1851 O O . LEU A 1 261 ? -29.692 -52.193 -121.452 1.00 63.50 ? 261 LEU A O 1 ATOM 1852 C CB . LEU A 1 261 ? -28.407 -55.199 -120.853 1.00 61.05 ? 261 LEU A CB 1 ATOM 1853 C CG . LEU A 1 261 ? -28.289 -56.721 -120.898 1.00 61.40 ? 261 LEU A CG 1 ATOM 1854 C CD1 . LEU A 1 261 ? -26.917 -57.128 -120.409 1.00 59.16 ? 261 LEU A CD1 1 ATOM 1855 C CD2 . LEU A 1 261 ? -29.361 -57.365 -120.053 1.00 61.94 ? 261 LEU A CD2 1 ATOM 1856 N N . ALA A 1 262 ? -30.101 -53.089 -119.417 1.00 61.11 ? 262 ALA A N 1 ATOM 1857 C CA . ALA A 1 262 ? -30.282 -51.806 -118.751 1.00 60.62 ? 262 ALA A CA 1 ATOM 1858 C C . ALA A 1 262 ? -29.965 -51.851 -117.263 1.00 58.30 ? 262 ALA A C 1 ATOM 1859 O O . ALA A 1 262 ? -30.431 -52.742 -116.551 1.00 58.33 ? 262 ALA A O 1 ATOM 1860 C CB . ALA A 1 262 ? -31.703 -51.297 -118.968 1.00 63.97 ? 262 ALA A CB 1 ATOM 1861 N N . CYS A 1 263 ? -29.178 -50.881 -116.800 1.00 56.62 ? 263 CYS A N 1 ATOM 1862 C CA . CYS A 1 263 ? -28.929 -50.704 -115.370 1.00 54.87 ? 263 CYS A CA 1 ATOM 1863 C C . CYS A 1 263 ? -30.013 -49.807 -114.781 1.00 56.50 ? 263 CYS A C 1 ATOM 1864 O O . CYS A 1 263 ? -30.144 -48.643 -115.168 1.00 57.87 ? 263 CYS A O 1 ATOM 1865 C CB . CYS A 1 263 ? -27.536 -50.111 -115.105 1.00 52.69 ? 263 CYS A CB 1 ATOM 1866 S SG . CYS A 1 263 ? -27.098 -50.097 -113.335 1.00 51.48 ? 263 CYS A SG 1 ATOM 1867 N N . ARG A 1 264 ? -30.793 -50.359 -113.857 1.00 56.79 ? 264 ARG A N 1 ATOM 1868 C CA . ARG A 1 264 ? -31.892 -49.635 -113.230 1.00 58.99 ? 264 ARG A CA 1 ATOM 1869 C C . ARG A 1 264 ? -31.565 -49.348 -111.774 1.00 57.64 ? 264 ARG A C 1 ATOM 1870 O O . ARG A 1 264 ? -31.160 -50.251 -111.036 1.00 56.16 ? 264 ARG A O 1 ATOM 1871 C CB . ARG A 1 264 ? -33.178 -50.450 -113.318 1.00 61.60 ? 264 ARG A CB 1 ATOM 1872 C CG . ARG A 1 264 ? -34.415 -49.719 -112.857 1.00 65.10 ? 264 ARG A CG 1 ATOM 1873 C CD . ARG A 1 264 ? -35.590 -50.673 -112.746 1.00 68.72 ? 264 ARG A CD 1 ATOM 1874 N NE . ARG A 1 264 ? -36.865 -49.966 -112.835 1.00 73.61 ? 264 ARG A NE 1 ATOM 1875 C CZ . ARG A 1 264 ? -37.564 -49.807 -113.958 1.00 76.95 ? 264 ARG A CZ 1 ATOM 1876 N NH1 . ARG A 1 264 ? -37.125 -50.315 -115.106 1.00 76.15 ? 264 ARG A NH1 1 ATOM 1877 N NH2 . ARG A 1 264 ? -38.712 -49.142 -113.931 1.00 81.46 ? 264 ARG A NH2 1 ATOM 1878 N N . VAL A 1 265 ? -31.744 -48.094 -111.362 1.00 58.57 ? 265 VAL A N 1 ATOM 1879 C CA . VAL A 1 265 ? -31.417 -47.681 -109.995 1.00 57.51 ? 265 VAL A CA 1 ATOM 1880 C C . VAL A 1 265 ? -32.617 -47.060 -109.283 1.00 60.39 ? 265 VAL A C 1 ATOM 1881 O O . VAL A 1 265 ? -33.100 -46.004 -109.686 1.00 62.72 ? 265 VAL A O 1 ATOM 1882 C CB . VAL A 1 265 ? -30.214 -46.702 -109.952 1.00 55.95 ? 265 VAL A CB 1 ATOM 1883 C CG1 . VAL A 1 265 ? -29.880 -46.325 -108.513 1.00 55.23 ? 265 VAL A CG1 1 ATOM 1884 C CG2 . VAL A 1 265 ? -28.994 -47.309 -110.637 1.00 53.27 ? 265 VAL A CG2 1 ATOM 1885 N N . LYS A 1 266 ? -33.084 -47.732 -108.230 1.00 60.65 ? 266 LYS A N 1 ATOM 1886 C CA . LYS A 1 266 ? -34.172 -47.235 -107.382 1.00 63.60 ? 266 LYS A CA 1 ATOM 1887 C C . LYS A 1 266 ? -33.614 -46.679 -106.071 1.00 62.78 ? 266 LYS A C 1 ATOM 1888 O O . LYS A 1 266 ? -32.830 -47.341 -105.385 1.00 60.30 ? 266 LYS A O 1 ATOM 1889 C CB . LYS A 1 266 ? -35.194 -48.339 -107.081 1.00 65.31 ? 266 LYS A CB 1 ATOM 1890 C CG . LYS A 1 266 ? -36.010 -48.798 -108.270 1.00 67.13 ? 266 LYS A CG 1 ATOM 1891 C CD . LYS A 1 266 ? -37.061 -49.819 -107.860 1.00 69.41 ? 266 LYS A CD 1 ATOM 1892 N N . HIS A 1 267 ? -34.028 -45.458 -105.737 1.00 65.18 ? 267 HIS A N 1 ATOM 1893 C CA . HIS A 1 267 ? -33.599 -44.783 -104.515 1.00 65.08 ? 267 HIS A CA 1 ATOM 1894 C C . HIS A 1 267 ? -34.688 -43.860 -103.971 1.00 69.23 ? 267 HIS A C 1 ATOM 1895 O O . HIS A 1 267 ? -35.394 -43.197 -104.737 1.00 72.03 ? 267 HIS A O 1 ATOM 1896 C CB . HIS A 1 267 ? -32.314 -43.989 -104.761 1.00 62.90 ? 267 HIS A CB 1 ATOM 1897 C CG . HIS A 1 267 ? -31.641 -43.536 -103.505 1.00 62.56 ? 267 HIS A CG 1 ATOM 1898 N ND1 . HIS A 1 267 ? -32.048 -42.423 -102.802 1.00 65.47 ? 267 HIS A ND1 1 ATOM 1899 C CD2 . HIS A 1 267 ? -30.597 -44.055 -102.817 1.00 60.29 ? 267 HIS A CD2 1 ATOM 1900 C CE1 . HIS A 1 267 ? -31.281 -42.272 -101.738 1.00 65.01 ? 267 HIS A CE1 1 ATOM 1901 N NE2 . HIS A 1 267 ? -30.392 -43.249 -101.724 1.00 62.14 ? 267 HIS A NE2 1 ATOM 1902 N N . SER A 1 268 ? -34.799 -43.811 -102.647 1.00 70.09 ? 268 SER A N 1 ATOM 1903 C CA . SER A 1 268 ? -35.800 -42.989 -101.955 1.00 74.61 ? 268 SER A CA 1 ATOM 1904 C C . SER A 1 268 ? -35.833 -41.509 -102.362 1.00 76.88 ? 268 SER A C 1 ATOM 1905 O O . SER A 1 268 ? -36.884 -40.869 -102.288 1.00 81.12 ? 268 SER A O 1 ATOM 1906 C CB . SER A 1 268 ? -35.610 -43.099 -100.438 1.00 74.80 ? 268 SER A CB 1 ATOM 1907 O OG . SER A 1 268 ? -34.285 -42.755 -100.061 1.00 72.36 ? 268 SER A OG 1 ATOM 1908 N N . SER A 1 269 ? -34.689 -40.979 -102.792 1.00 74.53 ? 269 SER A N 1 ATOM 1909 C CA . SER A 1 269 ? -34.554 -39.557 -103.132 1.00 76.84 ? 269 SER A CA 1 ATOM 1910 C C . SER A 1 269 ? -35.054 -39.200 -104.538 1.00 78.76 ? 269 SER A C 1 ATOM 1911 O O . SER A 1 269 ? -35.122 -38.021 -104.902 1.00 81.47 ? 269 SER A O 1 ATOM 1912 C CB . SER A 1 269 ? -33.102 -39.102 -102.958 1.00 73.98 ? 269 SER A CB 1 ATOM 1913 O OG . SER A 1 269 ? -32.274 -39.653 -103.960 1.00 70.53 ? 269 SER A OG 1 ATOM 1914 N N . LEU A 1 270 ? -35.398 -40.220 -105.321 1.00 77.68 ? 270 LEU A N 1 ATOM 1915 C CA . LEU A 1 270 ? -35.920 -40.021 -106.670 1.00 79.69 ? 270 LEU A CA 1 ATOM 1916 C C . LEU A 1 270 ? -37.430 -39.794 -106.649 1.00 84.95 ? 270 LEU A C 1 ATOM 1917 O O . LEU A 1 270 ? -37.956 -38.977 -107.411 1.00 88.50 ? 270 LEU A O 1 ATOM 1918 C CB . LEU A 1 270 ? -35.569 -41.217 -107.557 1.00 76.42 ? 270 LEU A CB 1 ATOM 1919 C CG . LEU A 1 270 ? -34.094 -41.625 -107.622 1.00 71.38 ? 270 LEU A CG 1 ATOM 1920 C CD1 . LEU A 1 270 ? -33.965 -43.000 -108.250 1.00 68.98 ? 270 LEU A CD1 1 ATOM 1921 C CD2 . LEU A 1 270 ? -33.253 -40.603 -108.381 1.00 70.94 ? 270 LEU A CD2 1 ATOM 1922 N N . GLY A 1 271 ? -38.116 -40.520 -105.767 1.00 85.86 ? 271 GLY A N 1 ATOM 1923 C CA . GLY A 1 271 ? -39.557 -40.382 -105.585 1.00 91.22 ? 271 GLY A CA 1 ATOM 1924 C C . GLY A 1 271 ? -40.356 -41.020 -106.702 1.00 93.06 ? 271 GLY A C 1 ATOM 1925 O O . GLY A 1 271 ? -41.260 -40.397 -107.257 1.00 97.85 ? 271 GLY A O 1 ATOM 1926 N N . GLY A 1 272 ? -40.021 -42.266 -107.031 1.00 89.78 ? 272 GLY A N 1 ATOM 1927 C CA . GLY A 1 272 ? -40.724 -43.014 -108.077 1.00 91.47 ? 272 GLY A CA 1 ATOM 1928 C C . GLY A 1 272 ? -40.444 -42.500 -109.480 1.00 91.81 ? 272 GLY A C 1 ATOM 1929 O O . GLY A 1 272 ? -41.374 -42.258 -110.260 1.00 96.13 ? 272 GLY A O 1 ATOM 1930 N N . GLN A 1 273 ? -39.158 -42.323 -109.784 1.00 87.60 ? 273 GLN A N 1 ATOM 1931 C CA . GLN A 1 273 ? -38.687 -41.889 -111.103 1.00 87.27 ? 273 GLN A CA 1 ATOM 1932 C C . GLN A 1 273 ? -37.221 -42.288 -111.226 1.00 81.70 ? 273 GLN A C 1 ATOM 1933 O O . GLN A 1 273 ? -36.317 -41.504 -110.920 1.00 80.17 ? 273 GLN A O 1 ATOM 1934 C CB . GLN A 1 273 ? -38.874 -40.377 -111.294 1.00 90.97 ? 273 GLN A CB 1 ATOM 1935 N N . ASP A 1 274 ? -37.007 -43.519 -111.683 1.00 79.14 ? 274 ASP A N 1 ATOM 1936 C CA . ASP A 1 274 ? -35.717 -44.197 -111.587 1.00 74.06 ? 274 ASP A CA 1 ATOM 1937 C C . ASP A 1 274 ? -34.709 -43.828 -112.662 1.00 72.36 ? 274 ASP A C 1 ATOM 1938 O O . ASP A 1 274 ? -35.067 -43.570 -113.812 1.00 74.55 ? 274 ASP A O 1 ATOM 1939 C CB . ASP A 1 274 ? -35.922 -45.712 -111.599 1.00 72.73 ? 274 ASP A CB 1 ATOM 1940 C CG . ASP A 1 274 ? -36.797 -46.193 -110.455 0.70 74.58 ? 274 ASP A CG 1 ATOM 1941 O OD1 . ASP A 1 274 ? -36.574 -45.761 -109.301 0.70 74.55 ? 274 ASP A OD1 1 ATOM 1942 O OD2 . ASP A 1 274 ? -37.706 -47.013 -110.711 0.70 76.76 ? 274 ASP A OD2 1 ATOM 1943 N N . ILE A 1 275 ? -33.443 -43.808 -112.254 1.00 68.80 ? 275 ILE A N 1 ATOM 1944 C CA . ILE A 1 275 ? -32.303 -43.709 -113.156 1.00 66.74 ? 275 ILE A CA 1 ATOM 1945 C C . ILE A 1 275 ? -32.241 -45.012 -113.954 1.00 65.33 ? 275 ILE A C 1 ATOM 1946 O O . ILE A 1 275 ? -32.066 -46.090 -113.376 1.00 63.26 ? 275 ILE A O 1 ATOM 1947 C CB . ILE A 1 275 ? -30.974 -43.522 -112.360 1.00 63.63 ? 275 ILE A CB 1 ATOM 1948 C CG1 . ILE A 1 275 ? -31.085 -42.358 -111.370 1.00 65.22 ? 275 ILE A CG1 1 ATOM 1949 C CG2 . ILE A 1 275 ? -29.783 -43.319 -113.297 1.00 62.07 ? 275 ILE A CG2 1 ATOM 1950 N N . ILE A 1 276 ? -32.415 -44.912 -115.272 1.00 66.85 ? 276 ILE A N 1 ATOM 1951 C CA . ILE A 1 276 ? -32.388 -46.088 -116.149 1.00 66.03 ? 276 ILE A CA 1 ATOM 1952 C C . ILE A 1 276 ? -31.352 -45.910 -117.260 1.00 64.87 ? 276 ILE A C 1 ATOM 1953 O O . ILE A 1 276 ? -31.479 -45.018 -118.103 1.00 67.14 ? 276 ILE A O 1 ATOM 1954 C CB . ILE A 1 276 ? -33.786 -46.414 -116.752 1.00 69.76 ? 276 ILE A CB 1 ATOM 1955 C CG1 . ILE A 1 276 ? -34.883 -46.327 -115.682 1.00 71.89 ? 276 ILE A CG1 1 ATOM 1956 C CG2 . ILE A 1 276 ? -33.785 -47.810 -117.388 1.00 69.08 ? 276 ILE A CG2 1 ATOM 1957 C CD1 . ILE A 1 276 ? -36.235 -45.855 -116.203 1.00 76.85 ? 276 ILE A CD1 1 ATOM 1958 N N . LEU A 1 277 ? -30.328 -46.763 -117.244 1.00 61.60 ? 277 LEU A N 1 ATOM 1959 C CA . LEU A 1 277 ? -29.225 -46.673 -118.199 1.00 60.52 ? 277 LEU A CA 1 ATOM 1960 C C . LEU A 1 277 ? -29.205 -47.832 -119.178 1.00 60.55 ? 277 LEU A C 1 ATOM 1961 O O . LEU A 1 277 ? -28.929 -48.967 -118.789 1.00 58.76 ? 277 LEU A O 1 ATOM 1962 C CB . LEU A 1 277 ? -27.878 -46.607 -117.478 1.00 57.39 ? 277 LEU A CB 1 ATOM 1963 C CG . LEU A 1 277 ? -27.510 -45.336 -116.724 1.00 57.18 ? 277 LEU A CG 1 ATOM 1964 C CD1 . LEU A 1 277 ? -26.070 -45.448 -116.299 1.00 54.40 ? 277 LEU A CD1 1 ATOM 1965 C CD2 . LEU A 1 277 ? -27.727 -44.085 -117.566 1.00 60.17 ? 277 LEU A CD2 1 ATOM 1966 N N . TYR A 1 278 ? -29.478 -47.528 -120.447 1.00 62.84 ? 278 TYR A N 1 ATOM 1967 C CA . TYR A 1 278 ? -29.494 -48.525 -121.507 1.00 63.43 ? 278 TYR A CA 1 ATOM 1968 C C . TYR A 1 278 ? -28.115 -48.696 -122.116 1.00 61.77 ? 278 TYR A C 1 ATOM 1969 O O . TYR A 1 278 ? -27.528 -47.730 -122.605 1.00 62.41 ? 278 TYR A O 1 ATOM 1970 C CB . TYR A 1 278 ? -30.496 -48.130 -122.590 1.00 67.50 ? 278 TYR A CB 1 ATOM 1971 C CG . TYR A 1 278 ? -31.940 -48.285 -122.174 1.00 70.32 ? 278 TYR A CG 1 ATOM 1972 C CD1 . TYR A 1 278 ? -32.609 -47.258 -121.509 1.00 72.22 ? 278 TYR A CD1 1 ATOM 1973 C CD2 . TYR A 1 278 ? -32.640 -49.461 -122.448 1.00 72.05 ? 278 TYR A CD2 1 ATOM 1974 C CE1 . TYR A 1 278 ? -33.942 -47.399 -121.125 1.00 75.14 ? 278 TYR A CE1 1 ATOM 1975 C CE2 . TYR A 1 278 ? -33.974 -49.614 -122.069 1.00 74.77 ? 278 TYR A CE2 1 ATOM 1976 C CZ . TYR A 1 278 ? -34.619 -48.579 -121.409 1.00 76.25 ? 278 TYR A CZ 1 ATOM 1977 O OH . TYR A 1 278 ? -35.937 -48.724 -121.032 1.00 79.18 ? 278 TYR A OH 1 ATOM 1978 N N . TRP A 1 279 ? -27.604 -49.927 -122.078 1.00 59.95 ? 279 TRP A N 1 ATOM 1979 C CA . TRP A 1 279 ? -26.332 -50.251 -122.707 1.00 58.99 ? 279 TRP A CA 1 ATOM 1980 C C . TRP A 1 279 ? -26.437 -50.073 -124.209 1.00 61.90 ? 279 TRP A C 1 ATOM 1981 O O . TRP A 1 279 ? -27.116 -50.841 -124.886 1.00 63.56 ? 279 TRP A O 1 ATOM 1982 C CB . TRP A 1 279 ? -25.885 -51.687 -122.400 1.00 57.29 ? 279 TRP A CB 1 ATOM 1983 C CG . TRP A 1 279 ? -24.575 -52.017 -123.075 1.00 56.79 ? 279 TRP A CG 1 ATOM 1984 C CD1 . TRP A 1 279 ? -24.399 -52.423 -124.365 1.00 58.38 ? 279 TRP A CD1 1 ATOM 1985 C CD2 . TRP A 1 279 ? -23.260 -51.923 -122.502 1.00 54.95 ? 279 TRP A CD2 1 ATOM 1986 N NE1 . TRP A 1 279 ? -23.065 -52.597 -124.631 1.00 58.13 ? 279 TRP A NE1 1 ATOM 1987 C CE2 . TRP A 1 279 ? -22.342 -52.298 -123.506 1.00 55.92 ? 279 TRP A CE2 1 ATOM 1988 C CE3 . TRP A 1 279 ? -22.770 -51.570 -121.234 1.00 52.91 ? 279 TRP A CE3 1 ATOM 1989 C CZ2 . TRP A 1 279 ? -20.955 -52.329 -123.284 1.00 55.11 ? 279 TRP A CZ2 1 ATOM 1990 C CZ3 . TRP A 1 279 ? -21.389 -51.601 -121.014 1.00 51.69 ? 279 TRP A CZ3 1 ATOM 1991 C CH2 . TRP A 1 279 ? -20.500 -51.975 -122.036 1.00 52.76 ? 279 TRP A CH2 1 ATOM 1992 N N . GLY A 1 280 ? -25.760 -49.054 -124.723 1.00 62.95 ? 280 GLY A N 1 ATOM 1993 C CA . GLY A 1 280 ? -25.648 -48.856 -126.165 1.00 66.03 ? 280 GLY A CA 1 ATOM 1994 C C . GLY A 1 280 ? -26.570 -47.795 -126.720 1.00 69.32 ? 280 GLY A C 1 ATOM 1995 O O . GLY A 1 280 ? -26.776 -47.720 -127.930 1.00 72.35 ? 280 GLY A O 1 ATOM 1996 N N . SER A 1 281 ? -27.134 -46.988 -125.829 1.00 69.24 ? 281 SER A N 1 ATOM 1997 C CA . SER A 1 281 ? -27.907 -45.821 -126.218 1.00 72.72 ? 281 SER A CA 1 ATOM 1998 C C . SER A 1 281 ? -26.958 -44.679 -126.582 1.00 73.83 ? 281 SER A C 1 ATOM 1999 O O . SER A 1 281 ? -25.798 -44.683 -126.167 1.00 71.32 ? 281 SER A O 1 ATOM 2000 C CB . SER A 1 281 ? -28.829 -45.406 -125.074 1.00 72.46 ? 281 SER A CB 1 ATOM 2001 O OG . SER A 1 281 ? -28.095 -45.186 -123.882 1.00 69.38 ? 281 SER A OG 1 ATOM 2002 N N . LEU A 1 282 ? -27.458 -43.708 -127.350 1.00 78.07 ? 282 LEU A N 1 ATOM 2003 C CA . LEU A 1 282 ? -26.678 -42.531 -127.772 1.00 80.31 ? 282 LEU A CA 1 ATOM 2004 C C . LEU A 1 282 ? -25.974 -41.832 -126.605 1.00 78.39 ? 282 LEU A C 1 ATOM 2005 O O . LEU A 1 282 ? -24.880 -41.297 -126.766 1.00 78.44 ? 282 LEU A O 1 ATOM 2006 C CB . LEU A 1 282 ? -27.559 -41.534 -128.537 1.00 85.16 ? 282 LEU A CB 1 ATOM 2007 N N . HIS A 1 283 ? -26.613 -41.850 -125.436 1.00 77.23 ? 283 HIS A N 1 ATOM 2008 C CA . HIS A 1 283 ? -26.024 -41.335 -124.203 1.00 75.46 ? 283 HIS A CA 1 ATOM 2009 C C . HIS A 1 283 ? -24.838 -42.200 -123.755 1.00 71.67 ? 283 HIS A C 1 ATOM 2010 O O . HIS A 1 283 ? -23.751 -41.674 -123.514 1.00 71.31 ? 283 HIS A O 1 ATOM 2011 C CB . HIS A 1 283 ? -27.091 -41.228 -123.103 1.00 75.26 ? 283 HIS A CB 1 ATOM 2012 C CG . HIS A 1 283 ? -26.592 -40.632 -121.821 1.00 74.29 ? 283 HIS A CG 1 ATOM 2013 N ND1 . HIS A 1 283 ? -26.275 -39.295 -121.694 1.00 76.90 ? 283 HIS A ND1 1 ATOM 2014 C CD2 . HIS A 1 283 ? -26.370 -41.189 -120.605 1.00 71.56 ? 283 HIS A CD2 1 ATOM 2015 C CE1 . HIS A 1 283 ? -25.871 -39.057 -120.457 1.00 75.27 ? 283 HIS A CE1 1 ATOM 2016 N NE2 . HIS A 1 283 ? -25.921 -40.189 -119.776 1.00 72.07 ? 283 HIS A NE2 1 ATOM 2017 N N . HIS A 1 284 ? -25.039 -43.516 -123.660 1.00 69.46 ? 284 HIS A N 1 ATOM 2018 C CA . HIS A 1 284 ? -23.945 -44.436 -123.326 1.00 66.48 ? 284 HIS A CA 1 ATOM 2019 C C . HIS A 1 284 ? -22.784 -44.303 -124.310 1.00 67.55 ? 284 HIS A C 1 ATOM 2020 O O . HIS A 1 284 ? -21.628 -44.254 -123.893 1.00 66.24 ? 284 HIS A O 1 ATOM 2021 C CB . HIS A 1 284 ? -24.428 -45.890 -123.255 1.00 64.89 ? 284 HIS A CB 1 ATOM 2022 C CG . HIS A 1 284 ? -23.334 -46.895 -123.021 1.00 63.03 ? 284 HIS A CG 1 ATOM 2023 N ND1 . HIS A 1 284 ? -22.166 -46.594 -122.348 1.00 61.89 ? 284 HIS A ND1 1 ATOM 2024 C CD2 . HIS A 1 284 ? -23.250 -48.211 -123.340 1.00 62.51 ? 284 HIS A CD2 1 ATOM 2025 C CE1 . HIS A 1 284 ? -21.404 -47.673 -122.282 1.00 60.27 ? 284 HIS A CE1 1 ATOM 2026 N NE2 . HIS A 1 284 ? -22.041 -48.669 -122.872 1.00 60.67 ? 284 HIS A NE2 1 ATOM 2027 N N . ILE A 1 285 ? -23.095 -44.237 -125.604 1.00 70.25 ? 285 ILE A N 1 ATOM 2028 C CA . ILE A 1 285 ? -22.069 -44.087 -126.631 1.00 71.91 ? 285 ILE A CA 1 ATOM 2029 C C . ILE A 1 285 ? -21.289 -42.793 -126.398 1.00 73.20 ? 285 ILE A C 1 ATOM 2030 O O . ILE A 1 285 ? -20.058 -42.806 -126.391 1.00 72.83 ? 285 ILE A O 1 ATOM 2031 C CB . ILE A 1 285 ? -22.656 -44.097 -128.081 1.00 75.44 ? 285 ILE A CB 1 ATOM 2032 C CG1 . ILE A 1 285 ? -23.658 -45.248 -128.303 1.00 75.12 ? 285 ILE A CG1 1 ATOM 2033 C CG2 . ILE A 1 285 ? -21.538 -44.115 -129.122 1.00 77.12 ? 285 ILE A CG2 1 ATOM 2034 C CD1 . ILE A 1 285 ? -23.075 -46.670 -128.291 1.00 73.48 ? 285 ILE A CD1 1 ATOM 2035 N N . LEU A 1 286 ? -22.014 -41.691 -126.188 1.00 75.15 ? 286 LEU A N 1 ATOM 2036 C CA . LEU A 1 286 ? -21.412 -40.357 -126.047 1.00 77.15 ? 286 LEU A CA 1 ATOM 2037 C C . LEU A 1 286 ? -20.531 -40.209 -124.819 1.00 74.54 ? 286 LEU A C 1 ATOM 2038 O O . LEU A 1 286 ? -19.490 -39.554 -124.880 1.00 76.00 ? 286 LEU A O 1 ATOM 2039 C CB . LEU A 1 286 ? -22.480 -39.256 -126.036 1.00 80.10 ? 286 LEU A CB 1 ATOM 2040 C CG . LEU A 1 286 ? -22.936 -38.686 -127.381 1.00 84.94 ? 286 LEU A CG 1 ATOM 2041 C CD1 . LEU A 1 286 ? -24.140 -37.772 -127.193 1.00 87.89 ? 286 LEU A CD1 1 ATOM 2042 C CD2 . LEU A 1 286 ? -21.800 -37.948 -128.086 1.00 87.94 ? 286 LEU A CD2 1 ATOM 2043 N N . ASP A 1 287 ? -20.955 -40.807 -123.710 1.00 71.16 ? 287 ASP A N 1 ATOM 2044 C CA . ASP A 1 287 ? -20.224 -40.694 -122.457 1.00 68.81 ? 287 ASP A CA 1 ATOM 2045 C C . ASP A 1 287 ? -18.977 -41.571 -122.467 1.00 66.96 ? 287 ASP A C 1 ATOM 2046 O O . ASP A 1 287 ? -17.877 -41.088 -122.210 1.00 67.38 ? 287 ASP A O 1 ATOM 2047 C CB . ASP A 1 287 ? -21.128 -41.039 -121.273 1.00 66.56 ? 287 ASP A CB 1 ATOM 2048 N N . ALA A 1 288 ? -19.152 -42.853 -122.784 1.00 65.41 ? 288 ALA A N 1 ATOM 2049 C CA . ALA A 1 288 ? -18.040 -43.813 -122.848 1.00 64.15 ? 288 ALA A CA 1 ATOM 2050 C C . ALA A 1 288 ? -16.882 -43.352 -123.746 1.00 66.74 ? 288 ALA A C 1 ATOM 2051 O O . ALA A 1 288 ? -15.747 -43.827 -123.605 1.00 66.41 ? 288 ALA A O 1 ATOM 2052 C CB . ALA A 1 288 ? -18.543 -45.185 -123.284 1.00 62.91 ? 288 ALA A CB 1 ATOM 2053 N N . GLN A 1 289 ? -17.174 -42.433 -124.664 1.00 69.63 ? 289 GLN A N 1 ATOM 2054 C CA . GLN A 1 289 ? -16.147 -41.830 -125.497 1.00 72.64 ? 289 GLN A CA 1 ATOM 2055 C C . GLN A 1 289 ? -15.390 -40.765 -124.710 1.00 73.45 ? 289 GLN A C 1 ATOM 2056 O O . GLN A 1 289 ? -14.166 -40.670 -124.813 1.00 74.75 ? 289 GLN A O 1 ATOM 2057 C CB . GLN A 1 289 ? -16.760 -41.225 -126.762 1.00 76.17 ? 289 GLN A CB 1 ATOM 2058 N N . LYS A 1 290 ? -16.123 -39.980 -123.917 1.00 73.03 ? 290 LYS A N 1 ATOM 2059 C CA . LYS A 1 290 ? -15.550 -38.877 -123.128 1.00 74.04 ? 290 LYS A CA 1 ATOM 2060 C C . LYS A 1 290 ? -14.530 -39.359 -122.096 1.00 71.78 ? 290 LYS A C 1 ATOM 2061 O O . LYS A 1 290 ? -13.862 -38.542 -121.454 1.00 73.12 ? 290 LYS A O 1 ATOM 2062 C CB . LYS A 1 290 ? -16.649 -38.070 -122.418 1.00 74.05 ? 290 LYS A CB 1 ATOM 2063 C CG . LYS A 1 290 ? -17.505 -37.216 -123.329 1.00 77.46 ? 290 LYS A CG 1 ATOM 2064 N N . MET A 1 291 ? -14.398 -40.676 -121.953 1.00 68.66 ? 291 MET A N 1 ATOM 2065 C CA . MET A 1 291 ? -13.537 -41.243 -120.921 1.00 66.53 ? 291 MET A CA 1 ATOM 2066 C C . MET A 1 291 ? -12.533 -42.300 -121.398 1.00 66.23 ? 291 MET A C 1 ATOM 2067 O O . MET A 1 291 ? -12.127 -43.164 -120.619 1.00 64.39 ? 291 MET A O 1 ATOM 2068 C CB . MET A 1 291 ? -14.380 -41.779 -119.757 1.00 63.34 ? 291 MET A CB 1 ATOM 2069 C CG . MET A 1 291 ? -15.438 -42.797 -120.132 1.00 61.79 ? 291 MET A CG 1 ATOM 2070 S SD . MET A 1 291 ? -16.234 -43.463 -118.664 1.00 59.72 ? 291 MET A SD 1 ATOM 2071 C CE . MET A 1 291 ? -15.096 -44.780 -118.220 1.00 58.29 ? 291 MET A CE 1 ATOM 2072 N N . VAL A 1 292 ? -12.122 -42.227 -122.661 1.00 68.47 ? 292 VAL A N 1 ATOM 2073 C CA . VAL A 1 292 ? -11.140 -43.176 -123.203 1.00 68.79 ? 292 VAL A CA 1 ATOM 2074 C C . VAL A 1 292 ? -9.731 -42.913 -122.674 1.00 70.13 ? 292 VAL A C 1 ATOM 2075 O O . VAL A 1 292 ? -9.424 -41.804 -122.238 1.00 71.61 ? 292 VAL A O 1 ATOM 2076 C CB . VAL A 1 292 ? -11.138 -43.202 -124.750 1.00 71.57 ? 292 VAL A CB 1 ATOM 2077 C CG1 . VAL A 1 292 ? -12.399 -43.887 -125.270 1.00 70.09 ? 292 VAL A CG1 1 ATOM 2078 C CG2 . VAL A 1 292 ? -10.993 -41.793 -125.327 1.00 75.06 ? 292 VAL A CG2 1 ATOM 2079 N N . TRP A 1 293 ? -8.888 -43.944 -122.710 1.00 70.00 ? 293 TRP A N 1 ATOM 2080 C CA . TRP A 1 293 ? -7.528 -43.887 -122.161 1.00 71.54 ? 293 TRP A CA 1 ATOM 2081 C C . TRP A 1 293 ? -6.652 -45.024 -122.697 1.00 72.82 ? 293 TRP A C 1 ATOM 2082 O O . TRP A 1 293 ? -7.155 -45.950 -123.340 1.00 71.80 ? 293 TRP A O 1 ATOM 2083 C CB . TRP A 1 293 ? -7.561 -43.896 -120.623 1.00 69.15 ? 293 TRP A CB 1 ATOM 2084 C CG . TRP A 1 293 ? -8.109 -45.164 -119.992 1.00 65.29 ? 293 TRP A CG 1 ATOM 2085 C CD1 . TRP A 1 293 ? -9.358 -45.695 -120.157 1.00 61.85 ? 293 TRP A CD1 1 ATOM 2086 C CD2 . TRP A 1 293 ? -7.424 -46.028 -119.077 1.00 64.17 ? 293 TRP A CD2 1 ATOM 2087 N NE1 . TRP A 1 293 ? -9.483 -46.840 -119.418 1.00 59.46 ? 293 TRP A NE1 1 ATOM 2088 C CE2 . TRP A 1 293 ? -8.314 -47.068 -118.743 1.00 60.75 ? 293 TRP A CE2 1 ATOM 2089 C CE3 . TRP A 1 293 ? -6.142 -46.027 -118.512 1.00 66.19 ? 293 TRP A CE3 1 ATOM 2090 C CZ2 . TRP A 1 293 ? -7.964 -48.100 -117.867 1.00 59.76 ? 293 TRP A CZ2 1 ATOM 2091 C CZ3 . TRP A 1 293 ? -5.796 -47.053 -117.638 1.00 65.05 ? 293 TRP A CZ3 1 ATOM 2092 C CH2 . TRP A 1 293 ? -6.705 -48.074 -117.325 1.00 61.64 ? 293 TRP A CH2 1 ATOM 2093 N N . ASN A 1 294 ? -5.349 -44.954 -122.418 1.00 75.31 ? 294 ASN A N 1 ATOM 2094 C CA . ASN A 1 294 ? -4.375 -45.904 -122.966 1.00 77.59 ? 294 ASN A CA 1 ATOM 2095 C C . ASN A 1 294 ? -4.421 -47.335 -122.405 1.00 75.52 ? 294 ASN A C 1 ATOM 2096 O O . ASN A 1 294 ? -3.796 -48.235 -122.958 1.00 77.59 ? 294 ASN A O 1 ATOM 2097 C CB . ASN A 1 294 ? -2.957 -45.335 -122.867 1.00 81.71 ? 294 ASN A CB 1 ATOM 2098 C CG . ASN A 1 294 ? -2.515 -45.103 -121.439 1.00 81.01 ? 294 ASN A CG 1 ATOM 2099 O OD1 . ASN A 1 294 ? -3.136 -45.587 -120.492 1.00 77.86 ? 294 ASN A OD1 1 ATOM 2100 N ND2 . ASN A 1 294 ? -1.433 -44.356 -121.275 1.00 84.77 ? 294 ASN A ND2 1 ATOM 2101 N N . HIS A 1 295 ? -5.145 -47.537 -121.308 1.00 72.10 ? 295 HIS A N 1 ATOM 2102 C CA . HIS A 1 295 ? -5.380 -48.876 -120.739 1.00 70.22 ? 295 HIS A CA 1 ATOM 2103 C C . HIS A 1 295 ? -4.209 -49.526 -119.987 1.00 72.10 ? 295 HIS A C 1 ATOM 2104 O O . HIS A 1 295 ? -4.289 -50.694 -119.605 1.00 71.24 ? 295 HIS A O 1 ATOM 2105 C CB . HIS A 1 295 ? -5.960 -49.837 -121.785 1.00 69.89 ? 295 HIS A CB 1 ATOM 2106 C CG . HIS A 1 295 ? -7.445 -49.732 -121.938 1.00 67.38 ? 295 HIS A CG 1 ATOM 2107 N ND1 . HIS A 1 295 ? -8.049 -48.739 -122.678 1.00 68.24 ? 295 HIS A ND1 1 ATOM 2108 C CD2 . HIS A 1 295 ? -8.449 -50.490 -121.437 1.00 64.78 ? 295 HIS A CD2 1 ATOM 2109 C CE1 . HIS A 1 295 ? -9.360 -48.895 -122.634 1.00 65.60 ? 295 HIS A CE1 1 ATOM 2110 N NE2 . HIS A 1 295 ? -9.629 -49.950 -121.887 1.00 63.45 ? 295 HIS A NE2 1 ATOM 2111 N N . ARG A 1 296 ? -3.136 -48.774 -119.768 1.00 75.18 ? 296 ARG A N 1 ATOM 2112 C CA . ARG A 1 296 ? -2.054 -49.201 -118.883 1.00 77.35 ? 296 ARG A CA 1 ATOM 2113 C C . ARG A 1 296 ? -2.030 -48.236 -117.710 1.00 76.85 ? 296 ARG A C 1 ATOM 2114 O O . ARG A 1 296 ? -2.123 -47.027 -117.919 1.00 77.73 ? 296 ARG A O 1 ATOM 2115 C CB . ARG A 1 296 ? -0.698 -49.193 -119.602 1.00 82.44 ? 296 ARG A CB 1 ATOM 2116 C CG . ARG A 1 296 ? -0.548 -48.102 -120.667 1.00 84.79 ? 296 ARG A CG 1 ATOM 2117 C CD . ARG A 1 296 ? 0.885 -47.606 -120.832 1.00 89.84 ? 296 ARG A CD 1 ATOM 2118 N NE . ARG A 1 296 ? 1.260 -46.682 -119.764 1.00 90.02 ? 296 ARG A NE 1 ATOM 2119 C CZ . ARG A 1 296 ? 2.384 -46.755 -119.059 1.00 93.05 ? 296 ARG A CZ 1 ATOM 2120 N NH1 . ARG A 1 296 ? 3.282 -47.701 -119.312 1.00 95.93 ? 296 ARG A NH1 1 ATOM 2121 N NH2 . ARG A 1 296 ? 2.617 -45.863 -118.105 1.00 93.38 ? 296 ARG A NH2 1 ATOM 2122 N N . HIS A 1 297 ? -1.935 -48.735 -116.476 1.00 75.97 ? 297 HIS A N 1 ATOM 2123 C CA . HIS A 1 297 ? -1.915 -50.157 -116.154 1.00 75.44 ? 297 HIS A CA 1 ATOM 2124 C C . HIS A 1 297 ? -3.316 -50.579 -115.719 1.00 71.14 ? 297 HIS A C 1 ATOM 2125 O O . HIS A 1 297 ? -3.822 -50.114 -114.697 1.00 68.96 ? 297 HIS A O 1 ATOM 2126 C CB . HIS A 1 297 ? -0.933 -50.437 -115.006 1.00 77.49 ? 297 HIS A CB 1 ATOM 2127 C CG . HIS A 1 297 ? 0.347 -49.661 -115.084 1.00 81.44 ? 297 HIS A CG 1 ATOM 2128 N ND1 . HIS A 1 297 ? 0.393 -48.285 -115.019 1.00 81.50 ? 297 HIS A ND1 1 ATOM 2129 C CD2 . HIS A 1 297 ? 1.633 -50.074 -115.186 1.00 85.78 ? 297 HIS A CD2 1 ATOM 2130 C CE1 . HIS A 1 297 ? 1.648 -47.884 -115.099 1.00 86.33 ? 297 HIS A CE1 1 ATOM 2131 N NE2 . HIS A 1 297 ? 2.421 -48.950 -115.197 1.00 88.75 ? 297 HIS A NE2 1 ATOM 2132 N N . HIS A 1 298 ? -3.952 -51.447 -116.498 1.00 70.38 ? 298 HIS A N 1 ATOM 2133 C CA . HIS A 1 298 ? -5.237 -52.005 -116.096 1.00 67.14 ? 298 HIS A CA 1 ATOM 2134 C C . HIS A 1 298 ? -5.007 -53.154 -115.111 1.00 67.54 ? 298 HIS A C 1 ATOM 2135 O O . HIS A 1 298 ? -3.872 -53.603 -114.934 1.00 70.69 ? 298 HIS A O 1 ATOM 2136 C CB . HIS A 1 298 ? -6.065 -52.446 -117.310 1.00 66.16 ? 298 HIS A CB 1 ATOM 2137 C CG . HIS A 1 298 ? -5.413 -53.507 -118.140 1.00 68.90 ? 298 HIS A CG 1 ATOM 2138 N ND1 . HIS A 1 298 ? -4.782 -53.234 -119.333 1.00 71.86 ? 298 HIS A ND1 1 ATOM 2139 C CD2 . HIS A 1 298 ? -5.301 -54.843 -117.952 1.00 69.87 ? 298 HIS A CD2 1 ATOM 2140 C CE1 . HIS A 1 298 ? -4.301 -54.354 -119.843 1.00 74.42 ? 298 HIS A CE1 1 ATOM 2141 N NE2 . HIS A 1 298 ? -4.603 -55.346 -119.024 1.00 73.37 ? 298 HIS A NE2 1 ATOM 2142 N N . HIS A 1 299 ? -6.077 -53.605 -114.458 1.00 65.00 ? 299 HIS A N 1 ATOM 2143 C CA . HIS A 1 299 ? -5.995 -54.730 -113.526 1.00 65.65 ? 299 HIS A CA 1 ATOM 2144 C C . HIS A 1 299 ? -5.973 -56.064 -114.270 1.00 67.19 ? 299 HIS A C 1 ATOM 2145 O O . HIS A 1 299 ? -6.757 -56.282 -115.200 1.00 66.06 ? 299 HIS A O 1 ATOM 2146 C CB . HIS A 1 299 ? -7.149 -54.686 -112.521 1.00 62.61 ? 299 HIS A CB 1 ATOM 2147 C CG . HIS A 1 299 ? -6.991 -53.635 -111.465 0.70 62.30 ? 299 HIS A CG 1 ATOM 2148 N ND1 . HIS A 1 299 ? -6.874 -53.937 -110.126 0.70 62.67 ? 299 HIS A ND1 1 ATOM 2149 C CD2 . HIS A 1 299 ? -6.918 -52.285 -111.553 1.00 62.14 ? 299 HIS A CD2 1 ATOM 2150 C CE1 . HIS A 1 299 ? -6.747 -52.818 -109.434 0.70 62.53 ? 299 HIS A CE1 1 ATOM 2151 N NE2 . HIS A 1 299 ? -6.770 -51.801 -110.276 0.70 62.05 ? 299 HIS A NE2 1 ATOM 2152 N N . HIS A 1 300 ? -5.061 -56.942 -113.856 1.00 70.27 ? 300 HIS A N 1 ATOM 2153 C CA . HIS A 1 300 ? -4.877 -58.250 -114.485 1.00 72.67 ? 300 HIS A CA 1 ATOM 2154 C C . HIS A 1 300 ? -6.012 -59.214 -114.140 1.00 70.63 ? 300 HIS A C 1 ATOM 2155 O O . HIS A 1 300 ? -6.459 -59.984 -114.990 1.00 70.89 ? 300 HIS A O 1 ATOM 2156 C CB . HIS A 1 300 ? -3.526 -58.846 -114.081 1.00 77.07 ? 300 HIS A CB 1 ATOM 2157 C CG . HIS A 1 300 ? -3.479 -60.341 -114.152 1.00 80.04 ? 300 HIS A CG 1 ATOM 2158 N ND1 . HIS A 1 300 ? -3.395 -61.028 -115.345 1.00 82.59 ? 300 HIS A ND1 1 ATOM 2159 C CD2 . HIS A 1 300 ? -3.513 -61.282 -113.178 1.00 81.45 ? 300 HIS A CD2 1 ATOM 2160 C CE1 . HIS A 1 300 ? -3.375 -62.327 -115.103 1.00 84.75 ? 300 HIS A CE1 1 ATOM 2161 N NE2 . HIS A 1 300 ? -3.445 -62.507 -113.795 1.00 84.27 ? 300 HIS A NE2 1 ATOM 2162 N N . GLN B 2 2 ? -1.454 -60.096 -87.878 1.00 84.66 ? 2 GLN B N 1 ATOM 2163 C CA . GLN B 2 2 ? -1.153 -59.193 -89.030 1.00 81.60 ? 2 GLN B CA 1 ATOM 2164 C C . GLN B 2 2 ? -1.999 -59.538 -90.261 1.00 78.48 ? 2 GLN B C 1 ATOM 2165 O O . GLN B 2 2 ? -1.694 -60.485 -90.994 1.00 80.84 ? 2 GLN B O 1 ATOM 2166 C CB . GLN B 2 2 ? 0.343 -59.224 -89.371 1.00 85.42 ? 2 GLN B CB 1 ATOM 2167 N N . LYS B 2 3 ? -3.060 -58.759 -90.473 1.00 73.82 ? 3 LYS B N 1 ATOM 2168 C CA . LYS B 2 3 ? -3.978 -58.954 -91.594 1.00 70.74 ? 3 LYS B CA 1 ATOM 2169 C C . LYS B 2 3 ? -3.702 -57.969 -92.730 1.00 67.92 ? 3 LYS B C 1 ATOM 2170 O O . LYS B 2 3 ? -3.537 -56.765 -92.501 1.00 66.03 ? 3 LYS B O 1 ATOM 2171 C CB . LYS B 2 3 ? -5.432 -58.857 -91.126 1.00 68.36 ? 3 LYS B CB 1 ATOM 2172 C CG . LYS B 2 3 ? -5.865 -60.007 -90.226 1.00 71.37 ? 3 LYS B CG 1 ATOM 2173 C CD . LYS B 2 3 ? -7.270 -59.784 -89.681 1.00 69.93 ? 3 LYS B CD 1 ATOM 2174 N N . THR B 2 4 ? -3.668 -58.508 -93.950 1.00 67.92 ? 4 THR B N 1 ATOM 2175 C CA . THR B 2 4 ? -3.236 -57.798 -95.157 1.00 66.13 ? 4 THR B CA 1 ATOM 2176 C C . THR B 2 4 ? -4.284 -56.810 -95.681 1.00 61.63 ? 4 THR B C 1 ATOM 2177 O O . THR B 2 4 ? -5.448 -57.178 -95.844 1.00 60.37 ? 4 THR B O 1 ATOM 2178 C CB . THR B 2 4 ? -2.882 -58.810 -96.267 1.00 68.57 ? 4 THR B CB 1 ATOM 2179 O OG1 . THR B 2 4 ? -1.930 -59.755 -95.765 1.00 72.88 ? 4 THR B OG1 1 ATOM 2180 C CG2 . THR B 2 4 ? -2.302 -58.110 -97.492 1.00 68.08 ? 4 THR B CG2 1 ATOM 2181 N N . PRO B 2 5 ? -3.869 -55.555 -95.954 1.00 59.81 ? 5 PRO B N 1 ATOM 2182 C CA . PRO B 2 5 ? -4.776 -54.497 -96.413 1.00 56.07 ? 5 PRO B CA 1 ATOM 2183 C C . PRO B 2 5 ? -5.237 -54.622 -97.863 1.00 54.76 ? 5 PRO B C 1 ATOM 2184 O O . PRO B 2 5 ? -4.423 -54.797 -98.763 1.00 56.16 ? 5 PRO B O 1 ATOM 2185 C CB . PRO B 2 5 ? -3.939 -53.225 -96.250 1.00 55.96 ? 5 PRO B CB 1 ATOM 2186 C CG . PRO B 2 5 ? -2.539 -53.677 -96.336 1.00 59.49 ? 5 PRO B CG 1 ATOM 2187 C CD . PRO B 2 5 ? -2.509 -55.038 -95.713 1.00 61.96 ? 5 PRO B CD 1 ATOM 2188 N N . GLN B 2 6 ? -6.544 -54.531 -98.073 1.00 52.71 ? 6 GLN B N 1 ATOM 2189 C CA . GLN B 2 6 ? -7.108 -54.402 -99.410 1.00 51.64 ? 6 GLN B CA 1 ATOM 2190 C C . GLN B 2 6 ? -7.198 -52.909 -99.784 1.00 49.53 ? 6 GLN B C 1 ATOM 2191 O O . GLN B 2 6 ? -7.349 -52.052 -98.909 1.00 48.68 ? 6 GLN B O 1 ATOM 2192 C CB . GLN B 2 6 ? -8.483 -55.073 -99.478 1.00 51.36 ? 6 GLN B CB 1 ATOM 2193 N N . ILE B 2 7 ? -7.092 -52.612 -101.078 1.00 49.07 ? 7 ILE B N 1 ATOM 2194 C CA . ILE B 2 7 ? -7.086 -51.243 -101.579 1.00 47.48 ? 7 ILE B CA 1 ATOM 2195 C C . ILE B 2 7 ? -8.093 -51.122 -102.724 1.00 46.78 ? 7 ILE B C 1 ATOM 2196 O O . ILE B 2 7 ? -8.126 -51.962 -103.619 1.00 48.07 ? 7 ILE B O 1 ATOM 2197 C CB . ILE B 2 7 ? -5.660 -50.821 -102.061 1.00 48.85 ? 7 ILE B CB 1 ATOM 2198 C CG1 . ILE B 2 7 ? -4.629 -50.993 -100.940 1.00 50.38 ? 7 ILE B CG1 1 ATOM 2199 C CG2 . ILE B 2 7 ? -5.635 -49.371 -102.538 1.00 47.72 ? 7 ILE B CG2 1 ATOM 2200 C CD1 . ILE B 2 7 ? -3.212 -51.257 -101.432 1.00 53.26 ? 7 ILE B CD1 1 ATOM 2201 N N . GLN B 2 8 ? -8.920 -50.080 -102.678 1.00 45.26 ? 8 GLN B N 1 ATOM 2202 C CA . GLN B 2 8 ? -9.892 -49.790 -103.734 1.00 44.76 ? 8 GLN B CA 1 ATOM 2203 C C . GLN B 2 8 ? -9.801 -48.320 -104.160 1.00 44.20 ? 8 GLN B C 1 ATOM 2204 O O . GLN B 2 8 ? -9.821 -47.415 -103.318 1.00 43.80 ? 8 GLN B O 1 ATOM 2205 C CB . GLN B 2 8 ? -11.310 -50.121 -103.266 1.00 44.47 ? 8 GLN B CB 1 ATOM 2206 C CG . GLN B 2 8 ? -11.631 -51.614 -103.234 1.00 46.05 ? 8 GLN B CG 1 ATOM 2207 C CD . GLN B 2 8 ? -12.717 -51.951 -102.221 1.00 46.80 ? 8 GLN B CD 1 ATOM 2208 O OE1 . GLN B 2 8 ? -12.483 -51.929 -101.011 1.00 47.12 ? 8 GLN B OE1 1 ATOM 2209 N NE2 . GLN B 2 8 ? -13.912 -52.260 -102.710 1.00 48.09 ? 8 GLN B NE2 1 ATOM 2210 N N . VAL B 2 9 ? -9.695 -48.093 -105.468 1.00 44.50 ? 9 VAL B N 1 ATOM 2211 C CA . VAL B 2 9 ? -9.562 -46.749 -106.028 1.00 43.98 ? 9 VAL B CA 1 ATOM 2212 C C . VAL B 2 9 ? -10.735 -46.447 -106.971 1.00 44.53 ? 9 VAL B C 1 ATOM 2213 O O . VAL B 2 9 ? -10.956 -47.156 -107.957 1.00 45.70 ? 9 VAL B O 1 ATOM 2214 C CB . VAL B 2 9 ? -8.212 -46.571 -106.786 1.00 44.98 ? 9 VAL B CB 1 ATOM 2215 C CG1 . VAL B 2 9 ? -7.974 -45.106 -107.122 1.00 45.27 ? 9 VAL B CG1 1 ATOM 2216 C CG2 . VAL B 2 9 ? -7.039 -47.137 -105.987 1.00 44.50 ? 9 VAL B CG2 1 ATOM 2217 N N . TYR B 2 10 ? -11.482 -45.392 -106.659 1.00 44.15 ? 10 TYR B N 1 ATOM 2218 C CA . TYR B 2 10 ? -12.635 -44.970 -107.452 1.00 45.06 ? 10 TYR B CA 1 ATOM 2219 C C . TYR B 2 10 ? -12.725 -43.449 -107.476 1.00 46.27 ? 10 TYR B C 1 ATOM 2220 O O . TYR B 2 10 ? -12.014 -42.781 -106.726 1.00 45.95 ? 10 TYR B O 1 ATOM 2221 C CB . TYR B 2 10 ? -13.918 -45.571 -106.883 1.00 44.75 ? 10 TYR B CB 1 ATOM 2222 C CG . TYR B 2 10 ? -13.994 -45.548 -105.375 1.00 42.61 ? 10 TYR B CG 1 ATOM 2223 C CD1 . TYR B 2 10 ? -13.018 -46.173 -104.602 1.00 40.42 ? 10 TYR B CD1 1 ATOM 2224 C CD2 . TYR B 2 10 ? -15.047 -44.924 -104.718 1.00 42.25 ? 10 TYR B CD2 1 ATOM 2225 C CE1 . TYR B 2 10 ? -13.072 -46.163 -103.232 1.00 38.56 ? 10 TYR B CE1 1 ATOM 2226 C CE2 . TYR B 2 10 ? -15.107 -44.917 -103.334 1.00 40.87 ? 10 TYR B CE2 1 ATOM 2227 C CZ . TYR B 2 10 ? -14.110 -45.541 -102.605 1.00 38.80 ? 10 TYR B CZ 1 ATOM 2228 O OH . TYR B 2 10 ? -14.138 -45.550 -101.238 1.00 39.34 ? 10 TYR B OH 1 ATOM 2229 N N . SER B 2 11 ? -13.588 -42.905 -108.338 1.00 48.45 ? 11 SER B N 1 ATOM 2230 C CA . SER B 2 11 ? -13.800 -41.448 -108.428 1.00 50.41 ? 11 SER B CA 1 ATOM 2231 C C . SER B 2 11 ? -15.174 -41.023 -107.924 1.00 51.75 ? 11 SER B C 1 ATOM 2232 O O . SER B 2 11 ? -16.112 -41.824 -107.904 1.00 51.89 ? 11 SER B O 1 ATOM 2233 C CB . SER B 2 11 ? -13.599 -40.948 -109.862 1.00 52.46 ? 11 SER B CB 1 ATOM 2234 O OG . SER B 2 11 ? -14.695 -41.303 -110.690 1.00 54.57 ? 11 SER B OG 1 ATOM 2235 N N . ARG B 2 12 ? -15.293 -39.756 -107.538 1.00 53.56 ? 12 ARG B N 1 ATOM 2236 C CA . ARG B 2 12 ? -16.539 -39.256 -106.953 1.00 55.86 ? 12 ARG B CA 1 ATOM 2237 C C . ARG B 2 12 ? -17.620 -38.982 -107.997 1.00 58.90 ? 12 ARG B C 1 ATOM 2238 O O . ARG B 2 12 ? -18.802 -39.214 -107.746 1.00 60.38 ? 12 ARG B O 1 ATOM 2239 C CB . ARG B 2 12 ? -16.286 -38.017 -106.095 1.00 57.18 ? 12 ARG B CB 1 ATOM 2240 C CG . ARG B 2 12 ? -16.912 -38.115 -104.708 1.00 57.93 ? 12 ARG B CG 1 ATOM 2241 C CD . ARG B 2 12 ? -18.220 -37.335 -104.564 1.00 62.64 ? 12 ARG B CD 1 ATOM 2242 N NE . ARG B 2 12 ? -19.310 -37.837 -105.399 1.00 63.74 ? 12 ARG B NE 1 ATOM 2243 C CZ . ARG B 2 12 ? -20.540 -37.328 -105.411 1.00 67.48 ? 12 ARG B CZ 1 ATOM 2244 N NH1 . ARG B 2 12 ? -20.853 -36.303 -104.626 1.00 70.16 ? 12 ARG B NH1 1 ATOM 2245 N NH2 . ARG B 2 12 ? -21.460 -37.844 -106.214 1.00 69.14 ? 12 ARG B NH2 1 ATOM 2246 N N . HIS B 2 13 ? -17.210 -38.498 -109.165 1.00 60.31 ? 13 HIS B N 1 ATOM 2247 C CA . HIS B 2 13 ? -18.134 -38.288 -110.271 1.00 63.77 ? 13 HIS B CA 1 ATOM 2248 C C . HIS B 2 13 ? -17.692 -39.125 -111.467 1.00 63.30 ? 13 HIS B C 1 ATOM 2249 O O . HIS B 2 13 ? -16.558 -39.608 -111.482 1.00 60.97 ? 13 HIS B O 1 ATOM 2250 C CB . HIS B 2 13 ? -18.185 -36.803 -110.640 1.00 67.27 ? 13 HIS B CB 1 ATOM 2251 C CG . HIS B 2 13 ? -18.294 -35.898 -109.457 1.00 68.17 ? 13 HIS B CG 1 ATOM 2252 N ND1 . HIS B 2 13 ? -19.441 -35.802 -108.700 1.00 70.27 ? 13 HIS B ND1 1 ATOM 2253 C CD2 . HIS B 2 13 ? -17.393 -35.067 -108.886 1.00 68.25 ? 13 HIS B CD2 1 ATOM 2254 C CE1 . HIS B 2 13 ? -19.244 -34.944 -107.716 1.00 71.34 ? 13 HIS B CE1 1 ATOM 2255 N NE2 . HIS B 2 13 ? -18.010 -34.482 -107.807 1.00 70.39 ? 13 HIS B NE2 1 ATOM 2256 N N . PRO B 2 14 ? -18.581 -39.316 -112.466 1.00 66.17 ? 14 PRO B N 1 ATOM 2257 C CA . PRO B 2 14 ? -18.177 -39.975 -113.708 1.00 66.56 ? 14 PRO B CA 1 ATOM 2258 C C . PRO B 2 14 ? -16.855 -39.404 -114.224 1.00 65.81 ? 14 PRO B C 1 ATOM 2259 O O . PRO B 2 14 ? -16.684 -38.184 -114.245 1.00 67.47 ? 14 PRO B O 1 ATOM 2260 C CB . PRO B 2 14 ? -19.298 -39.607 -114.677 1.00 71.15 ? 14 PRO B CB 1 ATOM 2261 C CG . PRO B 2 14 ? -20.483 -39.399 -113.828 1.00 72.67 ? 14 PRO B CG 1 ATOM 2262 C CD . PRO B 2 14 ? -20.018 -38.983 -112.464 1.00 69.74 ? 14 PRO B CD 1 ATOM 2263 N N . PRO B 2 15 ? -15.912 -40.275 -114.616 1.00 63.93 ? 15 PRO B N 1 ATOM 2264 C CA . PRO B 2 15 ? -14.648 -39.786 -115.155 1.00 63.74 ? 15 PRO B CA 1 ATOM 2265 C C . PRO B 2 15 ? -14.854 -39.189 -116.535 1.00 67.39 ? 15 PRO B C 1 ATOM 2266 O O . PRO B 2 15 ? -15.418 -39.841 -117.410 1.00 69.43 ? 15 PRO B O 1 ATOM 2267 C CB . PRO B 2 15 ? -13.784 -41.051 -115.258 1.00 61.76 ? 15 PRO B CB 1 ATOM 2268 C CG . PRO B 2 15 ? -14.523 -42.120 -114.491 1.00 60.35 ? 15 PRO B CG 1 ATOM 2269 C CD . PRO B 2 15 ? -15.963 -41.746 -114.570 1.00 62.60 ? 15 PRO B CD 1 ATOM 2270 N N . GLU B 2 16 ? -14.427 -37.945 -116.716 1.00 68.89 ? 16 GLU B N 1 ATOM 2271 C CA . GLU B 2 16 ? -14.462 -37.294 -118.020 1.00 72.55 ? 16 GLU B CA 1 ATOM 2272 C C . GLU B 2 16 ? -13.146 -36.554 -118.223 1.00 72.77 ? 16 GLU B C 1 ATOM 2273 O O . GLU B 2 16 ? -12.782 -35.691 -117.425 1.00 72.36 ? 16 GLU B O 1 ATOM 2274 C CB . GLU B 2 16 ? -15.663 -36.350 -118.130 1.00 75.99 ? 16 GLU B CB 1 ATOM 2275 N N . ASN B 2 17 ? -12.427 -36.921 -119.280 1.00 73.90 ? 17 ASN B N 1 ATOM 2276 C CA . ASN B 2 17 ? -11.081 -36.410 -119.525 1.00 74.53 ? 17 ASN B CA 1 ATOM 2277 C C . ASN B 2 17 ? -11.035 -34.886 -119.530 1.00 77.52 ? 17 ASN B C 1 ATOM 2278 O O . ASN B 2 17 ? -11.827 -34.241 -120.216 1.00 81.04 ? 17 ASN B O 1 ATOM 2279 C CB . ASN B 2 17 ? -10.515 -36.969 -120.838 1.00 76.54 ? 17 ASN B CB 1 ATOM 2280 C CG . ASN B 2 17 ? -10.376 -38.491 -120.827 1.00 74.37 ? 17 ASN B CG 1 ATOM 2281 O OD1 . ASN B 2 17 ? -9.493 -39.047 -120.177 1.00 72.03 ? 17 ASN B OD1 1 ATOM 2282 N ND2 . ASN B 2 17 ? -11.239 -39.165 -121.573 1.00 75.83 ? 17 ASN B ND2 1 ATOM 2283 N N . GLY B 2 18 ? -10.123 -34.319 -118.743 1.00 76.67 ? 18 GLY B N 1 ATOM 2284 C CA . GLY B 2 18 ? -9.936 -32.870 -118.686 1.00 79.93 ? 18 GLY B CA 1 ATOM 2285 C C . GLY B 2 18 ? -10.838 -32.117 -117.719 1.00 80.36 ? 18 GLY B C 1 ATOM 2286 O O . GLY B 2 18 ? -10.715 -30.898 -117.580 1.00 83.60 ? 18 GLY B O 1 ATOM 2287 N N . LYS B 2 19 ? -11.746 -32.835 -117.058 1.00 77.62 ? 19 LYS B N 1 ATOM 2288 C CA . LYS B 2 19 ? -12.648 -32.242 -116.070 1.00 78.25 ? 19 LYS B CA 1 ATOM 2289 C C . LYS B 2 19 ? -12.264 -32.675 -114.651 1.00 74.73 ? 19 LYS B C 1 ATOM 2290 O O . LYS B 2 19 ? -12.138 -33.875 -114.387 1.00 71.27 ? 19 LYS B O 1 ATOM 2291 C CB . LYS B 2 19 ? -14.102 -32.618 -116.369 1.00 78.89 ? 19 LYS B CB 1 ATOM 2292 N N . PRO B 2 20 ? -12.080 -31.702 -113.733 1.00 76.30 ? 20 PRO B N 1 ATOM 2293 C CA . PRO B 2 20 ? -11.628 -31.973 -112.359 1.00 73.64 ? 20 PRO B CA 1 ATOM 2294 C C . PRO B 2 20 ? -12.569 -32.870 -111.546 1.00 70.74 ? 20 PRO B C 1 ATOM 2295 O O . PRO B 2 20 ? -13.766 -32.593 -111.449 1.00 72.40 ? 20 PRO B O 1 ATOM 2296 C CB . PRO B 2 20 ? -11.549 -30.577 -111.731 1.00 77.42 ? 20 PRO B CB 1 ATOM 2297 C CG . PRO B 2 20 ? -12.413 -29.710 -112.593 1.00 81.75 ? 20 PRO B CG 1 ATOM 2298 C CD . PRO B 2 20 ? -12.257 -30.257 -113.971 1.00 81.34 ? 20 PRO B CD 1 ATOM 2299 N N . ASN B 2 21 ? -12.006 -33.933 -110.973 1.00 67.01 ? 21 ASN B N 1 ATOM 2300 C CA . ASN B 2 21 ? -12.740 -34.899 -110.157 1.00 64.30 ? 21 ASN B CA 1 ATOM 2301 C C . ASN B 2 21 ? -12.051 -35.079 -108.800 1.00 62.37 ? 21 ASN B C 1 ATOM 2302 O O . ASN B 2 21 ? -11.063 -34.403 -108.508 1.00 63.58 ? 21 ASN B O 1 ATOM 2303 C CB . ASN B 2 21 ? -12.830 -36.241 -110.897 1.00 62.06 ? 21 ASN B CB 1 ATOM 2304 C CG . ASN B 2 21 ? -14.070 -37.050 -110.523 1.00 61.40 ? 21 ASN B CG 1 ATOM 2305 O OD1 . ASN B 2 21 ? -14.339 -37.311 -109.349 1.00 60.59 ? 21 ASN B OD1 1 ATOM 2306 N ND2 . ASN B 2 21 ? -14.820 -37.468 -111.534 1.00 63.14 ? 21 ASN B ND2 1 ATOM 2307 N N . ILE B 2 22 ? -12.582 -35.981 -107.973 1.00 59.94 ? 22 ILE B N 1 ATOM 2308 C CA . ILE B 2 22 ? -11.984 -36.331 -106.680 1.00 58.15 ? 22 ILE B CA 1 ATOM 2309 C C . ILE B 2 22 ? -11.700 -37.843 -106.633 1.00 54.98 ? 22 ILE B C 1 ATOM 2310 O O . ILE B 2 22 ? -12.619 -38.660 -106.761 1.00 53.82 ? 22 ILE B O 1 ATOM 2311 C CB . ILE B 2 22 ? -12.893 -35.918 -105.482 1.00 58.95 ? 22 ILE B CB 1 ATOM 2312 C CG1 . ILE B 2 22 ? -13.509 -34.534 -105.696 1.00 62.81 ? 22 ILE B CG1 1 ATOM 2313 C CG2 . ILE B 2 22 ? -12.113 -35.933 -104.174 1.00 58.29 ? 22 ILE B CG2 1 ATOM 2314 N N . LEU B 2 23 ? -10.429 -38.205 -106.459 1.00 54.15 ? 23 LEU B N 1 ATOM 2315 C CA . LEU B 2 23 ? -10.025 -39.612 -106.429 1.00 52.01 ? 23 LEU B CA 1 ATOM 2316 C C . LEU B 2 23 ? -10.127 -40.195 -105.030 1.00 50.67 ? 23 LEU B C 1 ATOM 2317 O O . LEU B 2 23 ? -9.742 -39.562 -104.054 1.00 51.55 ? 23 LEU B O 1 ATOM 2318 C CB . LEU B 2 23 ? -8.598 -39.795 -106.958 1.00 52.52 ? 23 LEU B CB 1 ATOM 2319 C CG . LEU B 2 23 ? -8.172 -41.200 -107.416 1.00 51.20 ? 23 LEU B CG 1 ATOM 2320 C CD1 . LEU B 2 23 ? -9.032 -41.729 -108.562 1.00 51.07 ? 23 LEU B CD1 1 ATOM 2321 C CD2 . LEU B 2 23 ? -6.715 -41.202 -107.822 1.00 52.20 ? 23 LEU B CD2 1 ATOM 2322 N N . ASN B 2 24 ? -10.648 -41.411 -104.938 1.00 49.16 ? 24 ASN B N 1 ATOM 2323 C CA . ASN B 2 24 ? -10.768 -42.081 -103.657 1.00 48.05 ? 24 ASN B CA 1 ATOM 2324 C C . ASN B 2 24 ? -9.787 -43.229 -103.578 1.00 47.12 ? 24 ASN B C 1 ATOM 2325 O O . ASN B 2 24 ? -9.581 -43.932 -104.563 1.00 47.06 ? 24 ASN B O 1 ATOM 2326 C CB . ASN B 2 24 ? -12.193 -42.584 -103.443 1.00 47.45 ? 24 ASN B CB 1 ATOM 2327 C CG . ASN B 2 24 ? -13.198 -41.455 -103.268 1.00 49.76 ? 24 ASN B CG 1 ATOM 2328 O OD1 . ASN B 2 24 ? -12.835 -40.274 -103.113 1.00 51.55 ? 24 ASN B OD1 1 ATOM 2329 N ND2 . ASN B 2 24 ? -14.481 -41.813 -103.287 1.00 50.36 ? 24 ASN B ND2 1 ATOM 2330 N N . CYS B 2 25 ? -9.155 -43.384 -102.419 1.00 47.08 ? 25 CYS B N 1 ATOM 2331 C CA . CYS B 2 25 ? -8.386 -44.580 -102.118 1.00 46.78 ? 25 CYS B CA 1 ATOM 2332 C C . CYS B 2 25 ? -8.811 -45.115 -100.767 1.00 46.04 ? 25 CYS B C 1 ATOM 2333 O O . CYS B 2 25 ? -8.651 -44.450 -99.749 1.00 46.78 ? 25 CYS B O 1 ATOM 2334 C CB . CYS B 2 25 ? -6.882 -44.332 -102.137 1.00 48.26 ? 25 CYS B CB 1 ATOM 2335 S SG . CYS B 2 25 ? -6.009 -45.868 -101.774 1.00 49.99 ? 25 CYS B SG 1 ATOM 2336 N N . TYR B 2 26 ? -9.337 -46.331 -100.769 1.00 45.14 ? 26 TYR B N 1 ATOM 2337 C CA . TYR B 2 26 ? -10.049 -46.851 -99.618 1.00 44.88 ? 26 TYR B CA 1 ATOM 2338 C C . TYR B 2 26 ? -9.397 -48.139 -99.104 1.00 45.31 ? 26 TYR B C 1 ATOM 2339 O O . TYR B 2 26 ? -9.746 -49.247 -99.529 1.00 45.70 ? 26 TYR B O 1 ATOM 2340 C CB . TYR B 2 26 ? -11.520 -47.034 -100.003 1.00 44.40 ? 26 TYR B CB 1 ATOM 2341 C CG . TYR B 2 26 ? -12.417 -47.562 -98.923 1.00 44.79 ? 26 TYR B CG 1 ATOM 2342 C CD1 . TYR B 2 26 ? -12.547 -46.894 -97.707 1.00 46.08 ? 26 TYR B CD1 1 ATOM 2343 C CD2 . TYR B 2 26 ? -13.162 -48.722 -99.124 1.00 45.14 ? 26 TYR B CD2 1 ATOM 2344 C CE1 . TYR B 2 26 ? -13.383 -47.383 -96.705 1.00 46.98 ? 26 TYR B CE1 1 ATOM 2345 C CE2 . TYR B 2 26 ? -14.005 -49.217 -98.136 1.00 46.14 ? 26 TYR B CE2 1 ATOM 2346 C CZ . TYR B 2 26 ? -14.109 -48.543 -96.930 1.00 46.74 ? 26 TYR B CZ 1 ATOM 2347 O OH . TYR B 2 26 ? -14.929 -49.030 -95.945 1.00 48.24 ? 26 TYR B OH 1 ATOM 2348 N N . VAL B 2 27 ? -8.439 -47.972 -98.192 1.00 45.99 ? 27 VAL B N 1 ATOM 2349 C CA . VAL B 2 27 ? -7.637 -49.072 -97.656 1.00 46.85 ? 27 VAL B CA 1 ATOM 2350 C C . VAL B 2 27 ? -8.364 -49.714 -96.486 1.00 47.12 ? 27 VAL B C 1 ATOM 2351 O O . VAL B 2 27 ? -8.630 -49.039 -95.490 1.00 47.75 ? 27 VAL B O 1 ATOM 2352 C CB . VAL B 2 27 ? -6.265 -48.569 -97.147 1.00 48.52 ? 27 VAL B CB 1 ATOM 2353 C CG1 . VAL B 2 27 ? -5.268 -49.716 -97.090 1.00 50.27 ? 27 VAL B CG1 1 ATOM 2354 C CG2 . VAL B 2 27 ? -5.735 -47.436 -98.015 1.00 48.25 ? 27 VAL B CG2 1 ATOM 2355 N N . THR B 2 28 ? -8.681 -51.005 -96.586 1.00 47.38 ? 28 THR B N 1 ATOM 2356 C CA . THR B 2 28 ? -9.478 -51.670 -95.537 1.00 47.86 ? 28 THR B CA 1 ATOM 2357 C C . THR B 2 28 ? -8.996 -53.059 -95.146 1.00 49.45 ? 28 THR B C 1 ATOM 2358 O O . THR B 2 28 ? -8.051 -53.582 -95.729 1.00 50.53 ? 28 THR B O 1 ATOM 2359 C CB . THR B 2 28 ? -10.981 -51.791 -95.911 1.00 47.22 ? 28 THR B CB 1 ATOM 2360 O OG1 . THR B 2 28 ? -11.158 -52.796 -96.919 1.00 48.19 ? 28 THR B OG1 1 ATOM 2361 C CG2 . THR B 2 28 ? -11.532 -50.479 -96.405 1.00 46.04 ? 28 THR B CG2 1 ATOM 2362 N N . GLN B 2 29 ? -9.687 -53.640 -94.163 1.00 50.18 ? 29 GLN B N 1 ATOM 2363 C CA . GLN B 2 29 ? -9.423 -54.986 -93.631 1.00 52.29 ? 29 GLN B CA 1 ATOM 2364 C C . GLN B 2 29 ? -7.949 -55.223 -93.280 1.00 54.04 ? 29 GLN B C 1 ATOM 2365 O O . GLN B 2 29 ? -7.347 -56.208 -93.719 1.00 56.06 ? 29 GLN B O 1 ATOM 2366 C CB . GLN B 2 29 ? -9.970 -56.075 -94.574 1.00 52.82 ? 29 GLN B CB 1 ATOM 2367 N N . PHE B 2 30 ? -7.378 -54.315 -92.489 1.00 53.91 ? 30 PHE B N 1 ATOM 2368 C CA . PHE B 2 30 ? -5.982 -54.425 -92.072 1.00 56.17 ? 30 PHE B CA 1 ATOM 2369 C C . PHE B 2 30 ? -5.777 -54.260 -90.568 1.00 58.26 ? 30 PHE B C 1 ATOM 2370 O O . PHE B 2 30 ? -6.616 -53.686 -89.870 1.00 57.49 ? 30 PHE B O 1 ATOM 2371 C CB . PHE B 2 30 ? -5.103 -53.446 -92.845 1.00 55.43 ? 30 PHE B CB 1 ATOM 2372 C CG . PHE B 2 30 ? -5.332 -52.010 -92.495 1.00 53.84 ? 30 PHE B CG 1 ATOM 2373 C CD1 . PHE B 2 30 ? -6.378 -51.298 -93.067 1.00 51.18 ? 30 PHE B CD1 1 ATOM 2374 C CD2 . PHE B 2 30 ? -4.483 -51.356 -91.616 1.00 55.87 ? 30 PHE B CD2 1 ATOM 2375 C CE1 . PHE B 2 30 ? -6.589 -49.962 -92.752 1.00 50.33 ? 30 PHE B CE1 1 ATOM 2376 C CE2 . PHE B 2 30 ? -4.686 -50.020 -91.296 1.00 55.44 ? 30 PHE B CE2 1 ATOM 2377 C CZ . PHE B 2 30 ? -5.743 -49.323 -91.866 1.00 52.68 ? 30 PHE B CZ 1 ATOM 2378 N N . HIS B 2 31 ? -4.643 -54.766 -90.092 1.00 61.47 ? 31 HIS B N 1 ATOM 2379 C CA . HIS B 2 31 ? -4.304 -54.796 -88.677 1.00 64.36 ? 31 HIS B CA 1 ATOM 2380 C C . HIS B 2 31 ? -2.825 -55.143 -88.582 1.00 68.13 ? 31 HIS B C 1 ATOM 2381 O O . HIS B 2 31 ? -2.355 -55.990 -89.339 1.00 69.31 ? 31 HIS B O 1 ATOM 2382 C CB . HIS B 2 31 ? -5.135 -55.868 -87.969 1.00 65.39 ? 31 HIS B CB 1 ATOM 2383 C CG . HIS B 2 31 ? -4.937 -55.911 -86.487 1.00 69.01 ? 31 HIS B CG 1 ATOM 2384 N ND1 . HIS B 2 31 ? -5.766 -55.250 -85.606 1.00 68.67 ? 31 HIS B ND1 1 ATOM 2385 C CD2 . HIS B 2 31 ? -4.004 -56.536 -85.729 1.00 73.75 ? 31 HIS B CD2 1 ATOM 2386 C CE1 . HIS B 2 31 ? -5.351 -55.464 -84.370 1.00 72.34 ? 31 HIS B CE1 1 ATOM 2387 N NE2 . HIS B 2 31 ? -4.284 -56.241 -84.416 1.00 75.37 ? 31 HIS B NE2 1 ATOM 2388 N N . PRO B 2 32 ? -2.069 -54.492 -87.674 1.00 70.78 ? 32 PRO B N 1 ATOM 2389 C CA . PRO B 2 32 ? -2.368 -53.407 -86.733 1.00 70.75 ? 32 PRO B CA 1 ATOM 2390 C C . PRO B 2 32 ? -2.661 -52.077 -87.437 1.00 67.64 ? 32 PRO B C 1 ATOM 2391 O O . PRO B 2 32 ? -2.449 -51.979 -88.645 1.00 65.83 ? 32 PRO B O 1 ATOM 2392 C CB . PRO B 2 32 ? -1.075 -53.305 -85.911 1.00 76.00 ? 32 PRO B CB 1 ATOM 2393 C CG . PRO B 2 32 ? -0.398 -54.629 -86.085 1.00 78.74 ? 32 PRO B CG 1 ATOM 2394 C CD . PRO B 2 32 ? -0.690 -54.981 -87.495 1.00 75.33 ? 32 PRO B CD 1 ATOM 2395 N N . PRO B 2 33 ? -3.143 -51.058 -86.689 1.00 67.54 ? 33 PRO B N 1 ATOM 2396 C CA . PRO B 2 33 ? -3.634 -49.810 -87.285 1.00 65.06 ? 33 PRO B CA 1 ATOM 2397 C C . PRO B 2 33 ? -2.597 -48.937 -88.003 1.00 66.12 ? 33 PRO B C 1 ATOM 2398 O O . PRO B 2 33 ? -2.927 -48.338 -89.028 1.00 63.64 ? 33 PRO B O 1 ATOM 2399 C CB . PRO B 2 33 ? -4.237 -49.057 -86.095 1.00 66.23 ? 33 PRO B CB 1 ATOM 2400 C CG . PRO B 2 33 ? -3.582 -49.625 -84.915 1.00 70.39 ? 33 PRO B CG 1 ATOM 2401 C CD . PRO B 2 33 ? -3.338 -51.062 -85.229 1.00 70.32 ? 33 PRO B CD 1 ATOM 2402 N N . HIS B 2 34 ? -1.373 -48.857 -87.488 1.00 70.26 ? 34 HIS B N 1 ATOM 2403 C CA . HIS B 2 34 ? -0.365 -47.987 -88.096 1.00 72.10 ? 34 HIS B CA 1 ATOM 2404 C C . HIS B 2 34 ? -0.037 -48.368 -89.541 1.00 70.00 ? 34 HIS B C 1 ATOM 2405 O O . HIS B 2 34 ? 0.389 -49.493 -89.813 1.00 70.57 ? 34 HIS B O 1 ATOM 2406 C CB . HIS B 2 34 ? 0.913 -47.944 -87.262 1.00 78.08 ? 34 HIS B CB 1 ATOM 2407 C CG . HIS B 2 34 ? 2.077 -47.354 -87.992 1.00 81.21 ? 34 HIS B CG 1 ATOM 2408 N ND1 . HIS B 2 34 ? 2.154 -46.014 -88.306 1.00 82.13 ? 34 HIS B ND1 1 ATOM 2409 C CD2 . HIS B 2 34 ? 3.196 -47.926 -88.496 1.00 84.48 ? 34 HIS B CD2 1 ATOM 2410 C CE1 . HIS B 2 34 ? 3.277 -45.784 -88.962 1.00 85.22 ? 34 HIS B CE1 1 ATOM 2411 N NE2 . HIS B 2 34 ? 3.928 -46.927 -89.090 1.00 86.83 ? 34 HIS B NE2 1 ATOM 2412 N N . ILE B 2 35 ? -0.221 -47.404 -90.445 1.00 68.11 ? 35 ILE B N 1 ATOM 2413 C CA . ILE B 2 35 ? -0.102 -47.611 -91.895 1.00 65.95 ? 35 ILE B CA 1 ATOM 2414 C C . ILE B 2 35 ? 0.282 -46.308 -92.621 1.00 66.43 ? 35 ILE B C 1 ATOM 2415 O O . ILE B 2 35 ? -0.027 -45.213 -92.146 1.00 67.07 ? 35 ILE B O 1 ATOM 2416 C CB . ILE B 2 35 ? -1.428 -48.185 -92.479 1.00 61.47 ? 35 ILE B CB 1 ATOM 2417 C CG1 . ILE B 2 35 ? -1.178 -48.951 -93.781 1.00 60.40 ? 35 ILE B CG1 1 ATOM 2418 C CG2 . ILE B 2 35 ? -2.496 -47.085 -92.641 1.00 59.01 ? 35 ILE B CG2 1 ATOM 2419 C CD1 . ILE B 2 35 ? -2.379 -49.744 -94.267 1.00 57.20 ? 35 ILE B CD1 1 ATOM 2420 N N . GLU B 2 36 ? 0.945 -46.434 -93.772 1.00 66.62 ? 36 GLU B N 1 ATOM 2421 C CA . GLU B 2 36 ? 1.392 -45.273 -94.552 1.00 67.53 ? 36 GLU B CA 1 ATOM 2422 C C . GLU B 2 36 ? 0.881 -45.314 -95.997 1.00 64.17 ? 36 GLU B C 1 ATOM 2423 O O . GLU B 2 36 ? 1.216 -46.228 -96.756 1.00 63.83 ? 36 GLU B O 1 ATOM 2424 C CB . GLU B 2 36 ? 2.922 -45.156 -94.515 1.00 72.62 ? 36 GLU B CB 1 ATOM 2425 N N . ILE B 2 37 ? 0.082 -44.311 -96.367 1.00 62.29 ? 37 ILE B N 1 ATOM 2426 C CA . ILE B 2 37 ? -0.613 -44.277 -97.665 1.00 59.41 ? 37 ILE B CA 1 ATOM 2427 C C . ILE B 2 37 ? -0.196 -43.081 -98.531 1.00 61.05 ? 37 ILE B C 1 ATOM 2428 O O . ILE B 2 37 ? -0.106 -41.951 -98.045 1.00 63.08 ? 37 ILE B O 1 ATOM 2429 C CB . ILE B 2 37 ? -2.161 -44.254 -97.490 1.00 55.76 ? 37 ILE B CB 1 ATOM 2430 C CG1 . ILE B 2 37 ? -2.624 -45.403 -96.603 1.00 54.60 ? 37 ILE B CG1 1 ATOM 2431 C CG2 . ILE B 2 37 ? -2.869 -44.355 -98.832 1.00 53.22 ? 37 ILE B CG2 1 ATOM 2432 C CD1 . ILE B 2 37 ? -3.854 -45.079 -95.824 1.00 53.64 ? 37 ILE B CD1 1 ATOM 2433 N N . GLN B 2 38 ? 0.047 -43.346 -99.815 1.00 60.64 ? 38 GLN B N 1 ATOM 2434 C CA . GLN B 2 38 ? 0.385 -42.306 -100.784 1.00 62.08 ? 38 GLN B CA 1 ATOM 2435 C C . GLN B 2 38 ? -0.502 -42.380 -102.029 1.00 59.27 ? 38 GLN B C 1 ATOM 2436 O O . GLN B 2 38 ? -0.849 -43.471 -102.506 1.00 57.32 ? 38 GLN B O 1 ATOM 2437 C CB . GLN B 2 38 ? 1.850 -42.419 -101.203 1.00 65.92 ? 38 GLN B CB 1 ATOM 2438 C CG . GLN B 2 38 ? 2.846 -42.272 -100.070 1.00 70.27 ? 38 GLN B CG 1 ATOM 2439 C CD . GLN B 2 38 ? 4.150 -42.992 -100.349 1.00 74.32 ? 38 GLN B CD 1 ATOM 2440 O OE1 . GLN B 2 38 ? 4.873 -42.660 -101.296 1.00 76.70 ? 38 GLN B OE1 1 ATOM 2441 N NE2 . GLN B 2 38 ? 4.462 -43.986 -99.520 1.00 75.20 ? 38 GLN B NE2 1 ATOM 2442 N N . MET B 2 39 ? -0.871 -41.208 -102.541 1.00 59.44 ? 39 MET B N 1 ATOM 2443 C CA . MET B 2 39 ? -1.504 -41.091 -103.847 1.00 57.83 ? 39 MET B CA 1 ATOM 2444 C C . MET B 2 39 ? -0.438 -40.601 -104.825 1.00 60.89 ? 39 MET B C 1 ATOM 2445 O O . MET B 2 39 ? 0.351 -39.708 -104.500 1.00 64.16 ? 39 MET B O 1 ATOM 2446 C CB . MET B 2 39 ? -2.687 -40.123 -103.794 1.00 56.69 ? 39 MET B CB 1 ATOM 2447 C CG . MET B 2 39 ? -3.767 -40.504 -102.785 1.00 54.53 ? 39 MET B CG 1 ATOM 2448 S SD . MET B 2 39 ? -5.303 -41.181 -103.457 0.70 51.72 ? 39 MET B SD 1 ATOM 2449 C CE . MET B 2 39 ? -4.725 -42.600 -104.384 0.70 51.23 ? 39 MET B CE 1 ATOM 2450 N N . LEU B 2 40 ? -0.400 -41.202 -106.011 1.00 60.31 ? 40 LEU B N 1 ATOM 2451 C CA . LEU B 2 40 ? 0.655 -40.928 -106.976 1.00 63.41 ? 40 LEU B CA 1 ATOM 2452 C C . LEU B 2 40 ? 0.092 -40.572 -108.349 1.00 63.10 ? 40 LEU B C 1 ATOM 2453 O O . LEU B 2 40 ? -0.737 -41.297 -108.894 1.00 60.85 ? 40 LEU B O 1 ATOM 2454 C CB . LEU B 2 40 ? 1.590 -42.137 -107.098 1.00 64.63 ? 40 LEU B CB 1 ATOM 2455 C CG . LEU B 2 40 ? 2.198 -42.772 -105.843 1.00 65.44 ? 40 LEU B CG 1 ATOM 2456 C CD1 . LEU B 2 40 ? 2.749 -44.156 -106.157 1.00 66.31 ? 40 LEU B CD1 1 ATOM 2457 C CD2 . LEU B 2 40 ? 3.285 -41.900 -105.238 1.00 69.66 ? 40 LEU B CD2 1 ATOM 2458 N N . LYS B 2 41 ? 0.542 -39.447 -108.897 1.00 65.99 ? 41 LYS B N 1 ATOM 2459 C CA . LYS B 2 41 ? 0.249 -39.092 -110.281 1.00 66.66 ? 41 LYS B CA 1 ATOM 2460 C C . LYS B 2 41 ? 1.521 -39.248 -111.110 1.00 70.25 ? 41 LYS B C 1 ATOM 2461 O O . LYS B 2 41 ? 2.426 -38.412 -111.052 1.00 73.83 ? 41 LYS B O 1 ATOM 2462 C CB . LYS B 2 41 ? -0.317 -37.674 -110.384 1.00 67.70 ? 41 LYS B CB 1 ATOM 2463 C CG . LYS B 2 41 ? -0.775 -37.285 -111.776 1.00 68.48 ? 41 LYS B CG 1 ATOM 2464 C CD . LYS B 2 41 ? -1.326 -35.872 -111.790 1.00 70.61 ? 41 LYS B CD 1 ATOM 2465 C CE . LYS B 2 41 ? -1.441 -35.331 -113.209 1.00 73.25 ? 41 LYS B CE 1 ATOM 2466 N N . ASN B 2 42 ? 1.572 -40.352 -111.853 1.00 69.75 ? 42 ASN B N 1 ATOM 2467 C CA . ASN B 2 42 ? 2.697 -40.731 -112.720 1.00 73.38 ? 42 ASN B CA 1 ATOM 2468 C C . ASN B 2 42 ? 3.975 -41.193 -112.006 1.00 76.02 ? 42 ASN B C 1 ATOM 2469 O O . ASN B 2 42 ? 5.040 -41.276 -112.618 1.00 80.04 ? 42 ASN B O 1 ATOM 2470 C CB . ASN B 2 42 ? 2.989 -39.646 -113.763 1.00 76.64 ? 42 ASN B CB 1 ATOM 2471 C CG . ASN B 2 42 ? 1.884 -39.527 -114.794 1.00 75.42 ? 42 ASN B CG 1 ATOM 2472 O OD1 . ASN B 2 42 ? 2.035 -39.963 -115.938 1.00 77.51 ? 42 ASN B OD1 1 ATOM 2473 N ND2 . ASN B 2 42 ? 0.756 -38.954 -114.389 1.00 72.96 ? 42 ASN B ND2 1 ATOM 2474 N N . GLY B 2 43 ? 3.851 -41.522 -110.722 1.00 74.28 ? 43 GLY B N 1 ATOM 2475 C CA . GLY B 2 43 ? 4.993 -41.934 -109.907 1.00 77.22 ? 43 GLY B CA 1 ATOM 2476 C C . GLY B 2 43 ? 5.310 -40.931 -108.813 1.00 78.78 ? 43 GLY B C 1 ATOM 2477 O O . GLY B 2 43 ? 5.550 -41.312 -107.668 1.00 78.75 ? 43 GLY B O 1 ATOM 2478 N N . LYS B 2 44 ? 5.313 -39.648 -109.177 1.00 80.68 ? 44 LYS B N 1 ATOM 2479 C CA . LYS B 2 44 ? 5.536 -38.552 -108.239 1.00 82.86 ? 44 LYS B CA 1 ATOM 2480 C C . LYS B 2 44 ? 4.361 -38.434 -107.279 1.00 78.89 ? 44 LYS B C 1 ATOM 2481 O O . LYS B 2 44 ? 3.206 -38.400 -107.707 1.00 75.24 ? 44 LYS B O 1 ATOM 2482 C CB . LYS B 2 44 ? 5.738 -37.235 -108.991 1.00 86.12 ? 44 LYS B CB 1 ATOM 2483 N N . LYS B 2 45 ? 4.677 -38.367 -105.986 1.00 80.27 ? 45 LYS B N 1 ATOM 2484 C CA . LYS B 2 45 ? 3.690 -38.381 -104.903 1.00 77.24 ? 45 LYS B CA 1 ATOM 2485 C C . LYS B 2 45 ? 2.820 -37.123 -104.860 1.00 77.18 ? 45 LYS B C 1 ATOM 2486 O O . LYS B 2 45 ? 3.313 -36.024 -104.599 1.00 81.24 ? 45 LYS B O 1 ATOM 2487 C CB . LYS B 2 45 ? 4.401 -38.591 -103.559 1.00 79.55 ? 45 LYS B CB 1 ATOM 2488 C CG . LYS B 2 45 ? 3.492 -39.009 -102.413 1.00 76.30 ? 45 LYS B CG 1 ATOM 2489 N N . ILE B 2 46 ? 1.523 -37.300 -105.110 1.00 73.35 ? 46 ILE B N 1 ATOM 2490 C CA . ILE B 2 46 ? 0.552 -36.203 -105.073 1.00 73.56 ? 46 ILE B CA 1 ATOM 2491 C C . ILE B 2 46 ? 0.507 -35.586 -103.670 1.00 75.51 ? 46 ILE B C 1 ATOM 2492 O O . ILE B 2 46 ? 0.161 -36.273 -102.700 1.00 73.34 ? 46 ILE B O 1 ATOM 2493 C CB . ILE B 2 46 ? -0.873 -36.665 -105.484 1.00 69.10 ? 46 ILE B CB 1 ATOM 2494 C CG1 . ILE B 2 46 ? -0.848 -37.460 -106.788 1.00 67.56 ? 46 ILE B CG1 1 ATOM 2495 C CG2 . ILE B 2 46 ? -1.804 -35.470 -105.645 1.00 70.40 ? 46 ILE B CG2 1 ATOM 2496 N N . PRO B 2 47 ? 0.851 -34.286 -103.565 1.00 80.08 ? 47 PRO B N 1 ATOM 2497 C CA . PRO B 2 47 ? 1.041 -33.579 -102.292 1.00 83.44 ? 47 PRO B CA 1 ATOM 2498 C C . PRO B 2 47 ? -0.196 -33.495 -101.390 1.00 81.28 ? 47 PRO B C 1 ATOM 2499 O O . PRO B 2 47 ? -0.097 -33.774 -100.191 1.00 81.66 ? 47 PRO B O 1 ATOM 2500 C CB . PRO B 2 47 ? 1.460 -32.169 -102.735 1.00 88.78 ? 47 PRO B CB 1 ATOM 2501 C CG . PRO B 2 47 ? 0.929 -32.030 -104.128 1.00 86.92 ? 47 PRO B CG 1 ATOM 2502 C CD . PRO B 2 47 ? 1.075 -33.394 -104.719 1.00 82.82 ? 47 PRO B CD 1 ATOM 2503 N N . LYS B 2 48 ? -1.340 -33.117 -101.957 1.00 79.60 ? 48 LYS B N 1 ATOM 2504 C CA . LYS B 2 48 ? -2.529 -32.812 -101.159 1.00 78.81 ? 48 LYS B CA 1 ATOM 2505 C C . LYS B 2 48 ? -3.464 -34.016 -101.026 1.00 73.52 ? 48 LYS B C 1 ATOM 2506 O O . LYS B 2 48 ? -4.328 -34.246 -101.879 1.00 71.09 ? 48 LYS B O 1 ATOM 2507 C CB . LYS B 2 48 ? -3.266 -31.598 -101.742 1.00 81.15 ? 48 LYS B CB 1 ATOM 2508 C CG . LYS B 2 48 ? -4.351 -31.018 -100.844 1.00 82.18 ? 48 LYS B CG 1 ATOM 2509 N N . VAL B 2 49 ? -3.277 -34.786 -99.954 1.00 72.29 ? 49 VAL B N 1 ATOM 2510 C CA . VAL B 2 49 ? -4.096 -35.971 -99.705 1.00 67.71 ? 49 VAL B CA 1 ATOM 2511 C C . VAL B 2 49 ? -4.747 -35.893 -98.332 1.00 68.11 ? 49 VAL B C 1 ATOM 2512 O O . VAL B 2 49 ? -4.105 -36.136 -97.307 1.00 69.58 ? 49 VAL B O 1 ATOM 2513 C CB . VAL B 2 49 ? -3.285 -37.281 -99.829 1.00 65.84 ? 49 VAL B CB 1 ATOM 2514 C CG1 . VAL B 2 49 ? -4.175 -38.494 -99.574 1.00 61.48 ? 49 VAL B CG1 1 ATOM 2515 C CG2 . VAL B 2 49 ? -2.640 -37.379 -101.197 1.00 66.07 ? 49 VAL B CG2 1 ATOM 2516 N N . GLU B 2 50 ? -6.027 -35.540 -98.324 1.00 67.34 ? 50 GLU B N 1 ATOM 2517 C CA . GLU B 2 50 ? -6.796 -35.477 -97.091 1.00 67.93 ? 50 GLU B CA 1 ATOM 2518 C C . GLU B 2 50 ? -7.223 -36.889 -96.678 1.00 64.31 ? 50 GLU B C 1 ATOM 2519 O O . GLU B 2 50 ? -7.669 -37.684 -97.509 1.00 61.11 ? 50 GLU B O 1 ATOM 2520 C CB . GLU B 2 50 ? -8.012 -34.554 -97.256 1.00 69.29 ? 50 GLU B CB 1 ATOM 2521 C CG . GLU B 2 50 ? -7.682 -33.067 -97.347 1.00 73.94 ? 50 GLU B CG 1 ATOM 2522 N N . MET B 2 51 ? -7.064 -37.192 -95.393 1.00 65.32 ? 51 MET B N 1 ATOM 2523 C CA . MET B 2 51 ? -7.378 -38.508 -94.844 1.00 62.57 ? 51 MET B CA 1 ATOM 2524 C C . MET B 2 51 ? -8.607 -38.416 -93.957 1.00 62.55 ? 51 MET B C 1 ATOM 2525 O O . MET B 2 51 ? -8.827 -37.397 -93.296 1.00 65.60 ? 51 MET B O 1 ATOM 2526 C CB . MET B 2 51 ? -6.216 -39.014 -93.987 1.00 64.25 ? 51 MET B CB 1 ATOM 2527 C CG . MET B 2 51 ? -4.907 -39.208 -94.711 1.00 65.44 ? 51 MET B CG 1 ATOM 2528 S SD . MET B 2 51 ? -4.821 -40.847 -95.433 1.00 64.01 ? 51 MET B SD 1 ATOM 2529 C CE . MET B 2 51 ? -3.056 -41.161 -95.279 1.00 66.79 ? 51 MET B CE 1 ATOM 2530 N N . SER B 2 52 ? -9.396 -39.487 -93.938 1.00 59.44 ? 52 SER B N 1 ATOM 2531 C CA . SER B 2 52 ? -10.488 -39.617 -92.980 1.00 59.69 ? 52 SER B CA 1 ATOM 2532 C C . SER B 2 52 ? -9.925 -40.138 -91.664 1.00 60.57 ? 52 SER B C 1 ATOM 2533 O O . SER B 2 52 ? -8.787 -40.619 -91.611 1.00 60.57 ? 52 SER B O 1 ATOM 2534 C CB . SER B 2 52 ? -11.573 -40.565 -93.503 1.00 57.02 ? 52 SER B CB 1 ATOM 2535 O OG . SER B 2 52 ? -11.253 -41.932 -93.256 1.00 55.66 ? 52 SER B OG 1 ATOM 2536 N N . ASP B 2 53 ? -10.719 -40.030 -90.605 1.00 61.71 ? 53 ASP B N 1 ATOM 2537 C CA . ASP B 2 53 ? -10.352 -40.599 -89.321 1.00 62.67 ? 53 ASP B CA 1 ATOM 2538 C C . ASP B 2 53 ? -10.377 -42.111 -89.450 1.00 59.50 ? 53 ASP B C 1 ATOM 2539 O O . ASP B 2 53 ? -11.352 -42.667 -89.962 1.00 57.37 ? 53 ASP B O 1 ATOM 2540 C CB . ASP B 2 53 ? -11.345 -40.163 -88.248 1.00 65.25 ? 53 ASP B CB 1 ATOM 2541 C CG . ASP B 2 53 ? -11.060 -38.779 -87.706 0.70 69.37 ? 53 ASP B CG 1 ATOM 2542 O OD1 . ASP B 2 53 ? -10.599 -37.906 -88.476 0.70 69.86 ? 53 ASP B OD1 1 ATOM 2543 O OD2 . ASP B 2 53 ? -11.311 -38.567 -86.499 0.70 72.29 ? 53 ASP B OD2 1 ATOM 2544 N N . MET B 2 54 ? -9.307 -42.770 -89.002 1.00 59.74 ? 54 MET B N 1 ATOM 2545 C CA . MET B 2 54 ? -9.241 -44.234 -89.023 1.00 57.49 ? 54 MET B CA 1 ATOM 2546 C C . MET B 2 54 ? -10.315 -44.819 -88.109 1.00 57.70 ? 54 MET B C 1 ATOM 2547 O O . MET B 2 54 ? -10.706 -44.197 -87.120 1.00 60.43 ? 54 MET B O 1 ATOM 2548 C CB . MET B 2 54 ? -7.851 -44.738 -88.618 1.00 58.89 ? 54 MET B CB 1 ATOM 2549 C CG . MET B 2 54 ? -7.574 -46.182 -89.050 1.00 56.63 ? 54 MET B CG 1 ATOM 2550 S SD . MET B 2 54 ? -5.938 -46.830 -88.648 0.70 58.20 ? 54 MET B SD 1 ATOM 2551 C CE . MET B 2 54 ? -4.861 -45.670 -89.489 0.70 59.45 ? 54 MET B CE 1 ATOM 2552 N N . SER B 2 55 ? -10.799 -46.006 -88.448 1.00 55.42 ? 55 SER B N 1 ATOM 2553 C CA . SER B 2 55 ? -11.879 -46.637 -87.702 1.00 55.79 ? 55 SER B CA 1 ATOM 2554 C C . SER B 2 55 ? -11.711 -48.158 -87.750 1.00 54.82 ? 55 SER B C 1 ATOM 2555 O O . SER B 2 55 ? -10.634 -48.647 -88.095 1.00 54.59 ? 55 SER B O 1 ATOM 2556 C CB . SER B 2 55 ? -13.227 -46.203 -88.289 1.00 54.95 ? 55 SER B CB 1 ATOM 2557 O OG . SER B 2 55 ? -14.311 -46.704 -87.532 1.00 56.15 ? 55 SER B OG 1 ATOM 2558 N N . PHE B 2 56 ? -12.759 -48.898 -87.393 1.00 54.80 ? 56 PHE B N 1 ATOM 2559 C CA . PHE B 2 56 ? -12.769 -50.353 -87.548 1.00 54.28 ? 56 PHE B CA 1 ATOM 2560 C C . PHE B 2 56 ? -14.176 -50.940 -87.665 1.00 54.27 ? 56 PHE B C 1 ATOM 2561 O O . PHE B 2 56 ? -15.136 -50.405 -87.106 1.00 55.23 ? 56 PHE B O 1 ATOM 2562 C CB . PHE B 2 56 ? -11.968 -51.055 -86.438 1.00 56.57 ? 56 PHE B CB 1 ATOM 2563 C CG . PHE B 2 56 ? -12.253 -50.541 -85.050 1.00 58.87 ? 56 PHE B CG 1 ATOM 2564 C CD1 . PHE B 2 56 ? -13.340 -51.020 -84.322 1.00 59.93 ? 56 PHE B CD1 1 ATOM 2565 C CD2 . PHE B 2 56 ? -11.418 -49.596 -84.463 1.00 59.87 ? 56 PHE B CD2 1 ATOM 2566 C CE1 . PHE B 2 56 ? -13.602 -50.557 -83.045 1.00 61.88 ? 56 PHE B CE1 1 ATOM 2567 C CE2 . PHE B 2 56 ? -11.674 -49.129 -83.183 1.00 62.39 ? 56 PHE B CE2 1 ATOM 2568 C CZ . PHE B 2 56 ? -12.768 -49.611 -82.475 1.00 63.51 ? 56 PHE B CZ 1 ATOM 2569 N N . SER B 2 57 ? -14.271 -52.048 -88.399 1.00 53.66 ? 57 SER B N 1 ATOM 2570 C CA . SER B 2 57 ? -15.539 -52.731 -88.663 1.00 54.23 ? 57 SER B CA 1 ATOM 2571 C C . SER B 2 57 ? -15.826 -53.826 -87.648 1.00 56.68 ? 57 SER B C 1 ATOM 2572 O O . SER B 2 57 ? -14.999 -54.104 -86.781 1.00 57.86 ? 57 SER B O 1 ATOM 2573 C CB . SER B 2 57 ? -15.531 -53.328 -90.066 1.00 52.84 ? 57 SER B CB 1 ATOM 2574 O OG . SER B 2 57 ? -14.377 -54.118 -90.246 1.00 52.94 ? 57 SER B OG 1 ATOM 2575 N N . LYS B 2 58 ? -16.997 -54.451 -87.780 1.00 58.02 ? 58 LYS B N 1 ATOM 2576 C CA . LYS B 2 58 ? -17.482 -55.474 -86.844 1.00 61.00 ? 58 LYS B CA 1 ATOM 2577 C C . LYS B 2 58 ? -16.516 -56.651 -86.658 1.00 62.05 ? 58 LYS B C 1 ATOM 2578 O O . LYS B 2 58 ? -16.639 -57.418 -85.698 1.00 64.62 ? 58 LYS B O 1 ATOM 2579 C CB . LYS B 2 58 ? -18.864 -55.983 -87.274 1.00 62.54 ? 58 LYS B CB 1 ATOM 2580 N N . ASP B 2 59 ? -15.559 -56.779 -87.575 1.00 60.33 ? 59 ASP B N 1 ATOM 2581 C CA . ASP B 2 59 ? -14.534 -57.812 -87.480 1.00 61.88 ? 59 ASP B CA 1 ATOM 2582 C C . ASP B 2 59 ? -13.236 -57.298 -86.845 1.00 61.82 ? 59 ASP B C 1 ATOM 2583 O O . ASP B 2 59 ? -12.223 -57.999 -86.844 1.00 63.40 ? 59 ASP B O 1 ATOM 2584 C CB . ASP B 2 59 ? -14.276 -58.448 -88.854 1.00 61.21 ? 59 ASP B CB 1 ATOM 2585 C CG . ASP B 2 59 ? -13.884 -57.431 -89.912 0.70 57.91 ? 59 ASP B CG 1 ATOM 2586 O OD1 . ASP B 2 59 ? -13.078 -56.528 -89.606 0.70 56.83 ? 59 ASP B OD1 1 ATOM 2587 O OD2 . ASP B 2 59 ? -14.373 -57.540 -91.056 0.70 56.83 ? 59 ASP B OD2 1 ATOM 2588 N N . TRP B 2 60 ? -13.281 -56.077 -86.315 1.00 60.90 ? 60 TRP B N 1 ATOM 2589 C CA . TRP B 2 60 ? -12.163 -55.450 -85.582 1.00 61.72 ? 60 TRP B CA 1 ATOM 2590 C C . TRP B 2 60 ? -10.938 -55.086 -86.434 1.00 60.50 ? 60 TRP B C 1 ATOM 2591 O O . TRP B 2 60 ? -9.885 -54.732 -85.886 1.00 61.81 ? 60 TRP B O 1 ATOM 2592 C CB . TRP B 2 60 ? -11.709 -56.296 -84.378 1.00 65.22 ? 60 TRP B CB 1 ATOM 2593 C CG . TRP B 2 60 ? -12.782 -56.676 -83.417 1.00 66.95 ? 60 TRP B CG 1 ATOM 2594 C CD1 . TRP B 2 60 ? -13.375 -57.896 -83.304 1.00 68.94 ? 60 TRP B CD1 1 ATOM 2595 C CD2 . TRP B 2 60 ? -13.381 -55.842 -82.415 1.00 67.81 ? 60 TRP B CD2 1 ATOM 2596 N NE1 . TRP B 2 60 ? -14.314 -57.876 -82.302 1.00 71.12 ? 60 TRP B NE1 1 ATOM 2597 C CE2 . TRP B 2 60 ? -14.339 -56.627 -81.739 1.00 70.20 ? 60 TRP B CE2 1 ATOM 2598 C CE3 . TRP B 2 60 ? -13.208 -54.507 -82.029 1.00 67.21 ? 60 TRP B CE3 1 ATOM 2599 C CZ2 . TRP B 2 60 ? -15.122 -56.123 -80.697 1.00 71.47 ? 60 TRP B CZ2 1 ATOM 2600 C CZ3 . TRP B 2 60 ? -13.986 -54.009 -80.992 1.00 68.86 ? 60 TRP B CZ3 1 ATOM 2601 C CH2 . TRP B 2 60 ? -14.930 -54.818 -80.338 1.00 70.81 ? 60 TRP B CH2 1 ATOM 2602 N N . SER B 2 61 ? -11.065 -55.178 -87.756 1.00 58.45 ? 61 SER B N 1 ATOM 2603 C CA . SER B 2 61 ? -9.991 -54.730 -88.642 1.00 57.28 ? 61 SER B CA 1 ATOM 2604 C C . SER B 2 61 ? -10.224 -53.280 -89.059 1.00 54.95 ? 61 SER B C 1 ATOM 2605 O O . SER B 2 61 ? -11.360 -52.860 -89.272 1.00 53.65 ? 61 SER B O 1 ATOM 2606 C CB . SER B 2 61 ? -9.842 -55.649 -89.857 1.00 57.02 ? 61 SER B CB 1 ATOM 2607 O OG . SER B 2 61 ? -11.031 -55.702 -90.627 1.00 56.04 ? 61 SER B OG 1 ATOM 2608 N N . PHE B 2 62 ? -9.136 -52.525 -89.164 1.00 55.06 ? 62 PHE B N 1 ATOM 2609 C CA . PHE B 2 62 ? -9.202 -51.076 -89.347 1.00 54.00 ? 62 PHE B CA 1 ATOM 2610 C C . PHE B 2 62 ? -9.434 -50.706 -90.802 1.00 51.71 ? 62 PHE B C 1 ATOM 2611 O O . PHE B 2 62 ? -9.245 -51.539 -91.684 1.00 51.35 ? 62 PHE B O 1 ATOM 2612 C CB . PHE B 2 62 ? -7.922 -50.413 -88.821 1.00 55.87 ? 62 PHE B CB 1 ATOM 2613 C CG . PHE B 2 62 ? -7.630 -50.713 -87.374 1.00 58.29 ? 62 PHE B CG 1 ATOM 2614 C CD1 . PHE B 2 62 ? -6.874 -51.828 -87.018 1.00 59.74 ? 62 PHE B CD1 1 ATOM 2615 C CD2 . PHE B 2 62 ? -8.111 -49.886 -86.370 1.00 59.21 ? 62 PHE B CD2 1 ATOM 2616 C CE1 . PHE B 2 62 ? -6.610 -52.115 -85.689 1.00 62.38 ? 62 PHE B CE1 1 ATOM 2617 C CE2 . PHE B 2 62 ? -7.847 -50.164 -85.032 1.00 62.17 ? 62 PHE B CE2 1 ATOM 2618 C CZ . PHE B 2 62 ? -7.093 -51.281 -84.694 1.00 63.84 ? 62 PHE B CZ 1 ATOM 2619 N N . TYR B 2 63 ? -9.867 -49.468 -91.043 1.00 50.88 ? 63 TYR B N 1 ATOM 2620 C CA . TYR B 2 63 ? -10.049 -48.942 -92.402 1.00 49.14 ? 63 TYR B CA 1 ATOM 2621 C C . TYR B 2 63 ? -9.898 -47.424 -92.440 1.00 49.48 ? 63 TYR B C 1 ATOM 2622 O O . TYR B 2 63 ? -10.217 -46.742 -91.468 1.00 51.03 ? 63 TYR B O 1 ATOM 2623 C CB . TYR B 2 63 ? -11.403 -49.359 -92.985 1.00 47.91 ? 63 TYR B CB 1 ATOM 2624 C CG . TYR B 2 63 ? -12.600 -48.685 -92.358 1.00 48.65 ? 63 TYR B CG 1 ATOM 2625 C CD1 . TYR B 2 63 ? -12.934 -47.367 -92.678 1.00 48.46 ? 63 TYR B CD1 1 ATOM 2626 C CD2 . TYR B 2 63 ? -13.415 -49.375 -91.463 1.00 50.41 ? 63 TYR B CD2 1 ATOM 2627 C CE1 . TYR B 2 63 ? -14.032 -46.742 -92.107 1.00 50.26 ? 63 TYR B CE1 1 ATOM 2628 C CE2 . TYR B 2 63 ? -14.524 -48.762 -90.886 1.00 52.09 ? 63 TYR B CE2 1 ATOM 2629 C CZ . TYR B 2 63 ? -14.827 -47.444 -91.212 1.00 51.96 ? 63 TYR B CZ 1 ATOM 2630 O OH . TYR B 2 63 ? -15.924 -46.836 -90.640 1.00 53.58 ? 63 TYR B OH 1 ATOM 2631 N N . ILE B 2 64 ? -9.429 -46.895 -93.566 1.00 48.69 ? 64 ILE B N 1 ATOM 2632 C CA . ILE B 2 64 ? -9.178 -45.458 -93.691 1.00 49.69 ? 64 ILE B CA 1 ATOM 2633 C C . ILE B 2 64 ? -9.424 -44.957 -95.122 1.00 48.44 ? 64 ILE B C 1 ATOM 2634 O O . ILE B 2 64 ? -9.050 -45.622 -96.090 1.00 47.42 ? 64 ILE B O 1 ATOM 2635 C CB . ILE B 2 64 ? -7.750 -45.102 -93.192 1.00 51.83 ? 64 ILE B CB 1 ATOM 2636 C CG1 . ILE B 2 64 ? -7.480 -43.599 -93.298 1.00 53.97 ? 64 ILE B CG1 1 ATOM 2637 C CG2 . ILE B 2 64 ? -6.697 -45.919 -93.934 1.00 51.66 ? 64 ILE B CG2 1 ATOM 2638 C CD1 . ILE B 2 64 ? -6.347 -43.097 -92.407 1.00 58.12 ? 64 ILE B CD1 1 ATOM 2639 N N . LEU B 2 65 ? -10.068 -43.796 -95.245 1.00 48.90 ? 65 LEU B N 1 ATOM 2640 C CA . LEU B 2 65 ? -10.380 -43.223 -96.557 1.00 48.30 ? 65 LEU B CA 1 ATOM 2641 C C . LEU B 2 65 ? -9.489 -42.023 -96.921 1.00 49.90 ? 65 LEU B C 1 ATOM 2642 O O . LEU B 2 65 ? -9.496 -40.989 -96.246 1.00 52.00 ? 65 LEU B O 1 ATOM 2643 C CB . LEU B 2 65 ? -11.868 -42.858 -96.652 1.00 48.41 ? 65 LEU B CB 1 ATOM 2644 C CG . LEU B 2 65 ? -12.383 -42.258 -97.968 1.00 48.68 ? 65 LEU B CG 1 ATOM 2645 C CD1 . LEU B 2 65 ? -12.528 -43.319 -99.046 1.00 47.43 ? 65 LEU B CD1 1 ATOM 2646 C CD2 . LEU B 2 65 ? -13.707 -41.545 -97.757 1.00 50.16 ? 65 LEU B CD2 1 ATOM 2647 N N . ALA B 2 66 ? -8.725 -42.181 -97.997 1.00 49.34 ? 66 ALA B N 1 ATOM 2648 C CA . ALA B 2 66 ? -7.830 -41.144 -98.500 1.00 51.06 ? 66 ALA B CA 1 ATOM 2649 C C . ALA B 2 66 ? -8.406 -40.574 -99.785 1.00 50.76 ? 66 ALA B C 1 ATOM 2650 O O . ALA B 2 66 ? -8.894 -41.316 -100.632 1.00 49.29 ? 66 ALA B O 1 ATOM 2651 C CB . ALA B 2 66 ? -6.442 -41.727 -98.756 1.00 51.43 ? 66 ALA B CB 1 ATOM 2652 N N . HIS B 2 67 ? -8.357 -39.259 -99.941 1.00 52.93 ? 67 HIS B N 1 ATOM 2653 C CA . HIS B 2 67 ? -8.919 -38.642 -101.135 1.00 53.25 ? 67 HIS B CA 1 ATOM 2654 C C . HIS B 2 67 ? -8.203 -37.365 -101.538 1.00 56.14 ? 67 HIS B C 1 ATOM 2655 O O . HIS B 2 67 ? -7.737 -36.599 -100.692 1.00 58.60 ? 67 HIS B O 1 ATOM 2656 C CB . HIS B 2 67 ? -10.412 -38.382 -100.963 1.00 53.32 ? 67 HIS B CB 1 ATOM 2657 C CG . HIS B 2 67 ? -10.718 -37.317 -99.967 1.00 56.04 ? 67 HIS B CG 1 ATOM 2658 N ND1 . HIS B 2 67 ? -10.580 -37.512 -98.610 1.00 56.90 ? 67 HIS B ND1 1 ATOM 2659 C CD2 . HIS B 2 67 ? -11.139 -36.043 -100.127 1.00 59.36 ? 67 HIS B CD2 1 ATOM 2660 C CE1 . HIS B 2 67 ? -10.907 -36.402 -97.974 1.00 60.35 ? 67 HIS B CE1 1 ATOM 2661 N NE2 . HIS B 2 67 ? -11.249 -35.495 -98.872 1.00 62.45 ? 67 HIS B NE2 1 ATOM 2662 N N . THR B 2 68 ? -8.139 -37.154 -102.848 1.00 56.27 ? 68 THR B N 1 ATOM 2663 C CA . THR B 2 68 ? -7.428 -36.039 -103.444 1.00 59.36 ? 68 THR B CA 1 ATOM 2664 C C . THR B 2 68 ? -8.181 -35.551 -104.670 1.00 59.94 ? 68 THR B C 1 ATOM 2665 O O . THR B 2 68 ? -8.852 -36.339 -105.343 1.00 57.71 ? 68 THR B O 1 ATOM 2666 C CB . THR B 2 68 ? -5.980 -36.440 -103.844 1.00 59.85 ? 68 THR B CB 1 ATOM 2667 O OG1 . THR B 2 68 ? -5.383 -35.396 -104.626 1.00 63.05 ? 68 THR B OG1 1 ATOM 2668 C CG2 . THR B 2 68 ? -5.961 -37.750 -104.639 1.00 57.19 ? 68 THR B CG2 1 ATOM 2669 N N . GLU B 2 69 ? -8.069 -34.253 -104.945 1.00 63.35 ? 69 GLU B N 1 ATOM 2670 C CA . GLU B 2 69 ? -8.622 -33.666 -106.162 1.00 64.97 ? 69 GLU B CA 1 ATOM 2671 C C . GLU B 2 69 ? -7.678 -33.898 -107.347 1.00 65.20 ? 69 GLU B C 1 ATOM 2672 O O . GLU B 2 69 ? -6.480 -33.603 -107.265 1.00 66.94 ? 69 GLU B O 1 ATOM 2673 C CB . GLU B 2 69 ? -8.894 -32.170 -105.968 1.00 69.44 ? 69 GLU B CB 1 ATOM 2674 N N . PHE B 2 70 ? -8.224 -34.427 -108.443 1.00 63.98 ? 70 PHE B N 1 ATOM 2675 C CA . PHE B 2 70 ? -7.428 -34.782 -109.620 1.00 64.26 ? 70 PHE B CA 1 ATOM 2676 C C . PHE B 2 70 ? -8.179 -34.570 -110.935 1.00 65.48 ? 70 PHE B C 1 ATOM 2677 O O . PHE B 2 70 ? -9.412 -34.540 -110.965 1.00 65.25 ? 70 PHE B O 1 ATOM 2678 C CB . PHE B 2 70 ? -7.000 -36.246 -109.537 1.00 61.10 ? 70 PHE B CB 1 ATOM 2679 C CG . PHE B 2 70 ? -8.006 -37.198 -110.113 1.00 59.19 ? 70 PHE B CG 1 ATOM 2680 C CD1 . PHE B 2 70 ? -9.181 -37.485 -109.432 1.00 58.01 ? 70 PHE B CD1 1 ATOM 2681 C CD2 . PHE B 2 70 ? -7.790 -37.789 -111.344 1.00 59.53 ? 70 PHE B CD2 1 ATOM 2682 C CE1 . PHE B 2 70 ? -10.117 -38.357 -109.967 1.00 57.15 ? 70 PHE B CE1 1 ATOM 2683 C CE2 . PHE B 2 70 ? -8.718 -38.658 -111.880 1.00 58.86 ? 70 PHE B CE2 1 ATOM 2684 C CZ . PHE B 2 70 ? -9.886 -38.944 -111.193 1.00 57.41 ? 70 PHE B CZ 1 ATOM 2685 N N . THR B 2 71 ? -7.414 -34.458 -112.020 1.00 67.14 ? 71 THR B N 1 ATOM 2686 C CA . THR B 2 71 ? -7.953 -34.356 -113.371 1.00 68.54 ? 71 THR B CA 1 ATOM 2687 C C . THR B 2 71 ? -7.574 -35.609 -114.167 1.00 66.88 ? 71 THR B C 1 ATOM 2688 O O . THR B 2 71 ? -6.387 -35.892 -114.338 1.00 67.41 ? 71 THR B O 1 ATOM 2689 C CB . THR B 2 71 ? -7.426 -33.086 -114.072 1.00 72.83 ? 71 THR B CB 1 ATOM 2690 O OG1 . THR B 2 71 ? -7.920 -31.932 -113.386 1.00 74.94 ? 71 THR B OG1 1 ATOM 2691 C CG2 . THR B 2 71 ? -7.873 -33.030 -115.522 1.00 74.79 ? 71 THR B CG2 1 ATOM 2692 N N . PRO B 2 72 ? -8.578 -36.371 -114.647 1.00 65.55 ? 72 PRO B N 1 ATOM 2693 C CA . PRO B 2 72 ? -8.295 -37.586 -115.407 1.00 64.49 ? 72 PRO B CA 1 ATOM 2694 C C . PRO B 2 72 ? -8.042 -37.308 -116.879 1.00 67.59 ? 72 PRO B C 1 ATOM 2695 O O . PRO B 2 72 ? -8.755 -36.521 -117.499 1.00 69.96 ? 72 PRO B O 1 ATOM 2696 C CB . PRO B 2 72 ? -9.568 -38.416 -115.239 1.00 62.67 ? 72 PRO B CB 1 ATOM 2697 C CG . PRO B 2 72 ? -10.645 -37.443 -114.896 1.00 63.99 ? 72 PRO B CG 1 ATOM 2698 C CD . PRO B 2 72 ? -10.025 -36.133 -114.504 1.00 65.78 ? 72 PRO B CD 1 ATOM 2699 N N . THR B 2 73 ? -7.015 -37.950 -117.421 1.00 68.06 ? 73 THR B N 1 ATOM 2700 C CA . THR B 2 73 ? -6.691 -37.853 -118.839 1.00 71.27 ? 73 THR B CA 1 ATOM 2701 C C . THR B 2 73 ? -6.397 -39.240 -119.405 1.00 70.96 ? 73 THR B C 1 ATOM 2702 O O . THR B 2 73 ? -6.330 -40.221 -118.661 1.00 68.27 ? 73 THR B O 1 ATOM 2703 C CB . THR B 2 73 ? -5.487 -36.922 -119.092 1.00 73.99 ? 73 THR B CB 1 ATOM 2704 O OG1 . THR B 2 73 ? -4.418 -37.266 -118.205 1.00 72.55 ? 73 THR B OG1 1 ATOM 2705 C CG2 . THR B 2 73 ? -5.875 -35.470 -118.875 1.00 76.03 ? 73 THR B CG2 1 ATOM 2706 N N . GLU B 2 74 ? -6.224 -39.309 -120.723 1.00 74.26 ? 74 GLU B N 1 ATOM 2707 C CA . GLU B 2 74 ? -5.966 -40.565 -121.421 1.00 75.18 ? 74 GLU B CA 1 ATOM 2708 C C . GLU B 2 74 ? -4.600 -41.179 -121.100 1.00 75.17 ? 74 GLU B C 1 ATOM 2709 O O . GLU B 2 74 ? -4.433 -42.397 -121.188 1.00 75.00 ? 74 GLU B O 1 ATOM 2710 C CB . GLU B 2 74 ? -6.108 -40.369 -122.933 1.00 79.23 ? 74 GLU B CB 1 ATOM 2711 N N . THR B 2 75 ? -3.642 -40.339 -120.712 1.00 76.05 ? 75 THR B N 1 ATOM 2712 C CA . THR B 2 75 ? -2.247 -40.764 -120.549 1.00 77.40 ? 75 THR B CA 1 ATOM 2713 C C . THR B 2 75 ? -1.730 -40.776 -119.104 1.00 75.02 ? 75 THR B C 1 ATOM 2714 O O . THR B 2 75 ? -1.017 -41.705 -118.721 1.00 74.98 ? 75 THR B O 1 ATOM 2715 C CB . THR B 2 75 ? -1.297 -39.900 -121.394 1.00 81.66 ? 75 THR B CB 1 ATOM 2716 O OG1 . THR B 2 75 ? -1.548 -38.518 -121.115 1.00 82.30 ? 75 THR B OG1 1 ATOM 2717 C CG2 . THR B 2 75 ? -1.499 -40.164 -122.885 1.00 84.97 ? 75 THR B CG2 1 ATOM 2718 N N . ASP B 2 76 ? -2.069 -39.752 -118.318 1.00 73.70 ? 76 ASP B N 1 ATOM 2719 C CA . ASP B 2 76 ? -1.607 -39.646 -116.925 1.00 71.89 ? 76 ASP B CA 1 ATOM 2720 C C . ASP B 2 76 ? -2.104 -40.818 -116.085 1.00 68.27 ? 76 ASP B C 1 ATOM 2721 O O . ASP B 2 76 ? -3.260 -41.218 -116.209 1.00 66.47 ? 76 ASP B O 1 ATOM 2722 C CB . ASP B 2 76 ? -2.053 -38.318 -116.296 1.00 71.85 ? 76 ASP B CB 1 ATOM 2723 C CG . ASP B 2 76 ? -1.162 -37.134 -116.699 1.00 76.27 ? 76 ASP B CG 1 ATOM 2724 O OD1 . ASP B 2 76 ? 0.082 -37.281 -116.723 1.00 78.88 ? 76 ASP B OD1 1 ATOM 2725 O OD2 . ASP B 2 76 ? -1.708 -36.043 -116.977 1.00 77.90 ? 76 ASP B OD2 1 ATOM 2726 N N . THR B 2 77 ? -1.228 -41.361 -115.239 1.00 67.88 ? 77 THR B N 1 ATOM 2727 C CA . THR B 2 77 ? -1.543 -42.555 -114.439 1.00 65.24 ? 77 THR B CA 1 ATOM 2728 C C . THR B 2 77 ? -1.659 -42.266 -112.941 1.00 63.07 ? 77 THR B C 1 ATOM 2729 O O . THR B 2 77 ? -0.808 -41.586 -112.365 1.00 64.56 ? 77 THR B O 1 ATOM 2730 C CB . THR B 2 77 ? -0.498 -43.680 -114.634 1.00 67.17 ? 77 THR B CB 1 ATOM 2731 O OG1 . THR B 2 77 ? 0.728 -43.327 -113.982 1.00 68.94 ? 77 THR B OG1 1 ATOM 2732 C CG2 . THR B 2 77 ? -0.239 -43.946 -116.113 1.00 70.27 ? 77 THR B CG2 1 ATOM 2733 N N . TYR B 2 78 ? -2.704 -42.804 -112.315 1.00 60.08 ? 78 TYR B N 1 ATOM 2734 C CA . TYR B 2 78 ? -2.972 -42.561 -110.896 1.00 58.15 ? 78 TYR B CA 1 ATOM 2735 C C . TYR B 2 78 ? -2.917 -43.854 -110.100 1.00 56.89 ? 78 TYR B C 1 ATOM 2736 O O . TYR B 2 78 ? -3.519 -44.855 -110.497 1.00 56.37 ? 78 TYR B O 1 ATOM 2737 C CB . TYR B 2 78 ? -4.338 -41.899 -110.710 1.00 56.31 ? 78 TYR B CB 1 ATOM 2738 C CG . TYR B 2 78 ? -4.402 -40.465 -111.188 1.00 58.04 ? 78 TYR B CG 1 ATOM 2739 C CD1 . TYR B 2 78 ? -4.801 -40.155 -112.487 1.00 58.97 ? 78 TYR B CD1 1 ATOM 2740 C CD2 . TYR B 2 78 ? -4.068 -39.419 -110.337 1.00 58.84 ? 78 TYR B CD2 1 ATOM 2741 C CE1 . TYR B 2 78 ? -4.855 -38.839 -112.924 1.00 60.96 ? 78 TYR B CE1 1 ATOM 2742 C CE2 . TYR B 2 78 ? -4.122 -38.105 -110.764 1.00 61.25 ? 78 TYR B CE2 1 ATOM 2743 C CZ . TYR B 2 78 ? -4.513 -37.819 -112.055 1.00 62.20 ? 78 TYR B CZ 1 ATOM 2744 O OH . TYR B 2 78 ? -4.564 -36.504 -112.461 1.00 64.99 ? 78 TYR B OH 1 ATOM 2745 N N . ALA B 2 79 ? -2.198 -43.833 -108.979 1.00 57.21 ? 79 ALA B N 1 ATOM 2746 C CA . ALA B 2 79 ? -2.052 -45.026 -108.150 1.00 56.53 ? 79 ALA B CA 1 ATOM 2747 C C . ALA B 2 79 ? -1.987 -44.738 -106.656 1.00 56.05 ? 79 ALA B C 1 ATOM 2748 O O . ALA B 2 79 ? -1.554 -43.663 -106.235 1.00 57.25 ? 79 ALA B O 1 ATOM 2749 C CB . ALA B 2 79 ? -0.841 -45.828 -108.578 1.00 59.18 ? 79 ALA B CB 1 ATOM 2750 N N . CYS B 2 80 ? -2.418 -45.726 -105.870 1.00 54.85 ? 80 CYS B N 1 ATOM 2751 C CA . CYS B 2 80 ? -2.391 -45.676 -104.412 1.00 54.52 ? 80 CYS B CA 1 ATOM 2752 C C . CYS B 2 80 ? -1.327 -46.647 -103.878 1.00 56.15 ? 80 CYS B C 1 ATOM 2753 O O . CYS B 2 80 ? -1.417 -47.853 -104.109 1.00 56.08 ? 80 CYS B O 1 ATOM 2754 C CB . CYS B 2 80 ? -3.776 -46.031 -103.858 1.00 51.95 ? 80 CYS B CB 1 ATOM 2755 S SG . CYS B 2 80 ? -4.044 -45.486 -102.151 1.00 53.16 ? 80 CYS B SG 1 ATOM 2756 N N . ARG B 2 81 ? -0.322 -46.110 -103.181 1.00 58.16 ? 81 ARG B N 1 ATOM 2757 C CA . ARG B 2 81 ? 0.797 -46.905 -102.659 1.00 60.78 ? 81 ARG B CA 1 ATOM 2758 C C . ARG B 2 81 ? 0.709 -47.056 -101.143 1.00 60.69 ? 81 ARG B C 1 ATOM 2759 O O . ARG B 2 81 ? 0.695 -46.060 -100.408 1.00 61.11 ? 81 ARG B O 1 ATOM 2760 C CB . ARG B 2 81 ? 2.142 -46.270 -103.029 1.00 64.67 ? 81 ARG B CB 1 ATOM 2761 C CG . ARG B 2 81 ? 3.276 -47.278 -103.166 1.00 68.65 ? 81 ARG B CG 1 ATOM 2762 C CD . ARG B 2 81 ? 4.585 -46.826 -102.509 1.00 74.01 ? 81 ARG B CD 1 ATOM 2763 N NE . ARG B 2 81 ? 5.165 -45.614 -103.092 1.00 76.98 ? 81 ARG B NE 1 ATOM 2764 C CZ . ARG B 2 81 ? 5.881 -45.567 -104.216 1.00 79.69 ? 81 ARG B CZ 1 ATOM 2765 N NH1 . ARG B 2 81 ? 6.112 -46.667 -104.924 1.00 80.55 ? 81 ARG B NH1 1 ATOM 2766 N NH2 . ARG B 2 81 ? 6.362 -44.406 -104.640 1.00 82.09 ? 81 ARG B NH2 1 ATOM 2767 N N . VAL B 2 82 ? 0.678 -48.304 -100.680 1.00 60.58 ? 82 VAL B N 1 ATOM 2768 C CA . VAL B 2 82 ? 0.427 -48.606 -99.271 1.00 60.22 ? 82 VAL B CA 1 ATOM 2769 C C . VAL B 2 82 ? 1.580 -49.359 -98.597 1.00 64.10 ? 82 VAL B C 1 ATOM 2770 O O . VAL B 2 82 ? 1.939 -50.464 -99.010 1.00 65.60 ? 82 VAL B O 1 ATOM 2771 C CB . VAL B 2 82 ? -0.910 -49.365 -99.111 1.00 56.90 ? 82 VAL B CB 1 ATOM 2772 C CG1 . VAL B 2 82 ? -0.978 -50.108 -97.788 1.00 57.99 ? 82 VAL B CG1 1 ATOM 2773 C CG2 . VAL B 2 82 ? -2.069 -48.402 -99.237 1.00 53.67 ? 82 VAL B CG2 1 ATOM 2774 N N . LYS B 2 83 ? 2.152 -48.745 -97.560 1.00 66.28 ? 83 LYS B N 1 ATOM 2775 C CA . LYS B 2 83 ? 3.203 -49.372 -96.763 1.00 70.51 ? 83 LYS B CA 1 ATOM 2776 C C . LYS B 2 83 ? 2.623 -49.843 -95.434 1.00 69.99 ? 83 LYS B C 1 ATOM 2777 O O . LYS B 2 83 ? 2.087 -49.051 -94.666 1.00 68.87 ? 83 LYS B O 1 ATOM 2778 C CB . LYS B 2 83 ? 4.370 -48.402 -96.541 1.00 74.68 ? 83 LYS B CB 1 ATOM 2779 C CG . LYS B 2 83 ? 5.654 -49.060 -96.052 1.00 80.00 ? 83 LYS B CG 1 ATOM 2780 N N . HIS B 2 84 ? 2.723 -51.142 -95.179 1.00 71.38 ? 84 HIS B N 1 ATOM 2781 C CA . HIS B 2 84 ? 2.169 -51.746 -93.974 1.00 71.44 ? 84 HIS B CA 1 ATOM 2782 C C . HIS B 2 84 ? 3.063 -52.901 -93.537 1.00 76.26 ? 84 HIS B C 1 ATOM 2783 O O . HIS B 2 84 ? 3.748 -53.511 -94.362 1.00 78.44 ? 84 HIS B O 1 ATOM 2784 C CB . HIS B 2 84 ? 0.740 -52.228 -94.233 1.00 66.99 ? 84 HIS B CB 1 ATOM 2785 C CG . HIS B 2 84 ? 0.025 -52.712 -93.010 1.00 66.89 ? 84 HIS B CG 1 ATOM 2786 N ND1 . HIS B 2 84 ? -0.084 -54.048 -92.692 1.00 68.37 ? 84 HIS B ND1 1 ATOM 2787 C CD2 . HIS B 2 84 ? -0.627 -52.041 -92.031 1.00 66.03 ? 84 HIS B CD2 1 ATOM 2788 C CE1 . HIS B 2 84 ? -0.770 -54.180 -91.571 1.00 68.01 ? 84 HIS B CE1 1 ATOM 2789 N NE2 . HIS B 2 84 ? -1.111 -52.976 -91.149 1.00 66.45 ? 84 HIS B NE2 1 ATOM 2790 N N . ALA B 2 85 ? 3.055 -53.190 -92.237 1.00 78.48 ? 85 ALA B N 1 ATOM 2791 C CA . ALA B 2 85 ? 3.938 -54.195 -91.642 1.00 83.88 ? 85 ALA B CA 1 ATOM 2792 C C . ALA B 2 85 ? 3.661 -55.623 -92.121 1.00 84.32 ? 85 ALA B C 1 ATOM 2793 O O . ALA B 2 85 ? 4.545 -56.481 -92.066 1.00 89.11 ? 85 ALA B O 1 ATOM 2794 C CB . ALA B 2 85 ? 3.870 -54.120 -90.121 1.00 85.91 ? 85 ALA B CB 1 ATOM 2795 N N . SER B 2 86 ? 2.439 -55.867 -92.591 1.00 80.02 ? 86 SER B N 1 ATOM 2796 C CA . SER B 2 86 ? 2.035 -57.196 -93.053 1.00 80.80 ? 86 SER B CA 1 ATOM 2797 C C . SER B 2 86 ? 2.586 -57.559 -94.437 1.00 82.25 ? 86 SER B C 1 ATOM 2798 O O . SER B 2 86 ? 2.551 -58.728 -94.831 1.00 84.37 ? 86 SER B O 1 ATOM 2799 C CB . SER B 2 86 ? 0.511 -57.345 -93.024 1.00 76.22 ? 86 SER B CB 1 ATOM 2800 O OG . SER B 2 86 ? -0.111 -56.338 -93.800 1.00 71.86 ? 86 SER B OG 1 ATOM 2801 N N . MET B 2 87 ? 3.093 -56.563 -95.164 1.00 81.75 ? 87 MET B N 1 ATOM 2802 C CA . MET B 2 87 ? 3.694 -56.785 -96.485 1.00 83.74 ? 87 MET B CA 1 ATOM 2803 C C . MET B 2 87 ? 5.167 -56.389 -96.519 1.00 88.58 ? 87 MET B C 1 ATOM 2804 O O . MET B 2 87 ? 5.552 -55.353 -95.972 1.00 88.87 ? 87 MET B O 1 ATOM 2805 C CB . MET B 2 87 ? 2.936 -56.017 -97.567 1.00 79.08 ? 87 MET B CB 1 ATOM 2806 C CG . MET B 2 87 ? 1.443 -56.277 -97.586 1.00 75.56 ? 87 MET B CG 1 ATOM 2807 S SD . MET B 2 87 ? 0.542 -55.104 -98.612 1.00 72.22 ? 87 MET B SD 1 ATOM 2808 C CE . MET B 2 87 ? 0.904 -53.543 -97.804 1.00 71.12 ? 87 MET B CE 1 ATOM 2809 N N . ALA B 2 88 ? 5.983 -57.219 -97.166 1.00 93.13 ? 88 ALA B N 1 ATOM 2810 C CA . ALA B 2 88 ? 7.410 -56.939 -97.316 1.00 98.54 ? 88 ALA B CA 1 ATOM 2811 C C . ALA B 2 88 ? 7.609 -55.724 -98.216 1.00 96.46 ? 88 ALA B C 1 ATOM 2812 O O . ALA B 2 88 ? 8.242 -54.743 -97.821 1.00 98.02 ? 88 ALA B O 1 ATOM 2813 C CB . ALA B 2 88 ? 8.153 -58.158 -97.871 1.00 104.20 ? 88 ALA B CB 1 ATOM 2814 N N . GLU B 2 89 ? 7.051 -55.796 -99.420 1.00 93.35 ? 89 GLU B N 1 ATOM 2815 C CA . GLU B 2 89 ? 7.092 -54.682 -100.351 1.00 91.11 ? 89 GLU B CA 1 ATOM 2816 C C . GLU B 2 89 ? 5.803 -53.870 -100.234 1.00 84.43 ? 89 GLU B C 1 ATOM 2817 O O . GLU B 2 89 ? 4.758 -54.418 -99.867 1.00 81.50 ? 89 GLU B O 1 ATOM 2818 C CB . GLU B 2 89 ? 7.278 -55.194 -101.780 1.00 92.56 ? 89 GLU B CB 1 ATOM 2819 C CG . GLU B 2 89 ? 8.617 -55.874 -102.032 1.00 99.90 ? 89 GLU B CG 1 ATOM 2820 N N . PRO B 2 90 ? 5.870 -52.557 -100.524 1.00 82.58 ? 90 PRO B N 1 ATOM 2821 C CA . PRO B 2 90 ? 4.645 -51.761 -100.555 1.00 76.75 ? 90 PRO B CA 1 ATOM 2822 C C . PRO B 2 90 ? 3.722 -52.254 -101.660 1.00 73.56 ? 90 PRO B C 1 ATOM 2823 O O . PRO B 2 90 ? 4.197 -52.804 -102.654 1.00 75.87 ? 90 PRO B O 1 ATOM 2824 C CB . PRO B 2 90 ? 5.146 -50.350 -100.881 1.00 77.30 ? 90 PRO B CB 1 ATOM 2825 C CG . PRO B 2 90 ? 6.571 -50.344 -100.478 1.00 83.25 ? 90 PRO B CG 1 ATOM 2826 C CD . PRO B 2 90 ? 7.067 -51.728 -100.752 1.00 86.50 ? 90 PRO B CD 1 ATOM 2827 N N . LYS B 2 91 ? 2.417 -52.072 -101.478 1.00 68.85 ? 91 LYS B N 1 ATOM 2828 C CA . LYS B 2 91 ? 1.430 -52.504 -102.462 1.00 66.06 ? 91 LYS B CA 1 ATOM 2829 C C . LYS B 2 91 ? 0.970 -51.311 -103.294 1.00 63.44 ? 91 LYS B C 1 ATOM 2830 O O . LYS B 2 91 ? 0.407 -50.352 -102.767 1.00 60.95 ? 91 LYS B O 1 ATOM 2831 C CB . LYS B 2 91 ? 0.245 -53.183 -101.770 1.00 63.54 ? 91 LYS B CB 1 ATOM 2832 C CG . LYS B 2 91 ? -0.462 -54.224 -102.616 1.00 63.30 ? 91 LYS B CG 1 ATOM 2833 N N . THR B 2 92 ? 1.227 -51.378 -104.596 1.00 64.58 ? 92 THR B N 1 ATOM 2834 C CA . THR B 2 92 ? 0.892 -50.298 -105.522 1.00 62.86 ? 92 THR B CA 1 ATOM 2835 C C . THR B 2 92 ? -0.266 -50.703 -106.432 1.00 60.71 ? 92 THR B C 1 ATOM 2836 O O . THR B 2 92 ? -0.101 -51.543 -107.320 1.00 62.62 ? 92 THR B O 1 ATOM 2837 C CB . THR B 2 92 ? 2.119 -49.888 -106.379 1.00 66.40 ? 92 THR B CB 1 ATOM 2838 O OG1 . THR B 2 92 ? 3.265 -49.719 -105.536 1.00 69.38 ? 92 THR B OG1 1 ATOM 2839 C CG2 . THR B 2 92 ? 1.854 -48.589 -107.124 1.00 65.19 ? 92 THR B CG2 1 ATOM 2840 N N . VAL B 2 93 ? -1.426 -50.092 -106.203 1.00 57.36 ? 93 VAL B N 1 ATOM 2841 C CA . VAL B 2 93 ? -2.631 -50.337 -106.999 1.00 55.81 ? 93 VAL B CA 1 ATOM 2842 C C . VAL B 2 93 ? -3.007 -49.118 -107.862 1.00 55.04 ? 93 VAL B C 1 ATOM 2843 O O . VAL B 2 93 ? -3.120 -48.007 -107.343 1.00 53.97 ? 93 VAL B O 1 ATOM 2844 C CB . VAL B 2 93 ? -3.804 -50.742 -106.087 1.00 53.37 ? 93 VAL B CB 1 ATOM 2845 C CG1 . VAL B 2 93 ? -5.121 -50.760 -106.850 1.00 52.30 ? 93 VAL B CG1 1 ATOM 2846 C CG2 . VAL B 2 93 ? -3.536 -52.099 -105.473 1.00 54.86 ? 93 VAL B CG2 1 ATOM 2847 N N . TYR B 2 94 ? -3.199 -49.337 -109.168 1.00 56.17 ? 94 TYR B N 1 ATOM 2848 C CA . TYR B 2 94 ? -3.500 -48.261 -110.131 1.00 56.10 ? 94 TYR B CA 1 ATOM 2849 C C . TYR B 2 94 ? -4.992 -48.048 -110.370 1.00 54.43 ? 94 TYR B C 1 ATOM 2850 O O . TYR B 2 94 ? -5.778 -49.000 -110.309 1.00 54.19 ? 94 TYR B O 1 ATOM 2851 C CB . TYR B 2 94 ? -2.828 -48.539 -111.479 1.00 58.85 ? 94 TYR B CB 1 ATOM 2852 C CG . TYR B 2 94 ? -1.324 -48.418 -111.458 1.00 61.25 ? 94 TYR B CG 1 ATOM 2853 C CD1 . TYR B 2 94 ? -0.518 -49.537 -111.237 1.00 63.30 ? 94 TYR B CD1 1 ATOM 2854 C CD2 . TYR B 2 94 ? -0.703 -47.188 -111.669 1.00 61.70 ? 94 TYR B CD2 1 ATOM 2855 C CE1 . TYR B 2 94 ? 0.865 -49.430 -111.216 1.00 66.12 ? 94 TYR B CE1 1 ATOM 2856 C CE2 . TYR B 2 94 ? 0.681 -47.072 -111.650 1.00 64.68 ? 94 TYR B CE2 1 ATOM 2857 C CZ . TYR B 2 94 ? 1.456 -48.196 -111.422 1.00 66.82 ? 94 TYR B CZ 1 ATOM 2858 O OH . TYR B 2 94 ? 2.822 -48.086 -111.400 1.00 70.70 ? 94 TYR B OH 1 ATOM 2859 N N . TRP B 2 95 ? -5.370 -46.803 -110.668 1.00 53.95 ? 95 TRP B N 1 ATOM 2860 C CA . TRP B 2 95 ? -6.758 -46.466 -110.972 1.00 53.16 ? 95 TRP B CA 1 ATOM 2861 C C . TRP B 2 95 ? -7.181 -46.989 -112.340 1.00 55.21 ? 95 TRP B C 1 ATOM 2862 O O . TRP B 2 95 ? -6.581 -46.631 -113.358 1.00 57.18 ? 95 TRP B O 1 ATOM 2863 C CB . TRP B 2 95 ? -6.978 -44.957 -110.899 1.00 52.82 ? 95 TRP B CB 1 ATOM 2864 C CG . TRP B 2 95 ? -8.390 -44.532 -111.237 1.00 53.01 ? 95 TRP B CG 1 ATOM 2865 C CD1 . TRP B 2 95 ? -9.551 -45.095 -110.785 1.00 52.62 ? 95 TRP B CD1 1 ATOM 2866 C CD2 . TRP B 2 95 ? -8.780 -43.448 -112.085 1.00 54.83 ? 95 TRP B CD2 1 ATOM 2867 N NE1 . TRP B 2 95 ? -10.637 -44.434 -111.305 1.00 53.26 ? 95 TRP B NE1 1 ATOM 2868 C CE2 . TRP B 2 95 ? -10.192 -43.416 -112.102 1.00 54.78 ? 95 TRP B CE2 1 ATOM 2869 C CE3 . TRP B 2 95 ? -8.072 -42.497 -112.832 1.00 57.34 ? 95 TRP B CE3 1 ATOM 2870 C CZ2 . TRP B 2 95 ? -10.911 -42.474 -112.836 1.00 57.19 ? 95 TRP B CZ2 1 ATOM 2871 C CZ3 . TRP B 2 95 ? -8.789 -41.559 -113.565 1.00 59.15 ? 95 TRP B CZ3 1 ATOM 2872 C CH2 . TRP B 2 95 ? -10.195 -41.557 -113.561 1.00 59.09 ? 95 TRP B CH2 1 ATOM 2873 N N . ASP B 2 96 ? -8.223 -47.822 -112.348 1.00 55.24 ? 96 ASP B N 1 ATOM 2874 C CA . ASP B 2 96 ? -8.729 -48.460 -113.564 1.00 57.96 ? 96 ASP B CA 1 ATOM 2875 C C . ASP B 2 96 ? -10.187 -48.062 -113.787 1.00 58.23 ? 96 ASP B C 1 ATOM 2876 O O . ASP B 2 96 ? -11.107 -48.835 -113.504 1.00 58.54 ? 96 ASP B O 1 ATOM 2877 C CB . ASP B 2 96 ? -8.581 -49.991 -113.458 1.00 59.18 ? 96 ASP B CB 1 ATOM 2878 C CG . ASP B 2 96 ? -8.845 -50.730 -114.786 1.00 63.12 ? 96 ASP B CG 1 ATOM 2879 O OD1 . ASP B 2 96 ? -9.485 -50.168 -115.701 1.00 65.12 ? 96 ASP B OD1 1 ATOM 2880 O OD2 . ASP B 2 96 ? -8.417 -51.902 -114.908 1.00 65.42 ? 96 ASP B OD2 1 ATOM 2881 N N . ARG B 2 97 ? -10.379 -46.857 -114.320 1.00 59.07 ? 97 ARG B N 1 ATOM 2882 C CA . ARG B 2 97 ? -11.706 -46.240 -114.497 1.00 59.97 ? 97 ARG B CA 1 ATOM 2883 C C . ARG B 2 97 ? -12.822 -47.156 -115.025 1.00 62.30 ? 97 ARG B C 1 ATOM 2884 O O . ARG B 2 97 ? -14.009 -46.858 -114.851 1.00 62.91 ? 97 ARG B O 1 ATOM 2885 C CB . ARG B 2 97 ? -11.603 -44.980 -115.367 1.00 61.42 ? 97 ARG B CB 1 ATOM 2886 C CG . ARG B 2 97 ? -11.389 -45.243 -116.847 1.00 64.44 ? 97 ARG B CG 1 ATOM 2887 C CD . ARG B 2 97 ? -11.285 -43.947 -117.629 1.00 66.19 ? 97 ARG B CD 1 ATOM 2888 N NE . ARG B 2 97 ? -10.041 -43.235 -117.343 1.00 65.27 ? 97 ARG B NE 1 ATOM 2889 C CZ . ARG B 2 97 ? -9.707 -42.054 -117.858 1.00 66.62 ? 97 ARG B CZ 1 ATOM 2890 N NH1 . ARG B 2 97 ? -10.518 -41.425 -118.699 1.00 68.67 ? 97 ARG B NH1 1 ATOM 2891 N NH2 . ARG B 2 97 ? -8.549 -41.500 -117.528 1.00 66.65 ? 97 ARG B NH2 1 ATOM 2892 N N . ASP B 2 98 ? -12.445 -48.259 -115.663 1.00 64.36 ? 98 ASP B N 1 ATOM 2893 C CA . ASP B 2 98 ? -13.431 -49.198 -116.170 1.00 67.52 ? 98 ASP B CA 1 ATOM 2894 C C . ASP B 2 98 ? -13.866 -50.238 -115.126 1.00 66.77 ? 98 ASP B C 1 ATOM 2895 O O . ASP B 2 98 ? -15.060 -50.512 -114.998 1.00 68.19 ? 98 ASP B O 1 ATOM 2896 C CB . ASP B 2 98 ? -12.954 -49.848 -117.480 1.00 71.14 ? 98 ASP B CB 1 ATOM 2897 C CG . ASP B 2 98 ? -13.117 -48.920 -118.698 1.00 74.08 ? 98 ASP B CG 1 ATOM 2898 O OD1 . ASP B 2 98 ? -13.501 -47.744 -118.517 1.00 73.89 ? 98 ASP B OD1 1 ATOM 2899 O OD2 . ASP B 2 98 ? -12.871 -49.365 -119.844 1.00 77.66 ? 98 ASP B OD2 1 ATOM 2900 N N . MET B 2 99 ? -12.915 -50.795 -114.372 1.00 65.15 ? 99 MET B N 1 ATOM 2901 C CA . MET B 2 99 ? -13.226 -51.872 -113.409 1.00 64.89 ? 99 MET B CA 1 ATOM 2902 C C . MET B 2 99 ? -13.959 -51.354 -112.183 1.00 62.48 ? 99 MET B C 1 ATOM 2903 O O . MET B 2 99 ? -14.091 -50.143 -112.003 1.00 61.17 ? 99 MET B O 1 ATOM 2904 C CB . MET B 2 99 ? -11.965 -52.635 -112.984 1.00 64.33 ? 99 MET B CB 1 ATOM 2905 N N . THR C 3 1 ? 6.073 -29.839 -55.162 1.00 101.18 ? 1 THR C N 1 ATOM 2906 C CA . THR C 3 1 ? 5.638 -31.088 -54.472 1.00 93.71 ? 1 THR C CA 1 ATOM 2907 C C . THR C 3 1 ? 4.169 -31.405 -54.757 1.00 90.15 ? 1 THR C C 1 ATOM 2908 O O . THR C 3 1 ? 3.307 -30.519 -54.710 1.00 91.06 ? 1 THR C O 1 ATOM 2909 C CB . THR C 3 1 ? 5.861 -31.005 -52.943 1.00 89.82 ? 1 THR C CB 1 ATOM 2910 N N . GLN C 3 2 ? 3.898 -32.677 -55.043 1.00 86.90 ? 2 GLN C N 1 ATOM 2911 C CA . GLN C 3 2 ? 2.564 -33.136 -55.411 1.00 84.36 ? 2 GLN C CA 1 ATOM 2912 C C . GLN C 3 2 ? 1.537 -33.000 -54.286 1.00 79.85 ? 2 GLN C C 1 ATOM 2913 O O . GLN C 3 2 ? 0.370 -32.709 -54.543 1.00 80.22 ? 2 GLN C O 1 ATOM 2914 C CB . GLN C 3 2 ? 2.629 -34.587 -55.884 1.00 83.13 ? 2 GLN C CB 1 ATOM 2915 N N . VAL C 3 3 ? 1.977 -33.219 -53.047 1.00 76.37 ? 3 VAL C N 1 ATOM 2916 C CA . VAL C 3 3 ? 1.096 -33.171 -51.870 1.00 72.53 ? 3 VAL C CA 1 ATOM 2917 C C . VAL C 3 3 ? 1.734 -32.372 -50.725 1.00 72.15 ? 3 VAL C C 1 ATOM 2918 O O . VAL C 3 3 ? 2.842 -32.688 -50.281 1.00 71.83 ? 3 VAL C O 1 ATOM 2919 C CB . VAL C 3 3 ? 0.703 -34.597 -51.392 1.00 68.57 ? 3 VAL C CB 1 ATOM 2920 C CG1 . VAL C 3 3 ? 0.139 -34.574 -49.978 1.00 65.25 ? 3 VAL C CG1 1 ATOM 2921 C CG2 . VAL C 3 3 ? -0.295 -35.216 -52.347 1.00 69.22 ? 3 VAL C CG2 1 ATOM 2922 N N . GLU C 3 4 ? 1.023 -31.348 -50.253 1.00 72.88 ? 4 GLU C N 1 ATOM 2923 C CA . GLU C 3 4 ? 1.558 -30.418 -49.255 1.00 73.67 ? 4 GLU C CA 1 ATOM 2924 C C . GLU C 3 4 ? 0.800 -30.460 -47.922 1.00 70.33 ? 4 GLU C C 1 ATOM 2925 O O . GLU C 3 4 ? -0.429 -30.573 -47.899 1.00 69.64 ? 4 GLU C O 1 ATOM 2926 C CB . GLU C 3 4 ? 1.573 -28.990 -49.818 1.00 79.33 ? 4 GLU C CB 1 ATOM 2927 N N . GLN C 3 5 ? 1.547 -30.373 -46.821 1.00 68.95 ? 5 GLN C N 1 ATOM 2928 C CA . GLN C 3 5 ? 0.966 -30.371 -45.478 1.00 66.43 ? 5 GLN C CA 1 ATOM 2929 C C . GLN C 3 5 ? 1.292 -29.100 -44.698 1.00 69.23 ? 5 GLN C C 1 ATOM 2930 O O . GLN C 3 5 ? 2.405 -28.578 -44.762 1.00 71.77 ? 5 GLN C O 1 ATOM 2931 C CB . GLN C 3 5 ? 1.375 -31.622 -44.687 1.00 62.51 ? 5 GLN C CB 1 ATOM 2932 C CG . GLN C 3 5 ? 0.314 -32.733 -44.711 1.00 60.12 ? 5 GLN C CG 1 ATOM 2933 C CD . GLN C 3 5 ? 0.851 -34.121 -44.362 1.00 57.43 ? 5 GLN C CD 1 ATOM 2934 O OE1 . GLN C 3 5 ? 0.484 -34.709 -43.342 1.00 55.36 ? 5 GLN C OE1 1 ATOM 2935 N NE2 . GLN C 3 5 ? 1.705 -34.653 -45.220 1.00 57.78 ? 5 GLN C NE2 1 ATOM 2936 N N . SER C 3 6 ? 0.291 -28.607 -43.976 1.00 69.49 ? 6 SER C N 1 ATOM 2937 C CA . SER C 3 6 ? 0.429 -27.432 -43.131 1.00 72.60 ? 6 SER C CA 1 ATOM 2938 C C . SER C 3 6 ? -0.111 -27.729 -41.730 1.00 70.12 ? 6 SER C C 1 ATOM 2939 O O . SER C 3 6 ? -1.116 -28.420 -41.591 1.00 67.92 ? 6 SER C O 1 ATOM 2940 C CB . SER C 3 6 ? -0.301 -26.231 -43.747 1.00 78.00 ? 6 SER C CB 1 ATOM 2941 N N . PRO C 3 7 ? 0.566 -27.223 -40.684 1.00 71.15 ? 7 PRO C N 1 ATOM 2942 C CA . PRO C 3 7 ? 1.830 -26.492 -40.757 1.00 74.38 ? 7 PRO C CA 1 ATOM 2943 C C . PRO C 3 7 ? 3.000 -27.471 -40.755 1.00 71.76 ? 7 PRO C C 1 ATOM 2944 O O . PRO C 3 7 ? 2.777 -28.687 -40.813 1.00 67.54 ? 7 PRO C O 1 ATOM 2945 C CB . PRO C 3 7 ? 1.825 -25.650 -39.475 1.00 76.94 ? 7 PRO C CB 1 ATOM 2946 C CG . PRO C 3 7 ? 0.522 -25.984 -38.755 1.00 74.89 ? 7 PRO C CG 1 ATOM 2947 C CD . PRO C 3 7 ? 0.061 -27.277 -39.306 1.00 70.24 ? 7 PRO C CD 1 ATOM 2948 N N . GLN C 3 8 ? 4.226 -26.953 -40.708 1.00 75.19 ? 8 GLN C N 1 ATOM 2949 C CA . GLN C 3 8 ? 5.414 -27.801 -40.618 1.00 74.28 ? 8 GLN C CA 1 ATOM 2950 C C . GLN C 3 8 ? 5.432 -28.480 -39.252 1.00 71.21 ? 8 GLN C C 1 ATOM 2951 O O . GLN C 3 8 ? 5.595 -29.703 -39.144 1.00 67.98 ? 8 GLN C O 1 ATOM 2952 C CB . GLN C 3 8 ? 6.689 -26.977 -40.807 1.00 80.30 ? 8 GLN C CB 1 ATOM 2953 C CG . GLN C 3 8 ? 7.810 -27.740 -41.495 1.00 81.45 ? 8 GLN C CG 1 ATOM 2954 C CD . GLN C 3 8 ? 7.862 -27.472 -42.989 1.00 84.60 ? 8 GLN C CD 1 ATOM 2955 O OE1 . GLN C 3 8 ? 7.290 -28.215 -43.792 1.00 80.70 ? 8 GLN C OE1 1 ATOM 2956 N NE2 . GLN C 3 8 ? 8.543 -26.394 -43.369 1.00 92.04 ? 8 GLN C NE2 1 ATOM 2957 N N . SER C 3 9 ? 5.241 -27.664 -38.219 1.00 72.88 ? 9 SER C N 1 ATOM 2958 C CA . SER C 3 9 ? 5.180 -28.129 -36.843 1.00 70.90 ? 9 SER C CA 1 ATOM 2959 C C . SER C 3 9 ? 4.119 -27.352 -36.064 1.00 71.64 ? 9 SER C C 1 ATOM 2960 O O . SER C 3 9 ? 4.176 -26.119 -35.977 1.00 76.03 ? 9 SER C O 1 ATOM 2961 C CB . SER C 3 9 ? 6.555 -27.994 -36.177 1.00 74.20 ? 9 SER C CB 1 ATOM 2962 O OG . SER C 3 9 ? 7.277 -26.889 -36.704 1.00 79.45 ? 9 SER C OG 1 ATOM 2963 N N . LEU C 3 10 ? 3.136 -28.077 -35.529 1.00 68.14 ? 10 LEU C N 1 ATOM 2964 C CA . LEU C 3 10 ? 2.127 -27.488 -34.642 1.00 69.31 ? 10 LEU C CA 1 ATOM 2965 C C . LEU C 3 10 ? 2.448 -27.845 -33.195 1.00 69.03 ? 10 LEU C C 1 ATOM 2966 O O . LEU C 3 10 ? 2.843 -28.977 -32.893 1.00 66.46 ? 10 LEU C O 1 ATOM 2967 C CB . LEU C 3 10 ? 0.712 -27.950 -35.011 1.00 67.31 ? 10 LEU C CB 1 ATOM 2968 N N . VAL C 3 11 ? 2.297 -26.865 -32.311 1.00 72.36 ? 11 VAL C N 1 ATOM 2969 C CA . VAL C 3 11 ? 2.608 -27.042 -30.899 1.00 73.05 ? 11 VAL C CA 1 ATOM 2970 C C . VAL C 3 11 ? 1.358 -26.730 -30.082 1.00 74.68 ? 11 VAL C C 1 ATOM 2971 O O . VAL C 3 11 ? 0.760 -25.662 -30.242 1.00 78.20 ? 11 VAL C O 1 ATOM 2972 C CB . VAL C 3 11 ? 3.785 -26.135 -30.453 1.00 77.32 ? 11 VAL C CB 1 ATOM 2973 C CG1 . VAL C 3 11 ? 4.400 -26.654 -29.170 1.00 77.67 ? 11 VAL C CG1 1 ATOM 2974 C CG2 . VAL C 3 11 ? 4.853 -26.045 -31.542 1.00 77.59 ? 11 VAL C CG2 1 ATOM 2975 N N . VAL C 3 12 ? 0.954 -27.665 -29.222 1.00 73.06 ? 12 VAL C N 1 ATOM 2976 C CA . VAL C 3 12 ? -0.269 -27.495 -28.418 1.00 75.37 ? 12 VAL C CA 1 ATOM 2977 C C . VAL C 3 12 ? -0.072 -27.748 -26.920 1.00 77.30 ? 12 VAL C C 1 ATOM 2978 O O . VAL C 3 12 ? 0.733 -28.589 -26.522 1.00 75.66 ? 12 VAL C O 1 ATOM 2979 C CB . VAL C 3 12 ? -1.453 -28.368 -28.940 1.00 73.23 ? 12 VAL C CB 1 ATOM 2980 C CG1 . VAL C 3 12 ? -2.006 -27.814 -30.253 1.00 73.34 ? 12 VAL C CG1 1 ATOM 2981 C CG2 . VAL C 3 12 ? -1.043 -29.829 -29.089 1.00 68.99 ? 12 VAL C CG2 1 ATOM 2982 N N . ARG C 3 13 ? -0.817 -27.012 -26.100 1.00 81.56 ? 13 ARG C N 1 ATOM 2983 C CA . ARG C 3 13 ? -0.837 -27.249 -24.662 1.00 84.24 ? 13 ARG C CA 1 ATOM 2984 C C . ARG C 3 13 ? -1.670 -28.497 -24.383 1.00 82.92 ? 13 ARG C C 1 ATOM 2985 O O . ARG C 3 13 ? -2.843 -28.551 -24.755 1.00 83.76 ? 13 ARG C O 1 ATOM 2986 C CB . ARG C 3 13 ? -1.414 -26.035 -23.922 1.00 90.25 ? 13 ARG C CB 1 ATOM 2987 N N . GLN C 3 14 ? -1.060 -29.493 -23.737 1.00 81.82 ? 14 GLN C N 1 ATOM 2988 C CA . GLN C 3 14 ? -1.718 -30.776 -23.448 1.00 81.56 ? 14 GLN C CA 1 ATOM 2989 C C . GLN C 3 14 ? -3.182 -30.625 -23.036 1.00 85.69 ? 14 GLN C C 1 ATOM 2990 O O . GLN C 3 14 ? -3.508 -29.827 -22.160 1.00 90.32 ? 14 GLN C O 1 ATOM 2991 C CB . GLN C 3 14 ? -0.966 -31.548 -22.359 1.00 82.91 ? 14 GLN C CB 1 ATOM 2992 C CG . GLN C 3 14 ? -1.408 -33.010 -22.238 1.00 83.03 ? 14 GLN C CG 1 ATOM 2993 C CD . GLN C 3 14 ? -1.590 -33.487 -20.799 1.00 88.32 ? 14 GLN C CD 1 ATOM 2994 O OE1 . GLN C 3 14 ? -1.563 -32.698 -19.850 1.00 92.00 ? 14 GLN C OE1 1 ATOM 2995 N NE2 . GLN C 3 14 ? -1.788 -34.792 -20.637 1.00 89.22 ? 14 GLN C NE2 1 ATOM 2996 N N . GLY C 3 15 ? -4.054 -31.395 -23.678 1.00 84.86 ? 15 GLY C N 1 ATOM 2997 C CA . GLY C 3 15 ? -5.478 -31.388 -23.364 1.00 89.79 ? 15 GLY C CA 1 ATOM 2998 C C . GLY C 3 15 ? -6.257 -30.289 -24.062 1.00 91.59 ? 15 GLY C C 1 ATOM 2999 O O . GLY C 3 15 ? -7.196 -29.728 -23.493 1.00 97.54 ? 15 GLY C O 1 ATOM 3000 N N . GLU C 3 16 ? -5.864 -29.976 -25.293 1.00 87.39 ? 16 GLU C N 1 ATOM 3001 C CA . GLU C 3 16 ? -6.584 -29.003 -26.111 1.00 89.45 ? 16 GLU C CA 1 ATOM 3002 C C . GLU C 3 16 ? -6.738 -29.526 -27.536 1.00 85.50 ? 16 GLU C C 1 ATOM 3003 O O . GLU C 3 16 ? -6.332 -30.651 -27.838 1.00 81.47 ? 16 GLU C O 1 ATOM 3004 C CB . GLU C 3 16 ? -5.884 -27.638 -26.092 1.00 90.49 ? 16 GLU C CB 1 ATOM 3005 C CG . GLU C 3 16 ? -6.080 -26.851 -24.792 1.00 96.60 ? 16 GLU C CG 1 ATOM 3006 C CD . GLU C 3 16 ? -5.270 -25.559 -24.725 0.70 98.48 ? 16 GLU C CD 1 ATOM 3007 O OE1 . GLU C 3 16 ? -4.500 -25.267 -25.668 0.70 95.04 ? 16 GLU C OE1 1 ATOM 3008 O OE2 . GLU C 3 16 ? -5.405 -24.829 -23.716 0.70 104.05 ? 16 GLU C OE2 1 ATOM 3009 N N . ASN C 3 17 ? -7.343 -28.712 -28.399 1.00 87.55 ? 17 ASN C N 1 ATOM 3010 C CA . ASN C 3 17 ? -7.569 -29.073 -29.797 1.00 84.72 ? 17 ASN C CA 1 ATOM 3011 C C . ASN C 3 17 ? -6.318 -28.890 -30.656 1.00 79.59 ? 17 ASN C C 1 ATOM 3012 O O . ASN C 3 17 ? -5.399 -28.150 -30.296 1.00 79.50 ? 17 ASN C O 1 ATOM 3013 C CB . ASN C 3 17 ? -8.733 -28.262 -30.381 1.00 89.93 ? 17 ASN C CB 1 ATOM 3014 C CG . ASN C 3 17 ? -10.063 -28.559 -29.697 1.00 96.18 ? 17 ASN C CG 1 ATOM 3015 O OD1 . ASN C 3 17 ? -10.117 -28.845 -28.499 1.00 98.43 ? 17 ASN C OD1 1 ATOM 3016 N ND2 . ASN C 3 17 ? -11.146 -28.478 -30.461 1.00 99.97 ? 17 ASN C ND2 1 ATOM 3017 N N . SER C 3 18 ? -6.292 -29.581 -31.791 1.00 76.19 ? 18 SER C N 1 ATOM 3018 C CA . SER C 3 18 ? -5.189 -29.493 -32.738 1.00 72.13 ? 18 SER C CA 1 ATOM 3019 C C . SER C 3 18 ? -5.685 -29.850 -34.139 1.00 70.95 ? 18 SER C C 1 ATOM 3020 O O . SER C 3 18 ? -6.179 -30.957 -34.367 1.00 69.79 ? 18 SER C O 1 ATOM 3021 C CB . SER C 3 18 ? -4.044 -30.421 -32.317 1.00 68.16 ? 18 SER C CB 1 ATOM 3022 O OG . SER C 3 18 ? -4.538 -31.696 -31.939 1.00 67.69 ? 18 SER C OG 1 ATOM 3023 N N . VAL C 3 19 ? -5.571 -28.894 -35.060 1.00 72.06 ? 19 VAL C N 1 ATOM 3024 C CA . VAL C 3 19 ? -5.968 -29.092 -36.449 1.00 71.51 ? 19 VAL C CA 1 ATOM 3025 C C . VAL C 3 19 ? -4.737 -29.182 -37.342 1.00 67.99 ? 19 VAL C C 1 ATOM 3026 O O . VAL C 3 19 ? -3.839 -28.341 -37.256 1.00 68.68 ? 19 VAL C O 1 ATOM 3027 C CB . VAL C 3 19 ? -6.872 -27.947 -36.951 1.00 76.94 ? 19 VAL C CB 1 ATOM 3028 N N . LEU C 3 20 ? -4.698 -30.212 -38.186 1.00 65.08 ? 20 LEU C N 1 ATOM 3029 C CA . LEU C 3 20 ? -3.642 -30.363 -39.194 1.00 62.55 ? 20 LEU C CA 1 ATOM 3030 C C . LEU C 3 20 ? -4.231 -30.372 -40.605 1.00 63.62 ? 20 LEU C C 1 ATOM 3031 O O . LEU C 3 20 ? -5.326 -30.896 -40.830 1.00 64.39 ? 20 LEU C O 1 ATOM 3032 C CB . LEU C 3 20 ? -2.824 -31.635 -38.955 1.00 58.80 ? 20 LEU C CB 1 ATOM 3033 C CG . LEU C 3 20 ? -2.332 -31.943 -37.537 1.00 57.86 ? 20 LEU C CG 1 ATOM 3034 C CD1 . LEU C 3 20 ? -1.514 -33.229 -37.531 1.00 54.78 ? 20 LEU C CD1 1 ATOM 3035 C CD2 . LEU C 3 20 ? -1.525 -30.786 -36.968 1.00 59.19 ? 20 LEU C CD2 1 ATOM 3036 N N . GLN C 3 21 ? -3.490 -29.788 -41.545 1.00 64.27 ? 21 GLN C N 1 ATOM 3037 C CA . GLN C 3 21 ? -3.972 -29.566 -42.911 1.00 66.26 ? 21 GLN C CA 1 ATOM 3038 C C . GLN C 3 21 ? -3.252 -30.432 -43.930 1.00 63.63 ? 21 GLN C C 1 ATOM 3039 O O . GLN C 3 21 ? -2.161 -30.954 -43.668 1.00 60.99 ? 21 GLN C O 1 ATOM 3040 C CB . GLN C 3 21 ? -3.824 -28.089 -43.309 1.00 71.00 ? 21 GLN C CB 1 ATOM 3041 C CG . GLN C 3 21 ? -4.471 -27.094 -42.343 1.00 74.85 ? 21 GLN C CG 1 ATOM 3042 C CD . GLN C 3 21 ? -5.972 -27.282 -42.220 1.00 77.17 ? 21 GLN C CD 1 ATOM 3043 O OE1 . GLN C 3 21 ? -6.658 -27.562 -43.203 1.00 78.64 ? 21 GLN C OE1 1 ATOM 3044 N NE2 . GLN C 3 21 ? -6.488 -27.128 -41.008 1.00 78.30 ? 21 GLN C NE2 1 ATOM 3045 N N . CYS C 3 22 ? -3.883 -30.571 -45.093 1.00 65.16 ? 22 CYS C N 1 ATOM 3046 C CA . CYS C 3 22 ? -3.333 -31.310 -46.220 1.00 63.80 ? 22 CYS C CA 1 ATOM 3047 C C . CYS C 3 22 ? -3.972 -30.823 -47.515 1.00 67.47 ? 22 CYS C C 1 ATOM 3048 O O . CYS C 3 22 ? -5.199 -30.785 -47.636 1.00 69.71 ? 22 CYS C O 1 ATOM 3049 C CB . CYS C 3 22 ? -3.566 -32.811 -46.043 1.00 60.79 ? 22 CYS C CB 1 ATOM 3050 S SG . CYS C 3 22 ? -2.972 -33.826 -47.406 1.00 60.29 ? 22 CYS C SG 1 ATOM 3051 N N . ASN C 3 23 ? -3.134 -30.430 -48.467 1.00 68.99 ? 23 ASN C N 1 ATOM 3052 C CA . ASN C 3 23 ? -3.597 -30.032 -49.792 1.00 73.12 ? 23 ASN C CA 1 ATOM 3053 C C . ASN C 3 23 ? -2.887 -30.821 -50.873 1.00 72.30 ? 23 ASN C C 1 ATOM 3054 O O . ASN C 3 23 ? -1.658 -30.901 -50.887 1.00 71.47 ? 23 ASN C O 1 ATOM 3055 C CB . ASN C 3 23 ? -3.399 -28.534 -50.027 1.00 78.48 ? 23 ASN C CB 1 ATOM 3056 C CG . ASN C 3 23 ? -4.632 -27.724 -49.690 1.00 82.40 ? 23 ASN C CG 1 ATOM 3057 O OD1 . ASN C 3 23 ? -4.833 -27.322 -48.543 1.00 81.65 ? 23 ASN C OD1 1 ATOM 3058 N ND2 . ASN C 3 23 ? -5.466 -27.473 -50.698 1.00 86.83 ? 23 ASN C ND2 1 ATOM 3059 N N . TYR C 3 24 ? -3.666 -31.406 -51.775 1.00 73.32 ? 24 TYR C N 1 ATOM 3060 C CA . TYR C 3 24 ? -3.103 -32.220 -52.841 1.00 73.18 ? 24 TYR C CA 1 ATOM 3061 C C . TYR C 3 24 ? -3.548 -31.734 -54.220 1.00 78.54 ? 24 TYR C C 1 ATOM 3062 O O . TYR C 3 24 ? -4.631 -31.159 -54.370 1.00 81.78 ? 24 TYR C O 1 ATOM 3063 C CB . TYR C 3 24 ? -3.441 -33.705 -52.629 1.00 69.63 ? 24 TYR C CB 1 ATOM 3064 C CG . TYR C 3 24 ? -4.920 -34.027 -52.595 1.00 70.40 ? 24 TYR C CG 1 ATOM 3065 C CD1 . TYR C 3 24 ? -5.604 -34.364 -53.763 1.00 73.58 ? 24 TYR C CD1 1 ATOM 3066 C CD2 . TYR C 3 24 ? -5.633 -34.008 -51.398 1.00 68.59 ? 24 TYR C CD2 1 ATOM 3067 C CE1 . TYR C 3 24 ? -6.961 -34.660 -53.744 1.00 75.40 ? 24 TYR C CE1 1 ATOM 3068 C CE2 . TYR C 3 24 ? -6.992 -34.307 -51.369 1.00 70.87 ? 24 TYR C CE2 1 ATOM 3069 C CZ . TYR C 3 24 ? -7.649 -34.632 -52.548 1.00 74.31 ? 24 TYR C CZ 1 ATOM 3070 O OH . TYR C 3 24 ? -8.993 -34.925 -52.539 1.00 77.53 ? 24 TYR C OH 1 ATOM 3071 N N . SER C 3 25 ? -2.688 -31.950 -55.213 1.00 80.23 ? 25 SER C N 1 ATOM 3072 C CA . SER C 3 25 ? -3.018 -31.677 -56.606 1.00 85.61 ? 25 SER C CA 1 ATOM 3073 C C . SER C 3 25 ? -2.810 -32.955 -57.420 1.00 84.79 ? 25 SER C C 1 ATOM 3074 O O . SER C 3 25 ? -1.989 -33.010 -58.340 1.00 87.59 ? 25 SER C O 1 ATOM 3075 C CB . SER C 3 25 ? -2.198 -30.499 -57.152 1.00 90.74 ? 25 SER C CB 1 ATOM 3076 O OG . SER C 3 25 ? -0.804 -30.718 -57.018 1.00 89.75 ? 25 SER C OG 1 ATOM 3077 N N . VAL C 3 26 ? -3.572 -33.981 -57.058 1.00 81.87 ? 26 VAL C N 1 ATOM 3078 C CA . VAL C 3 26 ? -3.431 -35.311 -57.634 1.00 81.27 ? 26 VAL C CA 1 ATOM 3079 C C . VAL C 3 26 ? -4.745 -35.732 -58.300 1.00 84.25 ? 26 VAL C C 1 ATOM 3080 O O . VAL C 3 26 ? -5.820 -35.570 -57.721 1.00 84.24 ? 26 VAL C O 1 ATOM 3081 C CB . VAL C 3 26 ? -2.982 -36.336 -56.547 1.00 76.12 ? 26 VAL C CB 1 ATOM 3082 C CG1 . VAL C 3 26 ? -3.248 -37.761 -56.975 1.00 76.45 ? 26 VAL C CG1 1 ATOM 3083 C CG2 . VAL C 3 26 ? -1.508 -36.160 -56.216 1.00 74.70 ? 26 VAL C CG2 1 ATOM 3084 N N . THR C 3 27 ? -4.645 -36.251 -59.524 1.00 87.74 ? 27 THR C N 1 ATOM 3085 C CA . THR C 3 27 ? -5.802 -36.760 -60.267 1.00 91.46 ? 27 THR C CA 1 ATOM 3086 C C . THR C 3 27 ? -5.466 -38.108 -60.918 1.00 92.08 ? 27 THR C C 1 ATOM 3087 O O . THR C 3 27 ? -4.382 -38.267 -61.483 1.00 92.80 ? 27 THR C O 1 ATOM 3088 C CB . THR C 3 27 ? -6.264 -35.766 -61.360 1.00 97.61 ? 27 THR C CB 1 ATOM 3089 O OG1 . THR C 3 27 ? -6.071 -34.420 -60.906 1.00 98.52 ? 27 THR C OG1 1 ATOM 3090 C CG2 . THR C 3 27 ? -7.740 -35.976 -61.708 1.00 101.45 ? 27 THR C CG2 1 ATOM 3091 N N . PRO C 3 28 ? -6.377 -39.096 -60.815 1.00 92.74 ? 28 PRO C N 1 ATOM 3092 C CA . PRO C 3 28 ? -7.611 -39.045 -60.032 1.00 92.72 ? 28 PRO C CA 1 ATOM 3093 C C . PRO C 3 28 ? -7.339 -39.354 -58.563 1.00 87.63 ? 28 PRO C C 1 ATOM 3094 O O . PRO C 3 28 ? -6.335 -39.991 -58.243 1.00 84.69 ? 28 PRO C O 1 ATOM 3095 C CB . PRO C 3 28 ? -8.474 -40.132 -60.667 1.00 96.72 ? 28 PRO C CB 1 ATOM 3096 C CG . PRO C 3 28 ? -7.511 -41.104 -61.233 1.00 96.41 ? 28 PRO C CG 1 ATOM 3097 C CD . PRO C 3 28 ? -6.233 -40.376 -61.534 1.00 94.81 ? 28 PRO C CD 1 ATOM 3098 N N . ASP C 3 29 ? -8.223 -38.890 -57.686 1.00 87.42 ? 29 ASP C N 1 ATOM 3099 C CA . ASP C 3 29 ? -8.036 -39.028 -56.240 1.00 83.07 ? 29 ASP C CA 1 ATOM 3100 C C . ASP C 3 29 ? -9.090 -39.950 -55.632 1.00 84.54 ? 29 ASP C C 1 ATOM 3101 O O . ASP C 3 29 ? -10.195 -39.515 -55.302 1.00 87.42 ? 29 ASP C O 1 ATOM 3102 C CB . ASP C 3 29 ? -8.041 -37.648 -55.554 1.00 81.89 ? 29 ASP C CB 1 ATOM 3103 C CG . ASP C 3 29 ? -9.230 -36.769 -55.974 1.00 87.08 ? 29 ASP C CG 1 ATOM 3104 O OD1 . ASP C 3 29 ? -9.817 -37.000 -57.054 1.00 91.57 ? 29 ASP C OD1 1 ATOM 3105 O OD2 . ASP C 3 29 ? -9.575 -35.833 -55.219 1.00 87.57 ? 29 ASP C OD2 1 ATOM 3106 N N . ASN C 3 30 ? -8.746 -41.226 -55.495 1.00 83.61 ? 30 ASN C N 1 ATOM 3107 C CA . ASN C 3 30 ? -9.672 -42.201 -54.934 1.00 86.07 ? 30 ASN C CA 1 ATOM 3108 C C . ASN C 3 30 ? -9.938 -41.976 -53.445 1.00 83.82 ? 30 ASN C C 1 ATOM 3109 O O . ASN C 3 30 ? -11.088 -41.818 -53.038 1.00 87.24 ? 30 ASN C O 1 ATOM 3110 C CB . ASN C 3 30 ? -9.179 -43.630 -55.178 1.00 86.99 ? 30 ASN C CB 1 ATOM 3111 C CG . ASN C 3 30 ? -10.182 -44.676 -54.725 1.00 91.43 ? 30 ASN C CG 1 ATOM 3112 O OD1 . ASN C 3 30 ? -10.096 -45.194 -53.609 1.00 90.11 ? 30 ASN C OD1 1 ATOM 3113 N ND2 . ASN C 3 30 ? -11.151 -44.978 -55.584 1.00 97.43 ? 30 ASN C ND2 1 ATOM 3114 N N . HIS C 3 31 ? -8.876 -41.954 -52.644 1.00 78.80 ? 31 HIS C N 1 ATOM 3115 C CA . HIS C 3 31 ? -9.013 -41.858 -51.196 1.00 76.96 ? 31 HIS C CA 1 ATOM 3116 C C . HIS C 3 31 ? -7.851 -41.125 -50.535 1.00 71.75 ? 31 HIS C C 1 ATOM 3117 O O . HIS C 3 31 ? -6.904 -40.711 -51.205 1.00 69.88 ? 31 HIS C O 1 ATOM 3118 C CB . HIS C 3 31 ? -9.153 -43.251 -50.584 1.00 78.86 ? 31 HIS C CB 1 ATOM 3119 C CG . HIS C 3 31 ? -7.982 -44.144 -50.846 1.00 77.75 ? 31 HIS C CG 1 ATOM 3120 N ND1 . HIS C 3 31 ? -7.988 -45.110 -51.830 1.00 81.67 ? 31 HIS C ND1 1 ATOM 3121 C CD2 . HIS C 3 31 ? -6.765 -44.214 -50.257 1.00 74.33 ? 31 HIS C CD2 1 ATOM 3122 C CE1 . HIS C 3 31 ? -6.826 -45.739 -51.832 1.00 80.50 ? 31 HIS C CE1 1 ATOM 3123 N NE2 . HIS C 3 31 ? -6.066 -45.214 -50.888 1.00 76.45 ? 31 HIS C NE2 1 ATOM 3124 N N . LEU C 3 32 ? -7.939 -40.977 -49.212 1.00 70.20 ? 32 LEU C N 1 ATOM 3125 C CA . LEU C 3 32 ? -6.910 -40.315 -48.419 1.00 65.87 ? 32 LEU C CA 1 ATOM 3126 C C . LEU C 3 32 ? -6.778 -40.935 -47.030 1.00 64.82 ? 32 LEU C C 1 ATOM 3127 O O . LEU C 3 32 ? -7.716 -40.916 -46.232 1.00 66.65 ? 32 LEU C O 1 ATOM 3128 C CB . LEU C 3 32 ? -7.194 -38.818 -48.315 1.00 65.74 ? 32 LEU C CB 1 ATOM 3129 C CG . LEU C 3 32 ? -6.046 -37.922 -47.852 1.00 62.72 ? 32 LEU C CG 1 ATOM 3130 C CD1 . LEU C 3 32 ? -6.191 -36.546 -48.469 1.00 64.97 ? 32 LEU C CD1 1 ATOM 3131 C CD2 . LEU C 3 32 ? -5.984 -37.825 -46.331 1.00 61.41 ? 32 LEU C CD2 1 ATOM 3132 N N . ARG C 3 33 ? -5.595 -41.479 -46.763 1.00 62.65 ? 33 ARG C N 1 ATOM 3133 C CA . ARG C 3 33 ? -5.258 -42.080 -45.479 1.00 62.15 ? 33 ARG C CA 1 ATOM 3134 C C . ARG C 3 33 ? -4.437 -41.075 -44.680 1.00 58.84 ? 33 ARG C C 1 ATOM 3135 O O . ARG C 3 33 ? -3.595 -40.370 -45.242 1.00 57.01 ? 33 ARG C O 1 ATOM 3136 C CB . ARG C 3 33 ? -4.412 -43.336 -45.692 1.00 63.03 ? 33 ARG C CB 1 ATOM 3137 C CG . ARG C 3 33 ? -4.862 -44.560 -44.919 1.00 66.38 ? 33 ARG C CG 1 ATOM 3138 C CD . ARG C 3 33 ? -5.360 -45.636 -45.873 1.00 70.46 ? 33 ARG C CD 1 ATOM 3139 N NE . ARG C 3 33 ? -5.857 -46.814 -45.163 1.00 75.58 ? 33 ARG C NE 1 ATOM 3140 C CZ . ARG C 3 33 ? -6.332 -47.914 -45.748 1.00 80.68 ? 33 ARG C CZ 1 ATOM 3141 N NH1 . ARG C 3 33 ? -6.381 -48.013 -47.071 1.00 81.09 ? 33 ARG C NH1 1 ATOM 3142 N NH2 . ARG C 3 33 ? -6.761 -48.925 -45.002 1.00 85.70 ? 33 ARG C NH2 1 ATOM 3143 N N . TRP C 3 34 ? -4.690 -41.011 -43.376 1.00 58.85 ? 34 TRP C N 1 ATOM 3144 C CA . TRP C 3 34 ? -3.822 -40.290 -42.454 1.00 56.44 ? 34 TRP C CA 1 ATOM 3145 C C . TRP C 3 34 ? -3.012 -41.313 -41.668 1.00 56.92 ? 34 TRP C C 1 ATOM 3146 O O . TRP C 3 34 ? -3.573 -42.281 -41.140 1.00 59.53 ? 34 TRP C O 1 ATOM 3147 C CB . TRP C 3 34 ? -4.635 -39.429 -41.492 1.00 56.99 ? 34 TRP C CB 1 ATOM 3148 C CG . TRP C 3 34 ? -5.029 -38.079 -42.018 1.00 56.66 ? 34 TRP C CG 1 ATOM 3149 C CD1 . TRP C 3 34 ? -6.215 -37.744 -42.600 1.00 59.07 ? 34 TRP C CD1 1 ATOM 3150 C CD2 . TRP C 3 34 ? -4.247 -36.880 -41.983 1.00 54.86 ? 34 TRP C CD2 1 ATOM 3151 N NE1 . TRP C 3 34 ? -6.222 -36.414 -42.940 1.00 58.99 ? 34 TRP C NE1 1 ATOM 3152 C CE2 . TRP C 3 34 ? -5.026 -35.857 -42.573 1.00 56.82 ? 34 TRP C CE2 1 ATOM 3153 C CE3 . TRP C 3 34 ? -2.964 -36.568 -41.517 1.00 53.06 ? 34 TRP C CE3 1 ATOM 3154 C CZ2 . TRP C 3 34 ? -4.563 -34.539 -42.712 1.00 56.87 ? 34 TRP C CZ2 1 ATOM 3155 C CZ3 . TRP C 3 34 ? -2.502 -35.254 -41.653 1.00 53.25 ? 34 TRP C CZ3 1 ATOM 3156 C CH2 . TRP C 3 34 ? -3.303 -34.259 -42.247 1.00 55.09 ? 34 TRP C CH2 1 ATOM 3157 N N . PHE C 3 35 ? -1.697 -41.109 -41.598 1.00 55.37 ? 35 PHE C N 1 ATOM 3158 C CA . PHE C 3 35 ? -0.838 -42.015 -40.838 1.00 56.68 ? 35 PHE C CA 1 ATOM 3159 C C . PHE C 3 35 ? -0.256 -41.367 -39.580 1.00 55.85 ? 35 PHE C C 1 ATOM 3160 O O . PHE C 3 35 ? -0.228 -40.138 -39.461 1.00 54.02 ? 35 PHE C O 1 ATOM 3161 C CB . PHE C 3 35 ? 0.263 -42.602 -41.724 1.00 57.40 ? 35 PHE C CB 1 ATOM 3162 C CG . PHE C 3 35 ? -0.193 -43.759 -42.570 1.00 60.35 ? 35 PHE C CG 1 ATOM 3163 C CD1 . PHE C 3 35 ? -0.304 -45.037 -42.026 1.00 64.15 ? 35 PHE C CD1 1 ATOM 3164 C CD2 . PHE C 3 35 ? -0.518 -43.574 -43.913 1.00 60.21 ? 35 PHE C CD2 1 ATOM 3165 C CE1 . PHE C 3 35 ? -0.731 -46.114 -42.806 1.00 67.23 ? 35 PHE C CE1 1 ATOM 3166 C CE2 . PHE C 3 35 ? -0.945 -44.641 -44.700 1.00 62.79 ? 35 PHE C CE2 1 ATOM 3167 C CZ . PHE C 3 35 ? -1.051 -45.914 -44.144 1.00 66.49 ? 35 PHE C CZ 1 ATOM 3168 N N . LYS C 3 36 ? 0.184 -42.203 -38.640 1.00 57.91 ? 36 LYS C N 1 ATOM 3169 C CA . LYS C 3 36 ? 0.799 -41.729 -37.398 1.00 58.08 ? 36 LYS C CA 1 ATOM 3170 C C . LYS C 3 36 ? 2.156 -42.377 -37.176 1.00 60.08 ? 36 LYS C C 1 ATOM 3171 O O . LYS C 3 36 ? 2.253 -43.597 -36.990 1.00 63.35 ? 36 LYS C O 1 ATOM 3172 C CB . LYS C 3 36 ? -0.107 -42.006 -36.195 1.00 59.98 ? 36 LYS C CB 1 ATOM 3173 N N . GLN C 3 37 ? 3.204 -41.562 -37.184 1.00 59.18 ? 37 GLN C N 1 ATOM 3174 C CA . GLN C 3 37 ? 4.546 -42.095 -37.042 1.00 62.12 ? 37 GLN C CA 1 ATOM 3175 C C . GLN C 3 37 ? 5.183 -41.739 -35.702 1.00 63.66 ? 37 GLN C C 1 ATOM 3176 O O . GLN C 3 37 ? 5.563 -40.587 -35.459 1.00 62.38 ? 37 GLN C O 1 ATOM 3177 C CB . GLN C 3 37 ? 5.432 -41.654 -38.208 1.00 62.05 ? 37 GLN C CB 1 ATOM 3178 C CG . GLN C 3 37 ? 6.584 -42.607 -38.493 1.00 66.14 ? 37 GLN C CG 1 ATOM 3179 C CD . GLN C 3 37 ? 7.538 -42.090 -39.547 1.00 67.00 ? 37 GLN C CD 1 ATOM 3180 O OE1 . GLN C 3 37 ? 7.330 -41.025 -40.127 1.00 64.80 ? 37 GLN C OE1 1 ATOM 3181 N NE2 . GLN C 3 37 ? 8.596 -42.845 -39.799 1.00 71.32 ? 37 GLN C NE2 1 ATOM 3182 N N . ASP C 3 38 ? 5.281 -42.744 -34.835 1.00 67.16 ? 38 ASP C N 1 ATOM 3183 C CA . ASP C 3 38 ? 6.028 -42.627 -33.593 1.00 70.03 ? 38 ASP C CA 1 ATOM 3184 C C . ASP C 3 38 ? 7.509 -42.488 -33.937 1.00 72.70 ? 38 ASP C C 1 ATOM 3185 O O . ASP C 3 38 ? 8.038 -43.269 -34.737 1.00 75.11 ? 38 ASP C O 1 ATOM 3186 C CB . ASP C 3 38 ? 5.795 -43.858 -32.716 1.00 74.30 ? 38 ASP C CB 1 ATOM 3187 N N . THR C 3 39 ? 8.164 -41.487 -33.349 1.00 73.05 ? 39 THR C N 1 ATOM 3188 C CA . THR C 3 39 ? 9.567 -41.184 -33.657 1.00 76.47 ? 39 THR C CA 1 ATOM 3189 C C . THR C 3 39 ? 10.454 -42.431 -33.599 1.00 82.28 ? 39 THR C C 1 ATOM 3190 O O . THR C 3 39 ? 10.643 -43.031 -32.538 1.00 85.84 ? 39 THR C O 1 ATOM 3191 C CB . THR C 3 39 ? 10.142 -40.064 -32.749 1.00 77.60 ? 39 THR C CB 1 ATOM 3192 O OG1 . THR C 3 39 ? 9.763 -40.298 -31.387 1.00 78.71 ? 39 THR C OG1 1 ATOM 3193 C CG2 . THR C 3 39 ? 9.623 -38.694 -33.184 1.00 73.81 ? 39 THR C CG2 1 ATOM 3194 N N . GLY C 3 40 ? 10.969 -42.819 -34.764 1.00 83.91 ? 40 GLY C N 1 ATOM 3195 C CA . GLY C 3 40 ? 11.800 -44.016 -34.909 1.00 90.23 ? 40 GLY C CA 1 ATOM 3196 C C . GLY C 3 40 ? 11.012 -45.306 -35.065 1.00 90.80 ? 40 GLY C C 1 ATOM 3197 O O . GLY C 3 40 ? 11.446 -46.357 -34.592 1.00 96.89 ? 40 GLY C O 1 ATOM 3198 N N . LYS C 3 41 ? 9.860 -45.229 -35.734 1.00 85.40 ? 41 LYS C N 1 ATOM 3199 C CA . LYS C 3 41 ? 8.972 -46.384 -35.907 1.00 86.08 ? 41 LYS C CA 1 ATOM 3200 C C . LYS C 3 41 ? 8.148 -46.318 -37.201 1.00 81.96 ? 41 LYS C C 1 ATOM 3201 O O . LYS C 3 41 ? 8.217 -45.336 -37.940 1.00 78.15 ? 41 LYS C O 1 ATOM 3202 C CB . LYS C 3 41 ? 8.047 -46.533 -34.692 1.00 85.38 ? 41 LYS C CB 1 ATOM 3203 N N . GLY C 3 42 ? 7.371 -47.369 -37.459 1.00 83.46 ? 42 GLY C N 1 ATOM 3204 C CA . GLY C 3 42 ? 6.555 -47.474 -38.669 1.00 80.81 ? 42 GLY C CA 1 ATOM 3205 C C . GLY C 3 42 ? 5.374 -46.525 -38.689 1.00 74.64 ? 42 GLY C C 1 ATOM 3206 O O . GLY C 3 42 ? 5.245 -45.668 -37.818 1.00 72.16 ? 42 GLY C O 1 ATOM 3207 N N . LEU C 3 43 ? 4.509 -46.676 -39.687 1.00 73.01 ? 43 LEU C N 1 ATOM 3208 C CA . LEU C 3 43 ? 3.336 -45.816 -39.830 1.00 68.35 ? 43 LEU C CA 1 ATOM 3209 C C . LEU C 3 43 ? 2.070 -46.551 -39.412 1.00 70.10 ? 43 LEU C C 1 ATOM 3210 O O . LEU C 3 43 ? 1.890 -47.722 -39.749 1.00 74.27 ? 43 LEU C O 1 ATOM 3211 C CB . LEU C 3 43 ? 3.191 -45.316 -41.270 1.00 66.03 ? 43 LEU C CB 1 ATOM 3212 C CG . LEU C 3 43 ? 4.210 -44.337 -41.858 1.00 64.35 ? 43 LEU C CG 1 ATOM 3213 C CD1 . LEU C 3 43 ? 5.496 -45.038 -42.280 1.00 68.41 ? 43 LEU C CD1 1 ATOM 3214 C CD2 . LEU C 3 43 ? 3.592 -43.624 -43.043 1.00 61.60 ? 43 LEU C CD2 1 ATOM 3215 N N . VAL C 3 44 ? 1.201 -45.856 -38.682 1.00 67.88 ? 44 VAL C N 1 ATOM 3216 C CA . VAL C 3 44 ? -0.060 -46.429 -38.212 1.00 70.39 ? 44 VAL C CA 1 ATOM 3217 C C . VAL C 3 44 ? -1.267 -45.688 -38.796 1.00 67.90 ? 44 VAL C C 1 ATOM 3218 O O . VAL C 3 44 ? -1.390 -44.467 -38.659 1.00 64.28 ? 44 VAL C O 1 ATOM 3219 C CB . VAL C 3 44 ? -0.133 -46.450 -36.672 1.00 72.16 ? 44 VAL C CB 1 ATOM 3220 N N . SER C 3 45 ? -2.147 -46.440 -39.453 1.00 70.74 ? 45 SER C N 1 ATOM 3221 C CA . SER C 3 45 ? -3.308 -45.875 -40.136 1.00 69.82 ? 45 SER C CA 1 ATOM 3222 C C . SER C 3 45 ? -4.391 -45.424 -39.160 1.00 70.98 ? 45 SER C C 1 ATOM 3223 O O . SER C 3 45 ? -5.021 -46.244 -38.492 1.00 75.65 ? 45 SER C O 1 ATOM 3224 C CB . SER C 3 45 ? -3.883 -46.879 -41.140 1.00 73.63 ? 45 SER C CB 1 ATOM 3225 O OG . SER C 3 45 ? -5.047 -46.370 -41.773 1.00 73.88 ? 45 SER C OG 1 ATOM 3226 N N . LEU C 3 46 ? -4.598 -44.111 -39.095 1.00 67.61 ? 46 LEU C N 1 ATOM 3227 C CA . LEU C 3 46 ? -5.613 -43.520 -38.226 1.00 69.07 ? 46 LEU C CA 1 ATOM 3228 C C . LEU C 3 46 ? -7.004 -43.648 -38.829 1.00 72.55 ? 46 LEU C C 1 ATOM 3229 O O . LEU C 3 46 ? -7.895 -44.228 -38.209 1.00 77.65 ? 46 LEU C O 1 ATOM 3230 C CB . LEU C 3 46 ? -5.298 -42.051 -37.932 1.00 65.20 ? 46 LEU C CB 1 ATOM 3231 C CG . LEU C 3 46 ? -3.922 -41.701 -37.359 1.00 62.00 ? 46 LEU C CG 1 ATOM 3232 C CD1 . LEU C 3 46 ? -3.870 -40.220 -37.041 1.00 59.14 ? 46 LEU C CD1 1 ATOM 3233 C CD2 . LEU C 3 46 ? -3.614 -42.528 -36.118 1.00 64.62 ? 46 LEU C CD2 1 ATOM 3234 N N . THR C 3 47 ? -7.185 -43.109 -40.034 1.00 70.75 ? 47 THR C N 1 ATOM 3235 C CA . THR C 3 47 ? -8.476 -43.181 -40.736 1.00 74.68 ? 47 THR C CA 1 ATOM 3236 C C . THR C 3 47 ? -8.351 -43.037 -42.265 1.00 73.01 ? 47 THR C C 1 ATOM 3237 O O . THR C 3 47 ? -7.304 -42.629 -42.771 1.00 68.77 ? 47 THR C O 1 ATOM 3238 C CB . THR C 3 47 ? -9.524 -42.178 -40.139 1.00 76.97 ? 47 THR C CB 1 ATOM 3239 O OG1 . THR C 3 47 ? -10.790 -42.340 -40.799 1.00 81.91 ? 47 THR C OG1 1 ATOM 3240 C CG2 . THR C 3 47 ? -9.041 -40.719 -40.241 1.00 72.57 ? 47 THR C CG2 1 ATOM 3241 N N . VAL C 3 48 ? -9.417 -43.394 -42.985 1.00 77.21 ? 48 VAL C N 1 ATOM 3242 C CA . VAL C 3 48 ? -9.464 -43.302 -44.452 1.00 76.79 ? 48 VAL C CA 1 ATOM 3243 C C . VAL C 3 48 ? -10.721 -42.560 -44.898 1.00 80.27 ? 48 VAL C C 1 ATOM 3244 O O . VAL C 3 48 ? -11.771 -42.680 -44.264 1.00 85.21 ? 48 VAL C O 1 ATOM 3245 C CB . VAL C 3 48 ? -9.484 -44.695 -45.130 1.00 80.09 ? 48 VAL C CB 1 ATOM 3246 C CG1 . VAL C 3 48 ? -8.804 -44.628 -46.492 1.00 77.64 ? 48 VAL C CG1 1 ATOM 3247 C CG2 . VAL C 3 48 ? -8.831 -45.757 -44.253 1.00 80.70 ? 48 VAL C CG2 1 ATOM 3248 N N . LEU C 3 49 ? -10.617 -41.801 -45.990 1.00 78.77 ? 49 LEU C N 1 ATOM 3249 C CA . LEU C 3 49 ? -11.764 -41.058 -46.533 1.00 82.84 ? 49 LEU C CA 1 ATOM 3250 C C . LEU C 3 49 ? -11.905 -41.241 -48.046 1.00 84.47 ? 49 LEU C C 1 ATOM 3251 O O . LEU C 3 49 ? -11.050 -40.795 -48.811 1.00 80.94 ? 49 LEU C O 1 ATOM 3252 C CB . LEU C 3 49 ? -11.670 -39.565 -46.190 1.00 80.86 ? 49 LEU C CB 1 ATOM 3253 C CG . LEU C 3 49 ? -11.410 -39.128 -44.747 1.00 78.99 ? 49 LEU C CG 1 ATOM 3254 C CD1 . LEU C 3 49 ? -9.935 -38.804 -44.534 1.00 72.24 ? 49 LEU C CD1 1 ATOM 3255 C CD2 . LEU C 3 49 ? -12.274 -37.925 -44.404 1.00 82.54 ? 49 LEU C CD2 1 ATOM 3256 N N . VAL C 3 50 ? -12.997 -41.878 -48.469 1.00 90.61 ? 50 VAL C N 1 ATOM 3257 C CA . VAL C 3 50 ? -13.195 -42.234 -49.880 1.00 93.15 ? 50 VAL C CA 1 ATOM 3258 C C . VAL C 3 50 ? -14.176 -41.303 -50.621 1.00 97.66 ? 50 VAL C C 1 ATOM 3259 O O . VAL C 3 50 ? -13.956 -40.973 -51.790 1.00 97.54 ? 50 VAL C O 1 ATOM 3260 C CB . VAL C 3 50 ? -13.631 -43.724 -50.047 1.00 98.05 ? 50 VAL C CB 1 ATOM 3261 C CG1 . VAL C 3 50 ? -13.562 -44.159 -51.514 1.00 99.98 ? 50 VAL C CG1 1 ATOM 3262 C CG2 . VAL C 3 50 ? -12.767 -44.647 -49.191 1.00 95.01 ? 50 VAL C CG2 1 ATOM 3263 N N . ASP C 3 51 ? -15.240 -40.878 -49.938 1.00 102.38 ? 51 ASP C N 1 ATOM 3264 C CA . ASP C 3 51 ? -16.317 -40.095 -50.564 1.00 108.71 ? 51 ASP C CA 1 ATOM 3265 C C . ASP C 3 51 ? -15.896 -38.710 -51.065 1.00 106.25 ? 51 ASP C C 1 ATOM 3266 O O . ASP C 3 51 ? -14.856 -38.179 -50.667 1.00 99.72 ? 51 ASP C O 1 ATOM 3267 C CB . ASP C 3 51 ? -17.518 -39.972 -49.618 1.00 115.35 ? 51 ASP C CB 1 ATOM 3268 C CG . ASP C 3 51 ? -18.314 -41.259 -49.518 1.00 121.69 ? 51 ASP C CG 1 ATOM 3269 N N . GLN C 3 52 ? -16.725 -38.145 -51.945 1.00 112.49 ? 52 GLN C N 1 ATOM 3270 C CA . GLN C 3 52 ? -16.516 -36.815 -52.524 1.00 112.72 ? 52 GLN C CA 1 ATOM 3271 C C . GLN C 3 52 ? -16.366 -35.746 -51.437 1.00 111.19 ? 52 GLN C C 1 ATOM 3272 O O . GLN C 3 52 ? -15.454 -34.917 -51.486 1.00 106.89 ? 52 GLN C O 1 ATOM 3273 C CB . GLN C 3 52 ? -17.678 -36.469 -53.468 1.00 121.82 ? 52 GLN C CB 1 ATOM 3274 C CG . GLN C 3 52 ? -17.385 -35.366 -54.489 1.00 122.97 ? 52 GLN C CG 1 ATOM 3275 C CD . GLN C 3 52 ? -16.456 -35.812 -55.613 1.00 119.00 ? 52 GLN C CD 1 ATOM 3276 O OE1 . GLN C 3 52 ? -16.274 -37.007 -55.857 1.00 117.13 ? 52 GLN C OE1 1 ATOM 3277 N NE2 . GLN C 3 52 ? -15.867 -34.844 -56.307 1.00 118.45 ? 52 GLN C NE2 1 ATOM 3278 N N . LYS C 3 53 ? -17.274 -35.777 -50.465 1.00 115.65 ? 53 LYS C N 1 ATOM 3279 C CA . LYS C 3 53 ? -17.184 -34.946 -49.269 1.00 114.77 ? 53 LYS C CA 1 ATOM 3280 C C . LYS C 3 53 ? -17.392 -35.854 -48.058 1.00 114.28 ? 53 LYS C C 1 ATOM 3281 O O . LYS C 3 53 ? -18.519 -36.271 -47.771 1.00 121.48 ? 53 LYS C O 1 ATOM 3282 C CB . LYS C 3 53 ? -18.221 -33.817 -49.303 1.00 123.29 ? 53 LYS C CB 1 ATOM 3283 C CG . LYS C 3 53 ? -17.939 -32.729 -50.335 1.00 124.55 ? 53 LYS C CG 1 ATOM 3284 N N . ASP C 3 54 ? -16.302 -36.164 -47.358 1.00 106.74 ? 54 ASP C N 1 ATOM 3285 C CA . ASP C 3 54 ? -16.325 -37.203 -46.326 1.00 106.08 ? 54 ASP C CA 1 ATOM 3286 C C . ASP C 3 54 ? -16.001 -36.694 -44.920 1.00 103.86 ? 54 ASP C C 1 ATOM 3287 O O . ASP C 3 54 ? -15.288 -35.703 -44.753 1.00 99.90 ? 54 ASP C O 1 ATOM 3288 C CB . ASP C 3 54 ? -15.385 -38.359 -46.711 1.00 100.61 ? 54 ASP C CB 1 ATOM 3289 C CG . ASP C 3 54 ? -15.944 -39.738 -46.334 1.00 104.62 ? 54 ASP C CG 1 ATOM 3290 O OD1 . ASP C 3 54 ? -17.096 -39.825 -45.850 1.00 112.04 ? 54 ASP C OD1 1 ATOM 3291 O OD2 . ASP C 3 54 ? -15.227 -40.745 -46.531 1.00 101.14 ? 54 ASP C OD2 1 ATOM 3292 N N . LYS C 3 55 ? -16.554 -37.385 -43.923 1.00 107.41 ? 55 LYS C N 1 ATOM 3293 C CA . LYS C 3 55 ? -16.325 -37.106 -42.504 1.00 106.46 ? 55 LYS C CA 1 ATOM 3294 C C . LYS C 3 55 ? -16.223 -38.430 -41.754 1.00 106.63 ? 55 LYS C C 1 ATOM 3295 O O . LYS C 3 55 ? -17.008 -39.348 -41.994 1.00 112.36 ? 55 LYS C O 1 ATOM 3296 C CB . LYS C 3 55 ? -17.460 -36.260 -41.921 1.00 114.30 ? 55 LYS C CB 1 ATOM 3297 N N . THR C 3 56 ? -15.257 -38.523 -40.845 1.00 101.46 ? 56 THR C N 1 ATOM 3298 C CA . THR C 3 56 ? -14.971 -39.776 -40.145 1.00 101.56 ? 56 THR C CA 1 ATOM 3299 C C . THR C 3 56 ? -14.360 -39.536 -38.762 1.00 99.10 ? 56 THR C C 1 ATOM 3300 O O . THR C 3 56 ? -13.764 -38.486 -38.516 1.00 95.09 ? 56 THR C O 1 ATOM 3301 C CB . THR C 3 56 ? -14.045 -40.689 -40.989 1.00 96.67 ? 56 THR C CB 1 ATOM 3302 O OG1 . THR C 3 56 ? -13.805 -41.918 -40.292 1.00 98.27 ? 56 THR C OG1 1 ATOM 3303 C CG2 . THR C 3 56 ? -12.716 -39.997 -41.282 1.00 88.54 ? 56 THR C CG2 1 ATOM 3304 N N . SER C 3 57 ? -14.510 -40.516 -37.872 1.00 102.41 ? 57 SER C N 1 ATOM 3305 C CA . SER C 3 57 ? -14.026 -40.409 -36.497 1.00 101.50 ? 57 SER C CA 1 ATOM 3306 C C . SER C 3 57 ? -13.418 -41.719 -36.001 1.00 101.31 ? 57 SER C C 1 ATOM 3307 O O . SER C 3 57 ? -13.901 -42.802 -36.334 1.00 105.88 ? 57 SER C O 1 ATOM 3308 C CB . SER C 3 57 ? -15.161 -39.972 -35.567 1.00 109.25 ? 57 SER C CB 1 ATOM 3309 O OG . SER C 3 57 ? -14.761 -40.004 -34.207 1.00 109.51 ? 57 SER C OG 1 ATOM 3310 N N . ASN C 3 58 ? -12.358 -41.602 -35.203 1.00 96.96 ? 58 ASN C N 1 ATOM 3311 C CA . ASN C 3 58 ? -11.683 -42.753 -34.600 1.00 97.50 ? 58 ASN C CA 1 ATOM 3312 C C . ASN C 3 58 ? -10.915 -42.365 -33.338 1.00 95.38 ? 58 ASN C C 1 ATOM 3313 O O . ASN C 3 58 ? -9.848 -41.752 -33.412 1.00 89.00 ? 58 ASN C O 1 ATOM 3314 C CB . ASN C 3 58 ? -10.741 -43.428 -35.610 1.00 93.02 ? 58 ASN C CB 1 ATOM 3315 C CG . ASN C 3 58 ? -10.136 -44.724 -35.079 1.00 95.51 ? 58 ASN C CG 1 ATOM 3316 O OD1 . ASN C 3 58 ? -10.705 -45.387 -34.204 1.00 102.39 ? 58 ASN C OD1 1 ATOM 3317 N ND2 . ASN C 3 58 ? -8.975 -45.092 -35.614 1.00 91.19 ? 58 ASN C ND2 1 ATOM 3318 N N . GLY C 3 59 ? -11.460 -42.737 -32.183 1.00 101.59 ? 59 GLY C N 1 ATOM 3319 C CA . GLY C 3 59 ? -10.893 -42.338 -30.899 1.00 101.00 ? 59 GLY C CA 1 ATOM 3320 C C . GLY C 3 59 ? -11.139 -40.861 -30.664 1.00 99.41 ? 59 GLY C C 1 ATOM 3321 O O . GLY C 3 59 ? -12.285 -40.410 -30.654 1.00 104.42 ? 59 GLY C O 1 ATOM 3322 N N . ARG C 3 60 ? -10.059 -40.107 -30.482 1.00 93.42 ? 60 ARG C N 1 ATOM 3323 C CA . ARG C 3 60 ? -10.148 -38.652 -30.355 1.00 92.01 ? 60 ARG C CA 1 ATOM 3324 C C . ARG C 3 60 ? -9.946 -37.986 -31.716 1.00 87.25 ? 60 ARG C C 1 ATOM 3325 O O . ARG C 3 60 ? -10.259 -36.804 -31.898 1.00 87.44 ? 60 ARG C O 1 ATOM 3326 C CB . ARG C 3 60 ? -9.131 -38.133 -29.337 1.00 89.55 ? 60 ARG C CB 1 ATOM 3327 C CG . ARG C 3 60 ? -9.255 -38.768 -27.952 1.00 94.78 ? 60 ARG C CG 1 ATOM 3328 C CD . ARG C 3 60 ? -8.154 -38.303 -26.996 1.00 93.02 ? 60 ARG C CD 1 ATOM 3329 N NE . ARG C 3 60 ? -6.816 -38.327 -27.597 1.00 86.78 ? 60 ARG C NE 1 ATOM 3330 C CZ . ARG C 3 60 ? -6.081 -39.424 -27.782 1.00 85.55 ? 60 ARG C CZ 1 ATOM 3331 N NH1 . ARG C 3 60 ? -6.538 -40.620 -27.426 1.00 90.41 ? 60 ARG C NH1 1 ATOM 3332 N NH2 . ARG C 3 60 ? -4.883 -39.323 -28.336 1.00 80.42 ? 60 ARG C NH2 1 ATOM 3333 N N . TYR C 3 61 ? -9.429 -38.765 -32.666 1.00 83.86 ? 62 TYR C N 1 ATOM 3334 C CA . TYR C 3 61 ? -9.199 -38.314 -34.036 1.00 79.90 ? 62 TYR C CA 1 ATOM 3335 C C . TYR C 3 61 ? -10.508 -38.227 -34.832 1.00 84.08 ? 62 TYR C C 1 ATOM 3336 O O . TYR C 3 61 ? -11.346 -39.132 -34.779 1.00 88.91 ? 62 TYR C O 1 ATOM 3337 C CB . TYR C 3 61 ? -8.234 -39.260 -34.757 1.00 76.00 ? 62 TYR C CB 1 ATOM 3338 C CG . TYR C 3 61 ? -6.949 -39.566 -34.015 1.00 73.39 ? 62 TYR C CG 1 ATOM 3339 C CD1 . TYR C 3 61 ? -6.791 -40.760 -33.308 1.00 76.17 ? 62 TYR C CD1 1 ATOM 3340 C CD2 . TYR C 3 61 ? -5.880 -38.671 -34.037 1.00 69.17 ? 62 TYR C CD2 1 ATOM 3341 C CE1 . TYR C 3 61 ? -5.600 -41.044 -32.632 1.00 74.44 ? 62 TYR C CE1 1 ATOM 3342 C CE2 . TYR C 3 61 ? -4.691 -38.944 -33.367 1.00 67.08 ? 62 TYR C CE2 1 ATOM 3343 C CZ . TYR C 3 61 ? -4.556 -40.128 -32.669 1.00 69.81 ? 62 TYR C CZ 1 ATOM 3344 O OH . TYR C 3 61 ? -3.376 -40.390 -32.011 1.00 69.05 ? 62 TYR C OH 1 ATOM 3345 N N . SER C 3 62 ? -10.669 -37.130 -35.567 1.00 82.98 ? 63 SER C N 1 ATOM 3346 C CA . SER C 3 62 ? -11.823 -36.921 -36.432 1.00 87.05 ? 63 SER C CA 1 ATOM 3347 C C . SER C 3 62 ? -11.384 -36.144 -37.660 1.00 83.41 ? 63 SER C C 1 ATOM 3348 O O . SER C 3 62 ? -10.914 -35.010 -37.551 1.00 81.63 ? 63 SER C O 1 ATOM 3349 C CB . SER C 3 62 ? -12.919 -36.156 -35.694 1.00 93.64 ? 63 SER C CB 1 ATOM 3350 O OG . SER C 3 62 ? -12.487 -34.845 -35.374 1.00 92.32 ? 63 SER C OG 1 ATOM 3351 N N . ALA C 3 63 ? -11.541 -36.760 -38.828 1.00 83.06 ? 64 ALA C N 1 ATOM 3352 C CA . ALA C 3 63 ? -11.034 -36.188 -40.073 1.00 79.91 ? 64 ALA C CA 1 ATOM 3353 C C . ALA C 3 63 ? -12.137 -35.826 -41.067 1.00 84.62 ? 64 ALA C C 1 ATOM 3354 O O . ALA C 3 63 ? -13.201 -36.448 -41.077 1.00 89.73 ? 64 ALA C O 1 ATOM 3355 C CB . ALA C 3 63 ? -10.021 -37.132 -40.713 1.00 75.26 ? 64 ALA C CB 1 ATOM 3356 N N . THR C 3 64 ? -11.865 -34.817 -41.893 1.00 83.71 ? 65 THR C N 1 ATOM 3357 C CA . THR C 3 64 ? -12.792 -34.363 -42.935 1.00 88.65 ? 65 THR C CA 1 ATOM 3358 C C . THR C 3 64 ? -12.108 -34.307 -44.304 1.00 85.60 ? 65 THR C C 1 ATOM 3359 O O . THR C 3 64 ? -10.879 -34.263 -44.390 1.00 80.31 ? 65 THR C O 1 ATOM 3360 C CB . THR C 3 64 ? -13.378 -32.965 -42.618 1.00 93.50 ? 65 THR C CB 1 ATOM 3361 O OG1 . THR C 3 64 ? -12.309 -32.031 -42.426 1.00 89.96 ? 65 THR C OG1 1 ATOM 3362 C CG2 . THR C 3 64 ? -14.258 -33.000 -41.365 1.00 98.36 ? 65 THR C CG2 1 ATOM 3363 N N . LEU C 3 65 ? -12.915 -34.309 -45.366 1.00 89.83 ? 66 LEU C N 1 ATOM 3364 C CA . LEU C 3 65 ? -12.422 -34.254 -46.747 1.00 88.19 ? 66 LEU C CA 1 ATOM 3365 C C . LEU C 3 65 ? -13.432 -33.582 -47.677 1.00 94.87 ? 66 LEU C C 1 ATOM 3366 O O . LEU C 3 65 ? -14.635 -33.836 -47.583 1.00 100.81 ? 66 LEU C O 1 ATOM 3367 C CB . LEU C 3 65 ? -12.095 -35.665 -47.252 1.00 85.47 ? 66 LEU C CB 1 ATOM 3368 C CG . LEU C 3 65 ? -11.882 -35.930 -48.748 1.00 85.86 ? 66 LEU C CG 1 ATOM 3369 C CD1 . LEU C 3 65 ? -10.634 -35.234 -49.284 1.00 82.01 ? 66 LEU C CD1 1 ATOM 3370 C CD2 . LEU C 3 65 ? -11.813 -37.425 -49.016 1.00 85.07 ? 66 LEU C CD2 1 ATOM 3371 N N . ASP C 3 66 ? -12.934 -32.719 -48.562 1.00 94.80 ? 67 ASP C N 1 ATOM 3372 C CA . ASP C 3 66 ? -13.743 -32.122 -49.628 1.00 101.35 ? 67 ASP C CA 1 ATOM 3373 C C . ASP C 3 66 ? -12.972 -32.113 -50.947 1.00 99.54 ? 67 ASP C C 1 ATOM 3374 O O . ASP C 3 66 ? -12.057 -31.306 -51.136 1.00 97.73 ? 67 ASP C O 1 ATOM 3375 C CB . ASP C 3 66 ? -14.187 -30.703 -49.256 1.00 106.71 ? 67 ASP C CB 1 ATOM 3376 C CG . ASP C 3 66 ? -15.030 -30.052 -50.341 1.00 114.77 ? 67 ASP C CG 1 ATOM 3377 N N . LYS C 3 67 ? -13.347 -33.014 -51.854 1.00 100.78 ? 68 LYS C N 1 ATOM 3378 C CA . LYS C 3 67 ? -12.665 -33.148 -53.146 1.00 99.67 ? 68 LYS C CA 1 ATOM 3379 C C . LYS C 3 67 ? -12.966 -31.992 -54.100 1.00 105.85 ? 68 LYS C C 1 ATOM 3380 O O . LYS C 3 67 ? -12.228 -31.772 -55.060 1.00 105.49 ? 68 LYS C O 1 ATOM 3381 C CB . LYS C 3 67 ? -12.983 -34.492 -53.801 1.00 99.89 ? 68 LYS C CB 1 ATOM 3382 C CG . LYS C 3 67 ? -12.251 -35.658 -53.164 1.00 93.41 ? 68 LYS C CG 1 ATOM 3383 C CD . LYS C 3 67 ? -12.636 -36.981 -53.798 1.00 94.55 ? 68 LYS C CD 1 ATOM 3384 C CE . LYS C 3 67 ? -11.987 -38.136 -53.059 1.00 89.31 ? 68 LYS C CE 1 ATOM 3385 N NZ . LYS C 3 67 ? -12.417 -39.450 -53.597 1.00 91.90 ? 68 LYS C NZ 1 ATOM 3386 N N . ASP C 3 68 ? -14.042 -31.256 -53.821 1.00 112.40 ? 69 ASP C N 1 ATOM 3387 C CA . ASP C 3 68 ? -14.377 -30.034 -54.556 1.00 119.53 ? 69 ASP C CA 1 ATOM 3388 C C . ASP C 3 68 ? -13.383 -28.906 -54.247 1.00 117.80 ? 69 ASP C C 1 ATOM 3389 O O . ASP C 3 68 ? -13.511 -27.787 -54.754 1.00 124.10 ? 69 ASP C O 1 ATOM 3390 C CB . ASP C 3 68 ? -15.808 -29.594 -54.234 1.00 128.03 ? 69 ASP C CB 1 ATOM 3391 N N . ALA C 3 69 ? -12.399 -29.220 -53.405 1.00 110.05 ? 70 ALA C N 1 ATOM 3392 C CA . ALA C 3 69 ? -11.306 -28.313 -53.068 1.00 107.95 ? 70 ALA C CA 1 ATOM 3393 C C . ALA C 3 69 ? -9.982 -29.080 -52.934 1.00 99.75 ? 70 ALA C C 1 ATOM 3394 O O . ALA C 3 69 ? -8.924 -28.476 -52.723 1.00 97.96 ? 70 ALA C O 1 ATOM 3395 C CB . ALA C 3 69 ? -11.628 -27.545 -51.784 1.00 109.34 ? 70 ALA C CB 1 ATOM 3396 N N . LYS C 3 70 ? -10.057 -30.407 -53.069 1.00 95.80 ? 71 LYS C N 1 ATOM 3397 C CA . LYS C 3 70 ? -8.904 -31.308 -52.933 1.00 89.02 ? 71 LYS C CA 1 ATOM 3398 C C . LYS C 3 70 ? -8.142 -31.058 -51.627 1.00 84.64 ? 71 LYS C C 1 ATOM 3399 O O . LYS C 3 70 ? -6.919 -30.872 -51.621 1.00 81.95 ? 71 LYS C O 1 ATOM 3400 C CB . LYS C 3 70 ? -7.980 -31.200 -54.153 1.00 89.63 ? 71 LYS C CB 1 ATOM 3401 N N . HIS C 3 71 ? -8.885 -31.074 -50.523 1.00 84.67 ? 72 HIS C N 1 ATOM 3402 C CA . HIS C 3 71 ? -8.379 -30.616 -49.232 1.00 82.16 ? 72 HIS C CA 1 ATOM 3403 C C . HIS C 3 71 ? -8.787 -31.530 -48.075 1.00 79.25 ? 72 HIS C C 1 ATOM 3404 O O . HIS C 3 71 ? -9.883 -32.094 -48.073 1.00 81.63 ? 72 HIS C O 1 ATOM 3405 C CB . HIS C 3 71 ? -8.867 -29.185 -48.978 1.00 87.69 ? 72 HIS C CB 1 ATOM 3406 C CG . HIS C 3 71 ? -8.414 -28.611 -47.674 1.00 86.44 ? 72 HIS C CG 1 ATOM 3407 N ND1 . HIS C 3 71 ? -7.083 -28.452 -47.354 1.00 82.89 ? 72 HIS C ND1 1 ATOM 3408 C CD2 . HIS C 3 71 ? -9.115 -28.151 -46.610 1.00 89.12 ? 72 HIS C CD2 1 ATOM 3409 C CE1 . HIS C 3 71 ? -6.983 -27.923 -46.147 1.00 82.93 ? 72 HIS C CE1 1 ATOM 3410 N NE2 . HIS C 3 71 ? -8.201 -27.732 -45.674 1.00 86.56 ? 72 HIS C NE2 1 ATOM 3411 N N . SER C 3 72 ? -7.894 -31.664 -47.097 1.00 74.98 ? 73 SER C N 1 ATOM 3412 C CA . SER C 3 72 ? -8.142 -32.493 -45.915 1.00 72.84 ? 73 SER C CA 1 ATOM 3413 C C . SER C 3 72 ? -7.797 -31.760 -44.619 1.00 72.26 ? 73 SER C C 1 ATOM 3414 O O . SER C 3 72 ? -7.092 -30.750 -44.640 1.00 72.62 ? 73 SER C O 1 ATOM 3415 C CB . SER C 3 72 ? -7.358 -33.806 -46.001 1.00 68.39 ? 73 SER C CB 1 ATOM 3416 O OG . SER C 3 72 ? -7.562 -34.593 -44.839 1.00 67.15 ? 73 SER C OG 1 ATOM 3417 N N . THR C 3 73 ? -8.308 -32.276 -43.499 1.00 72.25 ? 74 THR C N 1 ATOM 3418 C CA . THR C 3 73 ? -8.063 -31.707 -42.168 1.00 72.20 ? 74 THR C CA 1 ATOM 3419 C C . THR C 3 73 ? -8.205 -32.778 -41.085 1.00 70.62 ? 74 THR C C 1 ATOM 3420 O O . THR C 3 73 ? -9.171 -33.539 -41.080 1.00 72.99 ? 74 THR C O 1 ATOM 3421 C CB . THR C 3 73 ? -9.010 -30.514 -41.860 1.00 77.93 ? 74 THR C CB 1 ATOM 3422 O OG1 . THR C 3 73 ? -8.888 -29.526 -42.888 1.00 80.67 ? 74 THR C OG1 1 ATOM 3423 C CG2 . THR C 3 73 ? -8.662 -29.868 -40.537 1.00 78.24 ? 74 THR C CG2 1 ATOM 3424 N N . LEU C 3 74 ? -7.235 -32.832 -40.177 1.00 67.64 ? 75 LEU C N 1 ATOM 3425 C CA . LEU C 3 74 ? -7.256 -33.787 -39.077 1.00 66.86 ? 75 LEU C CA 1 ATOM 3426 C C . LEU C 3 74 ? -7.393 -33.063 -37.753 1.00 69.04 ? 75 LEU C C 1 ATOM 3427 O O . LEU C 3 74 ? -6.542 -32.248 -37.395 1.00 67.96 ? 75 LEU C O 1 ATOM 3428 C CB . LEU C 3 74 ? -5.982 -34.637 -39.065 1.00 62.49 ? 75 LEU C CB 1 ATOM 3429 C CG . LEU C 3 74 ? -5.919 -35.743 -38.004 1.00 62.04 ? 75 LEU C CG 1 ATOM 3430 C CD1 . LEU C 3 74 ? -6.984 -36.795 -38.263 1.00 64.63 ? 75 LEU C CD1 1 ATOM 3431 C CD2 . LEU C 3 74 ? -4.545 -36.387 -37.931 1.00 58.40 ? 75 LEU C CD2 1 ATOM 3432 N N . HIS C 3 75 ? -8.463 -33.372 -37.028 1.00 73.00 ? 76 HIS C N 1 ATOM 3433 C CA . HIS C 3 75 ? -8.678 -32.821 -35.697 1.00 75.89 ? 76 HIS C CA 1 ATOM 3434 C C . HIS C 3 75 ? -8.427 -33.874 -34.625 1.00 75.24 ? 76 HIS C C 1 ATOM 3435 O O . HIS C 3 75 ? -8.963 -34.984 -34.696 1.00 76.54 ? 76 HIS C O 1 ATOM 3436 C CB . HIS C 3 75 ? -10.105 -32.292 -35.551 1.00 82.56 ? 76 HIS C CB 1 ATOM 3437 C CG . HIS C 3 75 ? -10.501 -31.304 -36.603 1.00 85.27 ? 76 HIS C CG 1 ATOM 3438 N ND1 . HIS C 3 75 ? -10.299 -29.948 -36.465 1.00 87.70 ? 76 HIS C ND1 1 ATOM 3439 C CD2 . HIS C 3 75 ? -11.102 -31.474 -37.805 1.00 87.12 ? 76 HIS C CD2 1 ATOM 3440 C CE1 . HIS C 3 75 ? -10.753 -29.325 -37.539 1.00 90.62 ? 76 HIS C CE1 1 ATOM 3441 N NE2 . HIS C 3 75 ? -11.246 -30.229 -38.367 1.00 90.24 ? 76 HIS C NE2 1 ATOM 3442 N N . ILE C 3 76 ? -7.602 -33.524 -33.641 1.00 74.07 ? 77 ILE C N 1 ATOM 3443 C CA . ILE C 3 76 ? -7.492 -34.309 -32.409 1.00 75.16 ? 77 ILE C CA 1 ATOM 3444 C C . ILE C 3 76 ? -7.974 -33.464 -31.226 1.00 79.64 ? 77 ILE C C 1 ATOM 3445 O O . ILE C 3 76 ? -7.362 -32.441 -30.894 1.00 79.12 ? 77 ILE C O 1 ATOM 3446 C CB . ILE C 3 76 ? -6.055 -34.805 -32.141 1.00 70.78 ? 77 ILE C CB 1 ATOM 3447 C CG1 . ILE C 3 76 ? -5.388 -35.276 -33.429 1.00 66.56 ? 77 ILE C CG1 1 ATOM 3448 C CG2 . ILE C 3 76 ? -6.070 -35.931 -31.118 1.00 72.72 ? 77 ILE C CG2 1 ATOM 3449 N N . THR C 3 77 ? -9.075 -33.887 -30.605 1.00 84.92 ? 78 THR C N 1 ATOM 3450 C CA . THR C 3 77 ? -9.630 -33.174 -29.451 1.00 90.35 ? 78 THR C CA 1 ATOM 3451 C C . THR C 3 77 ? -9.017 -33.704 -28.159 1.00 90.58 ? 78 THR C C 1 ATOM 3452 O O . THR C 3 77 ? -8.884 -34.919 -27.986 1.00 90.33 ? 78 THR C O 1 ATOM 3453 C CB . THR C 3 77 ? -11.178 -33.284 -29.370 1.00 97.64 ? 78 THR C CB 1 ATOM 3454 O OG1 . THR C 3 77 ? -11.753 -33.144 -30.675 1.00 97.79 ? 78 THR C OG1 1 ATOM 3455 C CG2 . THR C 3 77 ? -11.745 -32.201 -28.460 1.00 103.63 ? 78 THR C CG2 1 ATOM 3456 N N . ALA C 3 78 ? -8.653 -32.782 -27.266 1.00 91.94 ? 79 ALA C N 1 ATOM 3457 C CA . ALA C 3 78 ? -8.053 -33.098 -25.962 1.00 92.92 ? 79 ALA C CA 1 ATOM 3458 C C . ALA C 3 78 ? -6.796 -33.956 -26.105 1.00 87.55 ? 79 ALA C C 1 ATOM 3459 O O . ALA C 3 78 ? -6.810 -35.161 -25.834 1.00 88.41 ? 79 ALA C O 1 ATOM 3460 C CB . ALA C 3 78 ? -9.079 -33.755 -25.025 1.00 99.62 ? 79 ALA C CB 1 ATOM 3461 N N . THR C 3 79 ? -5.711 -33.312 -26.528 1.00 83.09 ? 80 THR C N 1 ATOM 3462 C CA . THR C 3 79 ? -4.475 -34.003 -26.879 1.00 78.48 ? 80 THR C CA 1 ATOM 3463 C C . THR C 3 79 ? -3.738 -34.538 -25.661 1.00 79.86 ? 80 THR C C 1 ATOM 3464 O O . THR C 3 79 ? -3.603 -33.850 -24.655 1.00 82.64 ? 80 THR C O 1 ATOM 3465 C CB . THR C 3 79 ? -3.520 -33.084 -27.659 1.00 74.89 ? 80 THR C CB 1 ATOM 3466 O OG1 . THR C 3 79 ? -4.274 -32.161 -28.456 1.00 75.75 ? 80 THR C OG1 1 ATOM 3467 C CG2 . THR C 3 79 ? -2.617 -33.908 -28.566 1.00 70.85 ? 80 THR C CG2 1 ATOM 3468 N N . LEU C 3 80 ? -3.266 -35.775 -25.765 1.00 78.73 ? 81 LEU C N 1 ATOM 3469 C CA . LEU C 3 80 ? -2.430 -36.368 -24.728 1.00 80.49 ? 81 LEU C CA 1 ATOM 3470 C C . LEU C 3 80 ? -0.960 -36.141 -25.067 1.00 77.05 ? 81 LEU C C 1 ATOM 3471 O O . LEU C 3 80 ? -0.641 -35.694 -26.169 1.00 73.39 ? 81 LEU C O 1 ATOM 3472 C CB . LEU C 3 80 ? -2.731 -37.863 -24.581 1.00 83.00 ? 81 LEU C CB 1 ATOM 3473 C CG . LEU C 3 80 ? -4.100 -38.206 -23.988 1.00 88.21 ? 81 LEU C CG 1 ATOM 3474 N N . LEU C 3 81 ? -0.073 -36.433 -24.118 1.00 79.06 ? 82 LEU C N 1 ATOM 3475 C CA . LEU C 3 81 ? 1.366 -36.330 -24.360 1.00 77.34 ? 82 LEU C CA 1 ATOM 3476 C C . LEU C 3 81 ? 1.845 -37.393 -25.336 1.00 75.34 ? 82 LEU C C 1 ATOM 3477 O O . LEU C 3 81 ? 2.720 -37.134 -26.162 1.00 72.93 ? 82 LEU C O 1 ATOM 3478 C CB . LEU C 3 81 ? 2.168 -36.442 -23.061 1.00 81.25 ? 82 LEU C CB 1 ATOM 3479 C CG . LEU C 3 81 ? 2.388 -35.219 -22.168 1.00 83.28 ? 82 LEU C CG 1 ATOM 3480 C CD1 . LEU C 3 81 ? 3.546 -35.517 -21.235 1.00 86.83 ? 82 LEU C CD1 1 ATOM 3481 C CD2 . LEU C 3 81 ? 2.666 -33.945 -22.959 1.00 80.19 ? 82 LEU C CD2 1 ATOM 3482 N N . ASP C 3 82 ? 1.259 -38.583 -25.240 1.00 77.18 ? 83 ASP C N 1 ATOM 3483 C CA . ASP C 3 82 ? 1.660 -39.712 -26.073 1.00 76.51 ? 83 ASP C CA 1 ATOM 3484 C C . ASP C 3 82 ? 1.138 -39.579 -27.509 1.00 72.41 ? 83 ASP C C 1 ATOM 3485 O O . ASP C 3 82 ? 1.066 -40.566 -28.245 1.00 72.50 ? 83 ASP C O 1 ATOM 3486 C CB . ASP C 3 82 ? 1.209 -41.036 -25.438 1.00 81.34 ? 83 ASP C CB 1 ATOM 3487 C CG . ASP C 3 82 ? 1.600 -41.146 -23.967 0.70 86.36 ? 83 ASP C CG 1 ATOM 3488 O OD1 . ASP C 3 82 ? 0.970 -40.467 -23.126 0.70 87.72 ? 83 ASP C OD1 1 ATOM 3489 O OD2 . ASP C 3 82 ? 2.531 -41.918 -23.650 0.70 89.59 ? 83 ASP C OD2 1 ATOM 3490 N N . ASP C 3 83 ? 0.776 -38.356 -27.893 1.00 69.55 ? 84 ASP C N 1 ATOM 3491 C CA . ASP C 3 83 ? 0.371 -38.050 -29.262 1.00 66.09 ? 84 ASP C CA 1 ATOM 3492 C C . ASP C 3 83 ? 1.511 -37.411 -30.031 1.00 63.52 ? 84 ASP C C 1 ATOM 3493 O O . ASP C 3 83 ? 1.417 -37.229 -31.245 1.00 61.22 ? 84 ASP C O 1 ATOM 3494 C CB . ASP C 3 83 ? -0.822 -37.098 -29.281 1.00 66.07 ? 84 ASP C CB 1 ATOM 3495 C CG . ASP C 3 83 ? -2.081 -37.725 -28.738 1.00 69.82 ? 84 ASP C CG 1 ATOM 3496 O OD1 . ASP C 3 83 ? -1.987 -38.691 -27.951 1.00 73.56 ? 84 ASP C OD1 1 ATOM 3497 O OD2 . ASP C 3 83 ? -3.175 -37.239 -29.091 1.00 70.84 ? 84 ASP C OD2 1 ATOM 3498 N N . THR C 3 84 ? 2.580 -37.058 -29.322 1.00 64.72 ? 85 THR C N 1 ATOM 3499 C CA . THR C 3 84 ? 3.724 -36.399 -29.946 1.00 63.65 ? 85 THR C CA 1 ATOM 3500 C C . THR C 3 84 ? 4.366 -37.327 -30.964 1.00 62.95 ? 85 THR C C 1 ATOM 3501 O O . THR C 3 84 ? 5.114 -38.248 -30.622 1.00 65.27 ? 85 THR C O 1 ATOM 3502 C CB . THR C 3 84 ? 4.729 -35.854 -28.910 1.00 66.42 ? 85 THR C CB 1 ATOM 3503 O OG1 . THR C 3 84 ? 4.122 -34.757 -28.212 1.00 66.99 ? 85 THR C OG1 1 ATOM 3504 C CG2 . THR C 3 84 ? 6.010 -35.371 -29.587 1.00 66.59 ? 85 THR C CG2 1 ATOM 3505 N N . ALA C 3 85 ? 4.025 -37.064 -32.220 1.00 60.32 ? 86 ALA C N 1 ATOM 3506 C CA . ALA C 3 85 ? 4.383 -37.903 -33.344 1.00 59.74 ? 86 ALA C CA 1 ATOM 3507 C C . ALA C 3 85 ? 4.356 -37.060 -34.610 1.00 57.84 ? 86 ALA C C 1 ATOM 3508 O O . ALA C 3 85 ? 4.068 -35.858 -34.555 1.00 57.39 ? 86 ALA C O 1 ATOM 3509 C CB . ALA C 3 85 ? 3.392 -39.048 -33.462 1.00 59.70 ? 86 ALA C CB 1 ATOM 3510 N N . THR C 3 86 ? 4.670 -37.686 -35.743 1.00 57.48 ? 87 THR C N 1 ATOM 3511 C CA . THR C 3 86 ? 4.462 -37.058 -37.042 1.00 55.93 ? 87 THR C CA 1 ATOM 3512 C C . THR C 3 86 ? 3.258 -37.677 -37.742 1.00 54.31 ? 87 THR C C 1 ATOM 3513 O O . THR C 3 86 ? 3.142 -38.906 -37.845 1.00 54.78 ? 87 THR C O 1 ATOM 3514 C CB . THR C 3 86 ? 5.718 -37.096 -37.932 1.00 57.63 ? 87 THR C CB 1 ATOM 3515 O OG1 . THR C 3 86 ? 6.725 -36.270 -37.347 1.00 59.95 ? 87 THR C OG1 1 ATOM 3516 C CG2 . THR C 3 86 ? 5.413 -36.555 -39.310 1.00 56.75 ? 87 THR C CG2 1 ATOM 3517 N N . TYR C 3 87 ? 2.360 -36.806 -38.196 1.00 53.13 ? 88 TYR C N 1 ATOM 3518 C CA . TYR C 3 87 ? 1.156 -37.225 -38.885 1.00 52.44 ? 88 TYR C CA 1 ATOM 3519 C C . TYR C 3 87 ? 1.264 -36.907 -40.356 1.00 52.30 ? 88 TYR C C 1 ATOM 3520 O O . TYR C 3 87 ? 1.427 -35.746 -40.735 1.00 52.78 ? 88 TYR C O 1 ATOM 3521 C CB . TYR C 3 87 ? -0.076 -36.571 -38.266 1.00 52.63 ? 88 TYR C CB 1 ATOM 3522 C CG . TYR C 3 87 ? -0.293 -37.004 -36.840 1.00 53.65 ? 88 TYR C CG 1 ATOM 3523 C CD1 . TYR C 3 87 ? -0.021 -36.143 -35.781 1.00 54.44 ? 88 TYR C CD1 1 ATOM 3524 C CD2 . TYR C 3 87 ? -0.734 -38.291 -36.547 1.00 54.52 ? 88 TYR C CD2 1 ATOM 3525 C CE1 . TYR C 3 87 ? -0.210 -36.548 -34.465 1.00 56.02 ? 88 TYR C CE1 1 ATOM 3526 C CE2 . TYR C 3 87 ? -0.919 -38.704 -35.240 1.00 56.51 ? 88 TYR C CE2 1 ATOM 3527 C CZ . TYR C 3 87 ? -0.657 -37.832 -34.203 1.00 56.90 ? 88 TYR C CZ 1 ATOM 3528 O OH . TYR C 3 87 ? -0.843 -38.252 -32.906 1.00 59.41 ? 88 TYR C OH 1 ATOM 3529 N N . ILE C 3 88 ? 1.178 -37.956 -41.172 1.00 52.50 ? 89 ILE C N 1 ATOM 3530 C CA . ILE C 3 88 ? 1.383 -37.858 -42.613 1.00 52.76 ? 89 ILE C CA 1 ATOM 3531 C C . ILE C 3 88 ? 0.095 -38.153 -43.388 1.00 52.91 ? 89 ILE C C 1 ATOM 3532 O O . ILE C 3 88 ? -0.624 -39.114 -43.094 1.00 53.22 ? 89 ILE C O 1 ATOM 3533 C CB . ILE C 3 88 ? 2.551 -38.758 -43.070 1.00 54.09 ? 89 ILE C CB 1 ATOM 3534 C CG1 . ILE C 3 88 ? 3.815 -38.406 -42.274 1.00 54.87 ? 89 ILE C CG1 1 ATOM 3535 C CG2 . ILE C 3 88 ? 2.794 -38.602 -44.564 1.00 55.41 ? 89 ILE C CG2 1 ATOM 3536 C CD1 . ILE C 3 88 ? 5.026 -39.277 -42.551 1.00 57.70 ? 89 ILE C CD1 1 ATOM 3537 N N . CYS C 3 89 ? -0.178 -37.294 -44.369 1.00 53.55 ? 90 CYS C N 1 ATOM 3538 C CA . CYS C 3 89 ? -1.370 -37.351 -45.211 1.00 54.61 ? 90 CYS C CA 1 ATOM 3539 C C . CYS C 3 89 ? -1.029 -38.051 -46.523 1.00 55.57 ? 90 CYS C C 1 ATOM 3540 O O . CYS C 3 89 ? -0.116 -37.630 -47.242 1.00 56.31 ? 90 CYS C O 1 ATOM 3541 C CB . CYS C 3 89 ? -1.864 -35.921 -45.472 1.00 55.75 ? 90 CYS C CB 1 ATOM 3542 S SG . CYS C 3 89 ? -3.183 -35.730 -46.702 1.00 59.35 ? 90 CYS C SG 1 ATOM 3543 N N . VAL C 3 90 ? -1.755 -39.124 -46.829 1.00 56.46 ? 91 VAL C N 1 ATOM 3544 C CA . VAL C 3 90 ? -1.438 -39.973 -47.990 1.00 57.97 ? 91 VAL C CA 1 ATOM 3545 C C . VAL C 3 90 ? -2.630 -40.167 -48.933 1.00 59.95 ? 91 VAL C C 1 ATOM 3546 O O . VAL C 3 90 ? -3.670 -40.703 -48.537 1.00 60.91 ? 91 VAL C O 1 ATOM 3547 C CB . VAL C 3 90 ? -0.864 -41.347 -47.557 1.00 58.61 ? 91 VAL C CB 1 ATOM 3548 C CG1 . VAL C 3 90 ? -0.657 -42.263 -48.761 1.00 61.22 ? 91 VAL C CG1 1 ATOM 3549 C CG2 . VAL C 3 90 ? 0.441 -41.158 -46.816 1.00 57.54 ? 91 VAL C CG2 1 ATOM 3550 N N . VAL C 3 91 ? -2.446 -39.747 -50.185 1.00 61.30 ? 92 VAL C N 1 ATOM 3551 C CA . VAL C 3 91 ? -3.496 -39.772 -51.203 1.00 63.75 ? 92 VAL C CA 1 ATOM 3552 C C . VAL C 3 91 ? -3.350 -40.982 -52.123 1.00 66.00 ? 92 VAL C C 1 ATOM 3553 O O . VAL C 3 91 ? -2.259 -41.255 -52.621 1.00 66.33 ? 92 VAL C O 1 ATOM 3554 C CB . VAL C 3 91 ? -3.488 -38.468 -52.040 1.00 64.96 ? 92 VAL C CB 1 ATOM 3555 C CG1 . VAL C 3 91 ? -4.593 -38.480 -53.088 1.00 68.32 ? 92 VAL C CG1 1 ATOM 3556 C CG2 . VAL C 3 91 ? -3.635 -37.256 -51.134 1.00 63.52 ? 92 VAL C CG2 1 ATOM 3557 N N . GLY C 3 92 ? -4.456 -41.700 -52.331 1.00 68.48 ? 93 GLY C N 1 ATOM 3558 C CA . GLY C 3 92 ? -4.502 -42.853 -53.239 1.00 71.93 ? 93 GLY C CA 1 ATOM 3559 C C . GLY C 3 92 ? -5.170 -42.511 -54.559 1.00 75.25 ? 93 GLY C C 1 ATOM 3560 O O . GLY C 3 92 ? -6.292 -42.004 -54.577 1.00 76.78 ? 93 GLY C O 1 ATOM 3561 N N . ASP C 3 93 ? -4.487 -42.792 -55.667 1.00 77.24 ? 94 ASP C N 1 ATOM 3562 C CA . ASP C 3 93 ? -4.942 -42.316 -56.978 1.00 80.67 ? 94 ASP C CA 1 ATOM 3563 C C . ASP C 3 93 ? -5.793 -43.314 -57.775 1.00 85.21 ? 94 ASP C C 1 ATOM 3564 O O . ASP C 3 93 ? -6.424 -42.945 -58.766 1.00 88.54 ? 94 ASP C O 1 ATOM 3565 C CB . ASP C 3 93 ? -3.766 -41.774 -57.813 1.00 81.21 ? 94 ASP C CB 1 ATOM 3566 C CG . ASP C 3 93 ? -2.865 -42.872 -58.358 1.00 83.75 ? 94 ASP C CG 1 ATOM 3567 O OD1 . ASP C 3 93 ? -2.645 -43.886 -57.657 1.00 83.74 ? 94 ASP C OD1 1 ATOM 3568 O OD2 . ASP C 3 93 ? -2.368 -42.711 -59.494 1.00 87.24 ? 94 ASP C OD2 1 ATOM 3569 N N . ARG C 3 94 ? -5.803 -44.571 -57.339 1.00 86.15 ? 95 ARG C N 1 ATOM 3570 C CA . ARG C 3 94 ? -6.657 -45.595 -57.943 1.00 91.28 ? 95 ARG C CA 1 ATOM 3571 C C . ARG C 3 94 ? -7.169 -46.596 -56.922 1.00 92.31 ? 95 ARG C C 1 ATOM 3572 O O . ARG C 3 94 ? -6.430 -47.015 -56.032 1.00 90.01 ? 95 ARG C O 1 ATOM 3573 C CB . ARG C 3 94 ? -5.940 -46.313 -59.085 1.00 94.63 ? 95 ARG C CB 1 ATOM 3574 C CG . ARG C 3 94 ? -6.523 -45.981 -60.447 0.70 98.83 ? 95 ARG C CG 1 ATOM 3575 C CD . ARG C 3 94 ? -5.760 -46.664 -61.572 0.70 102.57 ? 95 ARG C CD 1 ATOM 3576 N NE . ARG C 3 94 ? -4.666 -45.868 -62.145 0.70 101.21 ? 95 ARG C NE 1 ATOM 3577 C CZ . ARG C 3 94 ? -4.689 -44.553 -62.370 0.70 99.62 ? 95 ARG C CZ 1 ATOM 3578 N NH1 . ARG C 3 94 ? -3.627 -43.959 -62.894 0.70 99.80 ? 95 ARG C NH1 1 ATOM 3579 N NH2 . ARG C 3 94 ? -5.761 -43.825 -62.086 0.70 98.88 ? 95 ARG C NH2 1 ATOM 3580 N N . GLY C 3 95 ? -8.436 -46.978 -57.067 1.00 96.76 ? 96 GLY C N 1 ATOM 3581 C CA . GLY C 3 95 ? -9.097 -47.875 -56.122 1.00 99.35 ? 96 GLY C CA 1 ATOM 3582 C C . GLY C 3 95 ? -8.873 -49.347 -56.403 1.00 104.28 ? 96 GLY C C 1 ATOM 3583 O O . GLY C 3 95 ? -9.782 -50.162 -56.224 1.00 109.96 ? 96 GLY C O 1 ATOM 3584 N N . SER C 3 96 ? -7.662 -49.686 -56.840 1.00 103.12 ? 97 SER C N 1 ATOM 3585 C CA . SER C 3 96 ? -7.291 -51.067 -57.143 1.00 108.46 ? 97 SER C CA 1 ATOM 3586 C C . SER C 3 96 ? -5.782 -51.265 -57.063 1.00 106.07 ? 97 SER C C 1 ATOM 3587 O O . SER C 3 96 ? -5.020 -50.294 -57.064 1.00 100.76 ? 97 SER C O 1 ATOM 3588 C CB . SER C 3 96 ? -7.797 -51.474 -58.532 1.00 114.41 ? 97 SER C CB 1 ATOM 3589 O OG . SER C 3 96 ? -7.148 -50.730 -59.549 1.00 112.41 ? 97 SER C OG 1 ATOM 3590 N N . ALA C 3 97 ? -5.368 -52.530 -57.000 1.00 111.08 ? 98 ALA C N 1 ATOM 3591 C CA . ALA C 3 97 ? -3.958 -52.912 -56.954 1.00 111.05 ? 98 ALA C CA 1 ATOM 3592 C C . ALA C 3 97 ? -3.235 -52.557 -58.253 1.00 111.59 ? 98 ALA C C 1 ATOM 3593 O O . ALA C 3 97 ? -2.848 -51.406 -58.472 1.00 106.69 ? 98 ALA C O 1 ATOM 3594 C CB . ALA C 3 97 ? -3.831 -54.401 -56.667 1.00 118.16 ? 98 ALA C CB 1 ATOM 3595 N N . GLY C 3 99 ? -2.164 -48.789 -59.138 1.00 96.50 ? 100 GLY C N 1 ATOM 3596 C CA . GLY C 3 99 ? -2.241 -47.547 -58.373 1.00 90.70 ? 100 GLY C CA 1 ATOM 3597 C C . GLY C 3 99 ? -0.999 -47.254 -57.544 1.00 87.62 ? 100 GLY C C 1 ATOM 3598 O O . GLY C 3 99 ? -0.330 -48.170 -57.062 1.00 89.41 ? 100 GLY C O 1 ATOM 3599 N N . ARG C 3 100 ? -0.696 -45.969 -57.378 1.00 83.85 ? 103 ARG C N 1 ATOM 3600 C CA . ARG C 3 100 ? 0.473 -45.539 -56.621 1.00 81.44 ? 103 ARG C CA 1 ATOM 3601 C C . ARG C 3 100 ? 0.111 -44.428 -55.635 1.00 76.49 ? 103 ARG C C 1 ATOM 3602 O O . ARG C 3 100 ? -0.457 -43.402 -56.023 1.00 75.49 ? 103 ARG C O 1 ATOM 3603 C CB . ARG C 3 100 ? 1.580 -45.068 -57.568 1.00 84.03 ? 103 ARG C CB 1 ATOM 3604 N N . LEU C 3 101 ? 0.449 -44.643 -54.363 1.00 74.05 ? 104 LEU C N 1 ATOM 3605 C CA . LEU C 3 101 ? 0.171 -43.679 -53.297 1.00 69.57 ? 104 LEU C CA 1 ATOM 3606 C C . LEU C 3 101 ? 1.094 -42.460 -53.340 1.00 68.33 ? 104 LEU C C 1 ATOM 3607 O O . LEU C 3 101 ? 2.216 -42.530 -53.840 1.00 70.50 ? 104 LEU C O 1 ATOM 3608 C CB . LEU C 3 101 ? 0.252 -44.356 -51.925 1.00 68.30 ? 104 LEU C CB 1 ATOM 3609 C CG . LEU C 3 101 ? -0.782 -45.431 -51.576 1.00 69.82 ? 104 LEU C CG 1 ATOM 3610 C CD1 . LEU C 3 101 ? -0.397 -46.118 -50.287 1.00 69.86 ? 104 LEU C CD1 1 ATOM 3611 C CD2 . LEU C 3 101 ? -2.183 -44.853 -51.454 1.00 68.32 ? 104 LEU C CD2 1 ATOM 3612 N N . HIS C 3 102 ? 0.597 -41.347 -52.805 1.00 65.71 ? 105 HIS C N 1 ATOM 3613 C CA . HIS C 3 102 ? 1.312 -40.073 -52.804 1.00 65.41 ? 105 HIS C CA 1 ATOM 3614 C C . HIS C 3 102 ? 1.486 -39.577 -51.380 1.00 62.32 ? 105 HIS C C 1 ATOM 3615 O O . HIS C 3 102 ? 0.511 -39.442 -50.644 1.00 60.36 ? 105 HIS C O 1 ATOM 3616 C CB . HIS C 3 102 ? 0.548 -39.041 -53.628 1.00 66.53 ? 105 HIS C CB 1 ATOM 3617 C CG . HIS C 3 102 ? 0.183 -39.526 -54.993 1.00 70.11 ? 105 HIS C CG 1 ATOM 3618 N ND1 . HIS C 3 102 ? 1.062 -39.489 -56.054 1.00 74.18 ? 105 HIS C ND1 1 ATOM 3619 C CD2 . HIS C 3 102 ? -0.955 -40.087 -55.465 1.00 71.21 ? 105 HIS C CD2 1 ATOM 3620 C CE1 . HIS C 3 102 ? 0.477 -39.995 -57.125 1.00 77.05 ? 105 HIS C CE1 1 ATOM 3621 N NE2 . HIS C 3 102 ? -0.748 -40.365 -56.794 1.00 75.56 ? 105 HIS C NE2 1 ATOM 3622 N N . PHE C 3 103 ? 2.729 -39.300 -51.002 1.00 62.80 ? 106 PHE C N 1 ATOM 3623 C CA . PHE C 3 103 ? 3.062 -38.993 -49.616 1.00 60.51 ? 106 PHE C CA 1 ATOM 3624 C C . PHE C 3 103 ? 3.409 -37.522 -49.375 1.00 60.81 ? 106 PHE C C 1 ATOM 3625 O O . PHE C 3 103 ? 4.296 -36.965 -50.023 1.00 63.93 ? 106 PHE C O 1 ATOM 3626 C CB . PHE C 3 103 ? 4.207 -39.899 -49.151 1.00 61.87 ? 106 PHE C CB 1 ATOM 3627 C CG . PHE C 3 103 ? 3.807 -41.337 -48.977 1.00 61.56 ? 106 PHE C CG 1 ATOM 3628 C CD1 . PHE C 3 103 ? 3.515 -42.132 -50.077 1.00 63.13 ? 106 PHE C CD1 1 ATOM 3629 C CD2 . PHE C 3 103 ? 3.724 -41.898 -47.710 1.00 59.87 ? 106 PHE C CD2 1 ATOM 3630 C CE1 . PHE C 3 103 ? 3.136 -43.453 -49.916 1.00 64.23 ? 106 PHE C CE1 1 ATOM 3631 C CE2 . PHE C 3 103 ? 3.347 -43.222 -47.543 1.00 60.79 ? 106 PHE C CE2 1 ATOM 3632 C CZ . PHE C 3 103 ? 3.051 -43.997 -48.646 1.00 63.32 ? 106 PHE C CZ 1 ATOM 3633 N N . GLY C 3 104 ? 2.700 -36.896 -48.441 1.00 58.47 ? 107 GLY C N 1 ATOM 3634 C CA . GLY C 3 104 ? 3.087 -35.575 -47.953 1.00 59.34 ? 107 GLY C CA 1 ATOM 3635 C C . GLY C 3 104 ? 4.293 -35.658 -47.026 1.00 59.80 ? 107 GLY C C 1 ATOM 3636 O O . GLY C 3 104 ? 4.633 -36.742 -46.533 1.00 59.13 ? 107 GLY C O 1 ATOM 3637 N N . ALA C 3 105 ? 4.940 -34.519 -46.784 1.00 61.78 ? 108 ALA C N 1 ATOM 3638 C CA . ALA C 3 105 ? 6.151 -34.482 -45.959 1.00 63.38 ? 108 ALA C CA 1 ATOM 3639 C C . ALA C 3 105 ? 5.848 -34.647 -44.469 1.00 60.61 ? 108 ALA C C 1 ATOM 3640 O O . ALA C 3 105 ? 6.763 -34.775 -43.647 1.00 61.84 ? 108 ALA C O 1 ATOM 3641 C CB . ALA C 3 105 ? 6.932 -33.202 -46.210 1.00 67.82 ? 108 ALA C CB 1 ATOM 3642 N N . GLY C 3 106 ? 4.560 -34.639 -44.133 1.00 57.64 ? 109 GLY C N 1 ATOM 3643 C CA . GLY C 3 106 ? 4.105 -34.886 -42.770 1.00 55.55 ? 109 GLY C CA 1 ATOM 3644 C C . GLY C 3 106 ? 4.160 -33.675 -41.871 1.00 56.49 ? 109 GLY C C 1 ATOM 3645 O O . GLY C 3 106 ? 4.710 -32.634 -42.241 1.00 59.28 ? 109 GLY C O 1 ATOM 3646 N N . THR C 3 107 ? 3.582 -33.816 -40.685 1.00 55.07 ? 110 THR C N 1 ATOM 3647 C CA . THR C 3 107 ? 3.584 -32.746 -39.699 1.00 56.64 ? 110 THR C CA 1 ATOM 3648 C C . THR C 3 107 ? 4.020 -33.310 -38.352 1.00 56.31 ? 110 THR C C 1 ATOM 3649 O O . THR C 3 107 ? 3.348 -34.174 -37.787 1.00 54.82 ? 110 THR C O 1 ATOM 3650 C CB . THR C 3 107 ? 2.186 -32.057 -39.579 1.00 56.55 ? 110 THR C CB 1 ATOM 3651 O OG1 . THR C 3 107 ? 1.705 -31.698 -40.884 1.00 58.02 ? 110 THR C OG1 1 ATOM 3652 C CG2 . THR C 3 107 ? 2.248 -30.802 -38.696 1.00 58.63 ? 110 THR C CG2 1 ATOM 3653 N N . GLN C 3 108 ? 5.159 -32.825 -37.862 1.00 58.71 ? 111 GLN C N 1 ATOM 3654 C CA . GLN C 3 108 ? 5.654 -33.156 -36.532 1.00 59.35 ? 111 GLN C CA 1 ATOM 3655 C C . GLN C 3 108 ? 4.812 -32.403 -35.492 1.00 59.16 ? 111 GLN C C 1 ATOM 3656 O O . GLN C 3 108 ? 4.771 -31.165 -35.495 1.00 61.26 ? 111 GLN C O 1 ATOM 3657 C CB . GLN C 3 108 ? 7.137 -32.768 -36.426 1.00 63.18 ? 111 GLN C CB 1 ATOM 3658 C CG . GLN C 3 108 ? 7.883 -33.353 -35.231 1.00 65.11 ? 111 GLN C CG 1 ATOM 3659 N N . LEU C 3 109 ? 4.131 -33.146 -34.621 1.00 57.41 ? 112 LEU C N 1 ATOM 3660 C CA . LEU C 3 109 ? 3.310 -32.535 -33.576 1.00 57.94 ? 112 LEU C CA 1 ATOM 3661 C C . LEU C 3 109 ? 3.971 -32.606 -32.198 1.00 59.85 ? 112 LEU C C 1 ATOM 3662 O O . LEU C 3 109 ? 4.115 -33.692 -31.632 1.00 59.89 ? 112 LEU C O 1 ATOM 3663 C CB . LEU C 3 109 ? 1.919 -33.181 -33.524 1.00 56.37 ? 112 LEU C CB 1 ATOM 3664 C CG . LEU C 3 109 ? 0.950 -32.684 -32.441 1.00 57.69 ? 112 LEU C CG 1 ATOM 3665 C CD1 . LEU C 3 109 ? 0.390 -31.305 -32.775 1.00 58.48 ? 112 LEU C CD1 1 ATOM 3666 C CD2 . LEU C 3 109 ? -0.178 -33.679 -32.241 1.00 57.65 ? 112 LEU C CD2 1 ATOM 3667 N N . ILE C 3 110 ? 4.354 -31.449 -31.661 1.00 62.09 ? 113 ILE C N 1 ATOM 3668 C CA . ILE C 3 110 ? 4.962 -31.382 -30.333 1.00 64.46 ? 113 ILE C CA 1 ATOM 3669 C C . ILE C 3 110 ? 3.945 -30.905 -29.309 1.00 65.36 ? 113 ILE C C 1 ATOM 3670 O O . ILE C 3 110 ? 3.344 -29.845 -29.476 1.00 66.55 ? 113 ILE C O 1 ATOM 3671 C CB . ILE C 3 110 ? 6.194 -30.449 -30.310 1.00 68.10 ? 113 ILE C CB 1 ATOM 3672 N N . VAL C 3 111 ? 3.744 -31.696 -28.258 1.00 65.66 ? 114 VAL C N 1 ATOM 3673 C CA . VAL C 3 111 ? 2.805 -31.331 -27.192 1.00 67.44 ? 114 VAL C CA 1 ATOM 3674 C C . VAL C 3 111 ? 3.541 -30.986 -25.889 1.00 71.18 ? 114 VAL C C 1 ATOM 3675 O O . VAL C 3 111 ? 4.179 -31.845 -25.266 1.00 72.26 ? 114 VAL C O 1 ATOM 3676 C CB . VAL C 3 111 ? 1.746 -32.428 -26.942 1.00 66.35 ? 114 VAL C CB 1 ATOM 3677 C CG1 . VAL C 3 111 ? 0.895 -32.077 -25.759 1.00 69.80 ? 114 VAL C CG1 1 ATOM 3678 C CG2 . VAL C 3 111 ? 0.866 -32.593 -28.142 1.00 63.79 ? 114 VAL C CG2 1 ATOM 3679 N N . ILE C 3 112 ? 3.452 -29.715 -25.503 1.00 73.78 ? 115 ILE C N 1 ATOM 3680 C CA . ILE C 3 112 ? 4.020 -29.217 -24.256 1.00 77.74 ? 115 ILE C CA 1 ATOM 3681 C C . ILE C 3 112 ? 3.105 -29.565 -23.077 1.00 79.56 ? 115 ILE C C 1 ATOM 3682 O O . ILE C 3 112 ? 1.878 -29.474 -23.197 1.00 79.43 ? 115 ILE C O 1 ATOM 3683 C CB . ILE C 3 112 ? 4.269 -27.686 -24.312 1.00 81.16 ? 115 ILE C CB 1 ATOM 3684 C CG1 . ILE C 3 112 ? 3.077 -26.956 -24.944 1.00 80.80 ? 115 ILE C CG1 1 ATOM 3685 C CG2 . ILE C 3 112 ? 5.537 -27.388 -25.096 1.00 81.69 ? 115 ILE C CG2 1 ATOM 3686 C CD1 . ILE C 3 112 ? 3.017 -25.469 -24.648 1.00 86.09 ? 115 ILE C CD1 1 ATOM 3687 N N . PRO C 3 113 ? 3.692 -29.983 -21.940 1.00 82.13 ? 116 PRO C N 1 ATOM 3688 C CA . PRO C 3 113 ? 2.860 -30.314 -20.795 1.00 84.80 ? 116 PRO C CA 1 ATOM 3689 C C . PRO C 3 113 ? 2.503 -29.073 -19.987 1.00 89.33 ? 116 PRO C C 1 ATOM 3690 O O . PRO C 3 113 ? 3.349 -28.198 -19.791 1.00 91.81 ? 116 PRO C O 1 ATOM 3691 C CB . PRO C 3 113 ? 3.752 -31.249 -19.983 1.00 86.59 ? 116 PRO C CB 1 ATOM 3692 C CG . PRO C 3 113 ? 5.123 -30.805 -20.288 1.00 87.08 ? 116 PRO C CG 1 ATOM 3693 C CD . PRO C 3 113 ? 5.120 -30.230 -21.671 1.00 83.69 ? 116 PRO C CD 1 ATOM 3694 N N . ASP C 3 114 ? 1.252 -28.997 -19.538 1.00 91.36 ? 117 ASP C N 1 ATOM 3695 C CA . ASP C 3 114 ? 0.799 -27.903 -18.682 1.00 96.67 ? 117 ASP C CA 1 ATOM 3696 C C . ASP C 3 114 ? 1.267 -28.133 -17.248 1.00 101.14 ? 117 ASP C C 1 ATOM 3697 O O . ASP C 3 114 ? 0.843 -29.085 -16.592 1.00 102.36 ? 117 ASP C O 1 ATOM 3698 C CB . ASP C 3 114 ? -0.727 -27.758 -18.739 1.00 98.34 ? 117 ASP C CB 1 ATOM 3699 C CG . ASP C 3 114 ? -1.250 -26.664 -17.820 0.70 105.16 ? 117 ASP C CG 1 ATOM 3700 O OD1 . ASP C 3 114 ? -0.587 -25.612 -17.689 0.70 107.61 ? 117 ASP C OD1 1 ATOM 3701 O OD2 . ASP C 3 114 ? -2.332 -26.857 -17.228 0.70 109.27 ? 117 ASP C OD2 1 ATOM 3702 N N . ILE C 3 115 ? 2.150 -27.259 -16.776 1.00 78.98 ? 118 ILE C N 1 ATOM 3703 C CA . ILE C 3 115 ? 2.686 -27.359 -15.424 1.00 74.95 ? 118 ILE C CA 1 ATOM 3704 C C . ILE C 3 115 ? 1.950 -26.395 -14.499 1.00 78.38 ? 118 ILE C C 1 ATOM 3705 O O . ILE C 3 115 ? 1.967 -25.177 -14.705 1.00 80.30 ? 118 ILE C O 1 ATOM 3706 C CB . ILE C 3 115 ? 4.212 -27.090 -15.381 1.00 69.24 ? 118 ILE C CB 1 ATOM 3707 C CG1 . ILE C 3 115 ? 4.958 -27.929 -16.427 1.00 66.62 ? 118 ILE C CG1 1 ATOM 3708 C CG2 . ILE C 3 115 ? 4.766 -27.340 -13.981 1.00 66.24 ? 118 ILE C CG2 1 ATOM 3709 C CD1 . ILE C 3 115 ? 4.808 -29.434 -16.270 1.00 65.86 ? 118 ILE C CD1 1 ATOM 3710 N N . GLN C 3 116 ? 1.296 -26.956 -13.486 1.00 79.88 ? 119 GLN C N 1 ATOM 3711 C CA . GLN C 3 116 ? 0.511 -26.165 -12.545 1.00 84.12 ? 119 GLN C CA 1 ATOM 3712 C C . GLN C 3 116 ? 1.417 -25.452 -11.549 1.00 81.09 ? 119 GLN C C 1 ATOM 3713 O O . GLN C 3 116 ? 1.284 -24.247 -11.331 1.00 83.98 ? 119 GLN C O 1 ATOM 3714 C CB . GLN C 3 116 ? -0.513 -27.043 -11.819 1.00 87.59 ? 119 GLN C CB 1 ATOM 3715 N N . ASN C 3 117 ? 2.344 -26.200 -10.958 1.00 76.10 ? 120 ASN C N 1 ATOM 3716 C CA . ASN C 3 117 ? 3.279 -25.639 -9.996 1.00 73.57 ? 120 ASN C CA 1 ATOM 3717 C C . ASN C 3 117 ? 4.732 -25.757 -10.459 1.00 67.91 ? 120 ASN C C 1 ATOM 3718 O O . ASN C 3 117 ? 5.367 -26.804 -10.291 1.00 64.29 ? 120 ASN C O 1 ATOM 3719 C CB . ASN C 3 117 ? 3.072 -26.276 -8.624 1.00 74.37 ? 120 ASN C CB 1 ATOM 3720 C CG . ASN C 3 117 ? 1.639 -26.164 -8.147 1.00 80.68 ? 120 ASN C CG 1 ATOM 3721 O OD1 . ASN C 3 117 ? 1.126 -25.065 -7.934 1.00 84.75 ? 120 ASN C OD1 1 ATOM 3722 N ND2 . ASN C 3 117 ? 0.980 -27.306 -7.981 1.00 82.46 ? 120 ASN C ND2 1 ATOM 3723 N N . PRO C 3 118 ? 5.255 -24.678 -11.067 1.00 67.84 ? 121 PRO C N 1 ATOM 3724 C CA . PRO C 3 118 ? 6.644 -24.648 -11.496 1.00 63.52 ? 121 PRO C CA 1 ATOM 3725 C C . PRO C 3 118 ? 7.580 -24.461 -10.306 1.00 61.77 ? 121 PRO C C 1 ATOM 3726 O O . PRO C 3 118 ? 7.258 -23.726 -9.372 1.00 64.75 ? 121 PRO C O 1 ATOM 3727 C CB . PRO C 3 118 ? 6.709 -23.424 -12.425 1.00 65.82 ? 121 PRO C CB 1 ATOM 3728 C CG . PRO C 3 118 ? 5.294 -22.974 -12.624 1.00 71.31 ? 121 PRO C CG 1 ATOM 3729 C CD . PRO C 3 118 ? 4.551 -23.435 -11.424 1.00 72.78 ? 121 PRO C CD 1 ATOM 3730 N N . ASP C 3 119 ? 8.727 -25.132 -10.352 1.00 57.78 ? 122 ASP C N 1 ATOM 3731 C CA . ASP C 3 119 ? 9.751 -25.028 -9.316 1.00 56.41 ? 122 ASP C CA 1 ATOM 3732 C C . ASP C 3 119 ? 11.136 -24.842 -9.965 1.00 53.44 ? 122 ASP C C 1 ATOM 3733 O O . ASP C 3 119 ? 11.997 -25.713 -9.843 1.00 50.69 ? 122 ASP C O 1 ATOM 3734 C CB . ASP C 3 119 ? 9.713 -26.283 -8.431 1.00 55.35 ? 122 ASP C CB 1 ATOM 3735 C CG . ASP C 3 119 ? 10.428 -26.099 -7.099 0.70 56.31 ? 122 ASP C CG 1 ATOM 3736 O OD1 . ASP C 3 119 ? 10.970 -25.003 -6.832 0.70 58.51 ? 122 ASP C OD1 1 ATOM 3737 O OD2 . ASP C 3 119 ? 10.445 -27.065 -6.308 0.70 56.40 ? 122 ASP C OD2 1 ATOM 3738 N N . PRO C 3 120 ? 11.357 -23.701 -10.653 1.00 54.88 ? 123 PRO C N 1 ATOM 3739 C CA . PRO C 3 120 ? 12.579 -23.470 -11.445 1.00 53.02 ? 123 PRO C CA 1 ATOM 3740 C C . PRO C 3 120 ? 13.862 -23.673 -10.636 1.00 51.33 ? 123 PRO C C 1 ATOM 3741 O O . PRO C 3 120 ? 14.132 -22.914 -9.700 1.00 53.55 ? 123 PRO C O 1 ATOM 3742 C CB . PRO C 3 120 ? 12.454 -22.003 -11.864 1.00 56.73 ? 123 PRO C CB 1 ATOM 3743 C CG . PRO C 3 120 ? 11.010 -21.695 -11.754 1.00 60.11 ? 123 PRO C CG 1 ATOM 3744 C CD . PRO C 3 120 ? 10.513 -22.494 -10.603 1.00 59.31 ? 123 PRO C CD 1 ATOM 3745 N N . ALA C 3 121 ? 14.632 -24.700 -10.990 1.00 48.02 ? 124 ALA C N 1 ATOM 3746 C CA . ALA C 3 121 ? 15.821 -25.069 -10.223 1.00 46.89 ? 124 ALA C CA 1 ATOM 3747 C C . ALA C 3 121 ? 16.924 -25.645 -11.104 1.00 44.81 ? 124 ALA C C 1 ATOM 3748 O O . ALA C 3 121 ? 16.644 -26.235 -12.143 1.00 43.73 ? 124 ALA C O 1 ATOM 3749 C CB . ALA C 3 121 ? 15.452 -26.045 -9.134 1.00 46.36 ? 124 ALA C CB 1 ATOM 3750 N N . VAL C 3 122 ? 18.176 -25.453 -10.689 1.00 45.29 ? 125 VAL C N 1 ATOM 3751 C CA . VAL C 3 122 ? 19.337 -25.958 -11.430 1.00 44.21 ? 125 VAL C CA 1 ATOM 3752 C C . VAL C 3 122 ? 20.333 -26.673 -10.525 1.00 44.21 ? 125 VAL C C 1 ATOM 3753 O O . VAL C 3 122 ? 21.243 -26.059 -9.982 1.00 46.16 ? 125 VAL C O 1 ATOM 3754 C CB . VAL C 3 122 ? 20.099 -24.845 -12.163 1.00 46.12 ? 125 VAL C CB 1 ATOM 3755 C CG1 . VAL C 3 122 ? 21.031 -25.469 -13.184 1.00 45.68 ? 125 VAL C CG1 1 ATOM 3756 C CG2 . VAL C 3 122 ? 19.147 -23.853 -12.822 1.00 47.38 ? 125 VAL C CG2 1 ATOM 3757 N N . TYR C 3 123 ? 20.166 -27.980 -10.385 1.00 43.00 ? 126 TYR C N 1 ATOM 3758 C CA . TYR C 3 123 ? 21.008 -28.777 -9.502 1.00 43.74 ? 126 TYR C CA 1 ATOM 3759 C C . TYR C 3 123 ? 22.315 -29.220 -10.177 1.00 44.12 ? 126 TYR C C 1 ATOM 3760 O O . TYR C 3 123 ? 22.384 -29.316 -11.403 1.00 43.11 ? 126 TYR C O 1 ATOM 3761 C CB . TYR C 3 123 ? 20.213 -29.984 -9.008 1.00 43.11 ? 126 TYR C CB 1 ATOM 3762 C CG . TYR C 3 123 ? 18.837 -29.635 -8.483 1.00 43.28 ? 126 TYR C CG 1 ATOM 3763 C CD1 . TYR C 3 123 ? 18.671 -29.045 -7.233 1.00 45.82 ? 126 TYR C CD1 1 ATOM 3764 C CD2 . TYR C 3 123 ? 17.702 -29.890 -9.238 1.00 42.19 ? 126 TYR C CD2 1 ATOM 3765 C CE1 . TYR C 3 123 ? 17.403 -28.715 -6.750 1.00 46.62 ? 126 TYR C CE1 1 ATOM 3766 C CE2 . TYR C 3 123 ? 16.432 -29.564 -8.765 1.00 43.21 ? 126 TYR C CE2 1 ATOM 3767 C CZ . TYR C 3 123 ? 16.290 -28.985 -7.519 1.00 45.31 ? 126 TYR C CZ 1 ATOM 3768 O OH . TYR C 3 123 ? 15.032 -28.672 -7.055 1.00 46.54 ? 126 TYR C OH 1 ATOM 3769 N N . GLN C 3 124 ? 23.351 -29.467 -9.376 1.00 46.45 ? 127 GLN C N 1 ATOM 3770 C CA . GLN C 3 124 ? 24.613 -30.011 -9.887 1.00 48.12 ? 127 GLN C CA 1 ATOM 3771 C C . GLN C 3 124 ? 24.775 -31.469 -9.484 1.00 48.72 ? 127 GLN C C 1 ATOM 3772 O O . GLN C 3 124 ? 24.779 -31.789 -8.300 1.00 50.61 ? 127 GLN C O 1 ATOM 3773 C CB . GLN C 3 124 ? 25.816 -29.209 -9.390 1.00 51.44 ? 127 GLN C CB 1 ATOM 3774 C CG . GLN C 3 124 ? 27.153 -29.726 -9.929 1.00 54.68 ? 127 GLN C CG 1 ATOM 3775 C CD . GLN C 3 124 ? 28.363 -29.115 -9.234 1.00 60.52 ? 127 GLN C CD 1 ATOM 3776 O OE1 . GLN C 3 124 ? 29.250 -29.834 -8.758 1.00 63.34 ? 127 GLN C OE1 1 ATOM 3777 N NE2 . GLN C 3 124 ? 28.407 -27.782 -9.173 1.00 62.28 ? 127 GLN C NE2 1 ATOM 3778 N N . LEU C 3 125 ? 24.919 -32.344 -10.472 1.00 48.16 ? 128 LEU C N 1 ATOM 3779 C CA . LEU C 3 125 ? 25.007 -33.777 -10.221 1.00 49.54 ? 128 LEU C CA 1 ATOM 3780 C C . LEU C 3 125 ? 26.423 -34.264 -10.487 1.00 52.52 ? 128 LEU C C 1 ATOM 3781 O O . LEU C 3 125 ? 27.093 -33.770 -11.389 1.00 52.96 ? 128 LEU C O 1 ATOM 3782 C CB . LEU C 3 125 ? 23.997 -34.537 -11.087 1.00 47.97 ? 128 LEU C CB 1 ATOM 3783 C CG . LEU C 3 125 ? 22.498 -34.277 -10.858 1.00 46.10 ? 128 LEU C CG 1 ATOM 3784 C CD1 . LEU C 3 125 ? 22.068 -32.899 -11.357 1.00 42.94 ? 128 LEU C CD1 1 ATOM 3785 C CD2 . LEU C 3 125 ? 21.648 -35.371 -11.510 1.00 45.33 ? 128 LEU C CD2 1 ATOM 3786 N N . ARG C 3 126 ? 26.877 -35.229 -9.697 1.00 55.40 ? 129 ARG C N 1 ATOM 3787 C CA . ARG C 3 126 ? 28.257 -35.690 -9.773 1.00 59.24 ? 129 ARG C CA 1 ATOM 3788 C C . ARG C 3 126 ? 28.349 -37.148 -10.198 1.00 61.51 ? 129 ARG C C 1 ATOM 3789 O O . ARG C 3 126 ? 27.423 -37.927 -9.980 1.00 61.07 ? 129 ARG C O 1 ATOM 3790 C CB . ARG C 3 126 ? 28.979 -35.460 -8.438 1.00 62.72 ? 129 ARG C CB 1 ATOM 3791 C CG . ARG C 3 126 ? 29.203 -33.985 -8.108 1.00 61.96 ? 129 ARG C CG 1 ATOM 3792 C CD . ARG C 3 126 ? 30.526 -33.755 -7.401 1.00 66.51 ? 129 ARG C CD 1 ATOM 3793 N NE . ARG C 3 126 ? 30.978 -32.376 -7.549 1.00 66.47 ? 129 ARG C NE 1 ATOM 3794 N N . ASP C 3 127 ? 29.479 -37.507 -10.798 1.00 64.78 ? 130 ASP C N 1 ATOM 3795 C CA . ASP C 3 127 ? 29.657 -38.827 -11.395 1.00 67.83 ? 130 ASP C CA 1 ATOM 3796 C C . ASP C 3 127 ? 29.718 -39.944 -10.359 1.00 71.78 ? 130 ASP C C 1 ATOM 3797 O O . ASP C 3 127 ? 30.029 -39.709 -9.195 1.00 73.66 ? 130 ASP C O 1 ATOM 3798 C CB . ASP C 3 127 ? 30.917 -38.843 -12.262 1.00 71.28 ? 130 ASP C CB 1 ATOM 3799 C CG . ASP C 3 127 ? 30.946 -40.007 -13.230 1.00 74.30 ? 130 ASP C CG 1 ATOM 3800 O OD1 . ASP C 3 127 ? 29.868 -40.566 -13.522 1.00 73.16 ? 130 ASP C OD1 1 ATOM 3801 O OD2 . ASP C 3 127 ? 32.046 -40.365 -13.700 1.00 79.19 ? 130 ASP C OD2 1 ATOM 3802 N N . SER C 3 128 ? 29.412 -41.161 -10.791 1.00 74.07 ? 131 SER C N 1 ATOM 3803 C CA . SER C 3 128 ? 29.476 -42.327 -9.918 1.00 78.96 ? 131 SER C CA 1 ATOM 3804 C C . SER C 3 128 ? 30.898 -42.856 -9.770 1.00 85.34 ? 131 SER C C 1 ATOM 3805 O O . SER C 3 128 ? 31.202 -43.540 -8.799 1.00 90.25 ? 131 SER C O 1 ATOM 3806 C CB . SER C 3 128 ? 28.561 -43.438 -10.440 1.00 80.00 ? 131 SER C CB 1 ATOM 3807 O OG . SER C 3 128 ? 27.205 -43.030 -10.438 1.00 74.95 ? 131 SER C OG 1 ATOM 3808 N N . LYS C 3 129 ? 31.761 -42.539 -10.733 1.00 86.11 ? 132 LYS C N 1 ATOM 3809 C CA . LYS C 3 129 ? 33.136 -43.045 -10.739 1.00 93.05 ? 132 LYS C CA 1 ATOM 3810 C C . LYS C 3 129 ? 34.195 -41.995 -10.363 1.00 94.02 ? 132 LYS C C 1 ATOM 3811 O O . LYS C 3 129 ? 35.044 -42.247 -9.499 1.00 99.59 ? 132 LYS C O 1 ATOM 3812 C CB . LYS C 3 129 ? 33.475 -43.699 -12.086 1.00 95.70 ? 132 LYS C CB 1 ATOM 3813 C CG . LYS C 3 129 ? 33.012 -45.140 -12.215 1.00 99.70 ? 132 LYS C CG 1 ATOM 3814 N N . SER C 3 130 ? 34.146 -40.831 -11.009 1.00 89.45 ? 133 SER C N 1 ATOM 3815 C CA . SER C 3 130 ? 35.141 -39.780 -10.777 1.00 90.83 ? 133 SER C CA 1 ATOM 3816 C C . SER C 3 130 ? 34.483 -38.450 -10.435 1.00 85.03 ? 133 SER C C 1 ATOM 3817 O O . SER C 3 130 ? 33.974 -37.757 -11.322 1.00 80.57 ? 133 SER C O 1 ATOM 3818 C CB . SER C 3 130 ? 36.058 -39.618 -11.996 1.00 93.40 ? 133 SER C CB 1 ATOM 3819 O OG . SER C 3 130 ? 35.373 -39.009 -13.081 1.00 88.06 ? 133 SER C OG 1 ATOM 3820 N N . SER C 3 131 ? 34.510 -38.098 -9.148 1.00 85.93 ? 134 SER C N 1 ATOM 3821 C CA . SER C 3 131 ? 33.889 -36.867 -8.642 1.00 81.58 ? 134 SER C CA 1 ATOM 3822 C C . SER C 3 131 ? 34.343 -35.606 -9.384 1.00 80.13 ? 134 SER C C 1 ATOM 3823 O O . SER C 3 131 ? 33.704 -34.554 -9.287 1.00 76.32 ? 134 SER C O 1 ATOM 3824 C CB . SER C 3 131 ? 34.155 -36.711 -7.146 1.00 85.16 ? 134 SER C CB 1 ATOM 3825 O OG . SER C 3 131 ? 35.545 -36.621 -6.886 1.00 91.60 ? 134 SER C OG 1 ATOM 3826 N N . ASP C 3 132 ? 35.442 -35.722 -10.124 1.00 83.79 ? 135 ASP C N 1 ATOM 3827 C CA . ASP C 3 132 ? 35.935 -34.621 -10.940 1.00 83.47 ? 135 ASP C CA 1 ATOM 3828 C C . ASP C 3 132 ? 34.903 -34.191 -11.982 1.00 77.39 ? 135 ASP C C 1 ATOM 3829 O O . ASP C 3 132 ? 34.759 -33.001 -12.250 1.00 75.78 ? 135 ASP C O 1 ATOM 3830 C CB . ASP C 3 132 ? 37.285 -34.965 -11.594 1.00 89.54 ? 135 ASP C CB 1 ATOM 3831 C CG . ASP C 3 132 ? 37.243 -36.255 -12.390 1.00 90.47 ? 135 ASP C CG 1 ATOM 3832 N N . LYS C 3 133 ? 34.172 -35.160 -12.533 1.00 74.95 ? 136 LYS C N 1 ATOM 3833 C CA . LYS C 3 133 ? 33.197 -34.916 -13.605 1.00 70.21 ? 136 LYS C CA 1 ATOM 3834 C C . LYS C 3 133 ? 31.763 -34.694 -13.094 1.00 64.81 ? 136 LYS C C 1 ATOM 3835 O O . LYS C 3 133 ? 31.229 -35.508 -12.335 1.00 64.32 ? 136 LYS C O 1 ATOM 3836 C CB . LYS C 3 133 ? 33.238 -36.062 -14.627 1.00 71.77 ? 136 LYS C CB 1 ATOM 3837 N N . SER C 3 134 ? 31.146 -33.594 -13.523 1.00 61.39 ? 137 SER C N 1 ATOM 3838 C CA . SER C 3 134 ? 29.781 -33.262 -13.110 1.00 57.15 ? 137 SER C CA 1 ATOM 3839 C C . SER C 3 134 ? 28.925 -32.649 -14.231 1.00 54.16 ? 137 SER C C 1 ATOM 3840 O O . SER C 3 134 ? 29.441 -32.312 -15.298 1.00 55.75 ? 137 SER C O 1 ATOM 3841 C CB . SER C 3 134 ? 29.820 -32.316 -11.912 1.00 57.35 ? 137 SER C CB 1 ATOM 3842 O OG . SER C 3 134 ? 30.159 -31.002 -12.315 1.00 58.35 ? 137 SER C OG 1 ATOM 3843 N N . VAL C 3 135 ? 27.620 -32.511 -13.982 1.00 50.70 ? 138 VAL C N 1 ATOM 3844 C CA . VAL C 3 135 ? 26.705 -31.819 -14.910 1.00 48.56 ? 138 VAL C CA 1 ATOM 3845 C C . VAL C 3 135 ? 25.846 -30.750 -14.214 1.00 46.63 ? 138 VAL C C 1 ATOM 3846 O O . VAL C 3 135 ? 25.949 -30.570 -13.002 1.00 46.89 ? 138 VAL C O 1 ATOM 3847 C CB . VAL C 3 135 ? 25.779 -32.808 -15.661 1.00 47.45 ? 138 VAL C CB 1 ATOM 3848 C CG1 . VAL C 3 135 ? 26.568 -33.633 -16.651 1.00 50.13 ? 138 VAL C CG1 1 ATOM 3849 C CG2 . VAL C 3 135 ? 25.026 -33.697 -14.685 1.00 46.40 ? 138 VAL C CG2 1 ATOM 3850 N N . CYS C 3 136 ? 25.013 -30.050 -14.989 1.00 45.61 ? 139 CYS C N 1 ATOM 3851 C CA . CYS C 3 136 ? 24.012 -29.097 -14.462 1.00 44.83 ? 139 CYS C CA 1 ATOM 3852 C C . CYS C 3 136 ? 22.629 -29.431 -14.981 1.00 42.75 ? 139 CYS C C 1 ATOM 3853 O O . CYS C 3 136 ? 22.416 -29.453 -16.190 1.00 43.26 ? 139 CYS C O 1 ATOM 3854 C CB . CYS C 3 136 ? 24.325 -27.659 -14.891 1.00 46.67 ? 139 CYS C CB 1 ATOM 3855 S SG . CYS C 3 136 ? 26.043 -27.199 -14.744 1.00 52.63 ? 139 CYS C SG 1 ATOM 3856 N N . LEU C 3 137 ? 21.681 -29.651 -14.079 1.00 41.40 ? 140 LEU C N 1 ATOM 3857 C CA . LEU C 3 137 ? 20.326 -30.026 -14.485 1.00 40.58 ? 140 LEU C CA 1 ATOM 3858 C C . LEU C 3 137 ? 19.319 -28.896 -14.274 1.00 40.87 ? 140 LEU C C 1 ATOM 3859 O O . LEU C 3 137 ? 18.983 -28.571 -13.138 1.00 41.08 ? 140 LEU C O 1 ATOM 3860 C CB . LEU C 3 137 ? 19.882 -31.280 -13.728 1.00 40.01 ? 140 LEU C CB 1 ATOM 3861 C CG . LEU C 3 137 ? 18.465 -31.797 -13.929 1.00 39.43 ? 140 LEU C CG 1 ATOM 3862 C CD1 . LEU C 3 137 ? 18.374 -32.491 -15.263 1.00 41.46 ? 140 LEU C CD1 1 ATOM 3863 C CD2 . LEU C 3 137 ? 18.103 -32.747 -12.823 1.00 38.99 ? 140 LEU C CD2 1 ATOM 3864 N N . PHE C 3 138 ? 18.847 -28.292 -15.360 1.00 41.69 ? 141 PHE C N 1 ATOM 3865 C CA . PHE C 3 138 ? 17.814 -27.272 -15.246 1.00 42.83 ? 141 PHE C CA 1 ATOM 3866 C C . PHE C 3 138 ? 16.483 -27.968 -15.291 1.00 43.05 ? 141 PHE C C 1 ATOM 3867 O O . PHE C 3 138 ? 16.160 -28.623 -16.278 1.00 43.77 ? 141 PHE C O 1 ATOM 3868 C CB . PHE C 3 138 ? 17.905 -26.241 -16.371 1.00 44.89 ? 141 PHE C CB 1 ATOM 3869 C CG . PHE C 3 138 ? 16.835 -25.181 -16.318 1.00 46.03 ? 141 PHE C CG 1 ATOM 3870 C CD1 . PHE C 3 138 ? 16.516 -24.546 -15.123 1.00 45.72 ? 141 PHE C CD1 1 ATOM 3871 C CD2 . PHE C 3 138 ? 16.163 -24.805 -17.469 1.00 47.98 ? 141 PHE C CD2 1 ATOM 3872 C CE1 . PHE C 3 138 ? 15.532 -23.564 -15.071 1.00 48.34 ? 141 PHE C CE1 1 ATOM 3873 C CE2 . PHE C 3 138 ? 15.179 -23.820 -17.428 1.00 51.14 ? 141 PHE C CE2 1 ATOM 3874 C CZ . PHE C 3 138 ? 14.864 -23.197 -16.219 1.00 50.75 ? 141 PHE C CZ 1 ATOM 3875 N N . THR C 3 139 ? 15.702 -27.821 -14.229 1.00 43.46 ? 142 THR C N 1 ATOM 3876 C CA . THR C 3 139 ? 14.512 -28.642 -14.085 1.00 44.06 ? 142 THR C CA 1 ATOM 3877 C C . THR C 3 139 ? 13.332 -27.967 -13.383 1.00 45.85 ? 142 THR C C 1 ATOM 3878 O O . THR C 3 139 ? 13.496 -26.961 -12.701 1.00 46.58 ? 142 THR C O 1 ATOM 3879 C CB . THR C 3 139 ? 14.868 -29.980 -13.402 1.00 42.81 ? 142 THR C CB 1 ATOM 3880 O OG1 . THR C 3 139 ? 13.695 -30.792 -13.287 1.00 44.82 ? 142 THR C OG1 1 ATOM 3881 C CG2 . THR C 3 139 ? 15.442 -29.737 -12.037 1.00 42.07 ? 142 THR C CG2 1 ATOM 3882 N N . ASP C 3 140 ? 12.150 -28.554 -13.582 1.00 47.54 ? 143 ASP C N 1 ATOM 3883 C CA . ASP C 3 140 ? 10.873 -28.123 -12.996 1.00 50.25 ? 143 ASP C CA 1 ATOM 3884 C C . ASP C 3 140 ? 10.412 -26.731 -13.434 1.00 52.80 ? 143 ASP C C 1 ATOM 3885 O O . ASP C 3 140 ? 9.801 -26.003 -12.655 1.00 54.97 ? 143 ASP C O 1 ATOM 3886 C CB . ASP C 3 140 ? 10.892 -28.251 -11.468 1.00 50.26 ? 143 ASP C CB 1 ATOM 3887 C CG . ASP C 3 140 ? 11.031 -29.689 -11.002 0.70 50.02 ? 143 ASP C CG 1 ATOM 3888 O OD1 . ASP C 3 140 ? 10.344 -30.568 -11.570 0.70 51.56 ? 143 ASP C OD1 1 ATOM 3889 O OD2 . ASP C 3 140 ? 11.817 -29.940 -10.057 0.70 49.71 ? 143 ASP C OD2 1 ATOM 3890 N N . PHE C 3 141 ? 10.690 -26.375 -14.684 1.00 53.35 ? 144 PHE C N 1 ATOM 3891 C CA . PHE C 3 141 ? 10.285 -25.072 -15.215 1.00 56.89 ? 144 PHE C CA 1 ATOM 3892 C C . PHE C 3 141 ? 8.972 -25.129 -15.995 1.00 60.84 ? 144 PHE C C 1 ATOM 3893 O O . PHE C 3 141 ? 8.566 -26.192 -16.464 1.00 60.80 ? 144 PHE C O 1 ATOM 3894 C CB . PHE C 3 141 ? 11.405 -24.413 -16.043 1.00 56.45 ? 144 PHE C CB 1 ATOM 3895 C CG . PHE C 3 141 ? 12.072 -25.329 -17.042 1.00 54.13 ? 144 PHE C CG 1 ATOM 3896 C CD1 . PHE C 3 141 ? 11.909 -25.121 -18.401 1.00 55.73 ? 144 PHE C CD1 1 ATOM 3897 C CD2 . PHE C 3 141 ? 12.897 -26.379 -16.623 1.00 50.51 ? 144 PHE C CD2 1 ATOM 3898 C CE1 . PHE C 3 141 ? 12.535 -25.954 -19.324 1.00 54.64 ? 144 PHE C CE1 1 ATOM 3899 C CE2 . PHE C 3 141 ? 13.523 -27.215 -17.547 1.00 48.66 ? 144 PHE C CE2 1 ATOM 3900 C CZ . PHE C 3 141 ? 13.342 -27.002 -18.892 1.00 50.55 ? 144 PHE C CZ 1 ATOM 3901 N N . ASP C 3 142 ? 8.302 -23.984 -16.108 1.00 65.25 ? 145 ASP C N 1 ATOM 3902 C CA . ASP C 3 142 ? 7.056 -23.908 -16.861 1.00 70.27 ? 145 ASP C CA 1 ATOM 3903 C C . ASP C 3 142 ? 7.370 -23.921 -18.349 1.00 71.81 ? 145 ASP C C 1 ATOM 3904 O O . ASP C 3 142 ? 8.510 -23.681 -18.752 1.00 69.97 ? 145 ASP C O 1 ATOM 3905 C CB . ASP C 3 142 ? 6.241 -22.663 -16.480 1.00 75.24 ? 145 ASP C CB 1 ATOM 3906 C CG . ASP C 3 142 ? 6.789 -21.387 -17.097 1.00 77.87 ? 145 ASP C CG 1 ATOM 3907 N N . SER C 3 143 ? 6.354 -24.185 -19.161 1.00 76.19 ? 146 SER C N 1 ATOM 3908 C CA . SER C 3 143 ? 6.546 -24.363 -20.592 1.00 78.47 ? 146 SER C CA 1 ATOM 3909 C C . SER C 3 143 ? 6.661 -23.044 -21.368 1.00 83.05 ? 146 SER C C 1 ATOM 3910 O O . SER C 3 143 ? 6.769 -23.046 -22.596 1.00 86.07 ? 146 SER C O 1 ATOM 3911 C CB . SER C 3 143 ? 5.444 -25.261 -21.148 1.00 81.90 ? 146 SER C CB 1 ATOM 3912 O OG . SER C 3 143 ? 5.411 -26.488 -20.434 1.00 78.47 ? 146 SER C OG 1 ATOM 3913 N N . GLN C 3 144 ? 6.653 -21.926 -20.642 1.00 84.43 ? 147 GLN C N 1 ATOM 3914 C CA . GLN C 3 144 ? 6.920 -20.606 -21.224 1.00 89.05 ? 147 GLN C CA 1 ATOM 3915 C C . GLN C 3 144 ? 8.415 -20.409 -21.509 1.00 86.14 ? 147 GLN C C 1 ATOM 3916 O O . GLN C 3 144 ? 8.796 -19.624 -22.380 1.00 89.97 ? 147 GLN C O 1 ATOM 3917 C CB . GLN C 3 144 ? 6.413 -19.497 -20.297 1.00 92.06 ? 147 GLN C CB 1 ATOM 3918 N N . THR C 3 145 ? 9.252 -21.135 -20.771 1.00 80.16 ? 148 THR C N 1 ATOM 3919 C CA . THR C 3 145 ? 10.702 -21.041 -20.911 1.00 77.60 ? 148 THR C CA 1 ATOM 3920 C C . THR C 3 145 ? 11.228 -21.762 -22.155 1.00 77.60 ? 148 THR C C 1 ATOM 3921 O O . THR C 3 145 ? 10.869 -22.914 -22.415 1.00 76.16 ? 148 THR C O 1 ATOM 3922 C CB . THR C 3 145 ? 11.422 -21.610 -19.671 1.00 71.80 ? 148 THR C CB 1 ATOM 3923 O OG1 . THR C 3 145 ? 10.702 -21.243 -18.487 1.00 72.40 ? 148 THR C OG1 1 ATOM 3924 N N . ASN C 3 146 ? 12.069 -21.065 -22.919 1.00 80.07 ? 149 ASN C N 1 ATOM 3925 C CA . ASN C 3 146 ? 12.829 -21.670 -24.012 1.00 80.28 ? 149 ASN C CA 1 ATOM 3926 C C . ASN C 3 146 ? 14.302 -21.839 -23.628 1.00 76.45 ? 149 ASN C C 1 ATOM 3927 O O . ASN C 3 146 ? 14.907 -20.920 -23.070 1.00 76.86 ? 149 ASN C O 1 ATOM 3928 C CB . ASN C 3 146 ? 12.707 -20.833 -25.291 1.00 87.08 ? 149 ASN C CB 1 ATOM 3929 C CG . ASN C 3 146 ? 11.389 -21.054 -26.019 1.00 91.63 ? 149 ASN C CG 1 ATOM 3930 O OD1 . ASN C 3 146 ? 10.945 -22.188 -26.197 1.00 90.15 ? 149 ASN C OD1 1 ATOM 3931 N ND2 . ASN C 3 146 ? 10.765 -19.964 -26.457 1.00 98.05 ? 149 ASN C ND2 1 ATOM 3932 N N . VAL C 3 147 ? 14.861 -23.015 -23.916 1.00 73.53 ? 150 VAL C N 1 ATOM 3933 C CA . VAL C 3 147 ? 16.273 -23.308 -23.648 1.00 70.51 ? 150 VAL C CA 1 ATOM 3934 C C . VAL C 3 147 ? 17.109 -23.040 -24.902 1.00 74.35 ? 150 VAL C C 1 ATOM 3935 O O . VAL C 3 147 ? 17.024 -23.779 -25.881 1.00 76.18 ? 150 VAL C O 1 ATOM 3936 C CB . VAL C 3 147 ? 16.487 -24.780 -23.168 1.00 65.95 ? 150 VAL C CB 1 ATOM 3937 C CG1 . VAL C 3 147 ? 17.963 -25.081 -22.952 1.00 63.87 ? 150 VAL C CG1 1 ATOM 3938 C CG2 . VAL C 3 147 ? 15.722 -25.050 -21.890 1.00 62.77 ? 150 VAL C CG2 1 ATOM 3939 N N . SER C 3 148 ? 17.911 -21.978 -24.864 1.00 76.40 ? 151 SER C N 1 ATOM 3940 C CA . SER C 3 148 ? 18.781 -21.615 -25.981 1.00 80.74 ? 151 SER C CA 1 ATOM 3941 C C . SER C 3 148 ? 20.074 -22.423 -25.956 1.00 78.38 ? 151 SER C C 1 ATOM 3942 O O . SER C 3 148 ? 20.387 -23.074 -24.960 1.00 73.50 ? 151 SER C O 1 ATOM 3943 C CB . SER C 3 148 ? 19.093 -20.117 -25.950 1.00 85.12 ? 151 SER C CB 1 ATOM 3944 O OG . SER C 3 148 ? 17.904 -19.343 -25.939 1.00 88.11 ? 151 SER C OG 1 ATOM 3945 N N . GLN C 3 149 ? 20.816 -22.387 -27.059 1.00 82.64 ? 152 GLN C N 1 ATOM 3946 C CA . GLN C 3 149 ? 22.094 -23.092 -27.151 1.00 81.92 ? 152 GLN C CA 1 ATOM 3947 C C . GLN C 3 149 ? 23.228 -22.249 -26.578 1.00 82.63 ? 152 GLN C C 1 ATOM 3948 O O . GLN C 3 149 ? 23.032 -21.076 -26.251 1.00 84.60 ? 152 GLN C O 1 ATOM 3949 C CB . GLN C 3 149 ? 22.400 -23.496 -28.601 1.00 86.98 ? 152 GLN C CB 1 ATOM 3950 C CG . GLN C 3 149 ? 21.615 -24.715 -29.109 1.00 86.91 ? 152 GLN C CG 1 ATOM 3951 C CD . GLN C 3 149 ? 21.649 -25.904 -28.147 1.00 81.71 ? 152 GLN C CD 1 ATOM 3952 O OE1 . GLN C 3 149 ? 20.601 -26.434 -27.760 1.00 79.36 ? 152 GLN C OE1 1 ATOM 3953 N NE2 . GLN C 3 149 ? 22.854 -26.321 -27.752 1.00 80.36 ? 152 GLN C NE2 1 ATOM 3954 N N . SER C 3 150 ? 24.407 -22.854 -26.450 1.00 81.71 ? 153 SER C N 1 ATOM 3955 C CA . SER C 3 150 ? 25.582 -22.148 -25.951 1.00 83.20 ? 153 SER C CA 1 ATOM 3956 C C . SER C 3 150 ? 26.281 -21.363 -27.057 1.00 90.15 ? 153 SER C C 1 ATOM 3957 O O . SER C 3 150 ? 26.550 -21.898 -28.137 1.00 93.09 ? 153 SER C O 1 ATOM 3958 C CB . SER C 3 150 ? 26.568 -23.125 -25.314 1.00 80.32 ? 153 SER C CB 1 ATOM 3959 O OG . SER C 3 150 ? 27.726 -22.447 -24.857 1.00 82.79 ? 153 SER C OG 1 ATOM 3960 N N . LYS C 3 151 ? 26.576 -20.095 -26.775 1.00 93.41 ? 154 LYS C N 1 ATOM 3961 C CA . LYS C 3 151 ? 27.384 -19.266 -27.668 1.00 100.70 ? 154 LYS C CA 1 ATOM 3962 C C . LYS C 3 151 ? 28.859 -19.671 -27.587 1.00 102.02 ? 154 LYS C C 1 ATOM 3963 O O . LYS C 3 151 ? 29.685 -19.206 -28.379 1.00 108.51 ? 154 LYS C O 1 ATOM 3964 C CB . LYS C 3 151 ? 27.212 -17.784 -27.327 1.00 104.60 ? 154 LYS C CB 1 ATOM 3965 N N . ASP C 3 152 ? 29.169 -20.549 -26.631 1.00 96.46 ? 155 ASP C N 1 ATOM 3966 C CA . ASP C 3 152 ? 30.530 -21.030 -26.391 1.00 97.55 ? 155 ASP C CA 1 ATOM 3967 C C . ASP C 3 152 ? 30.762 -22.437 -26.942 1.00 95.94 ? 155 ASP C C 1 ATOM 3968 O O . ASP C 3 152 ? 29.916 -23.324 -26.792 1.00 91.05 ? 155 ASP C O 1 ATOM 3969 C CB . ASP C 3 152 ? 30.848 -21.007 -24.894 1.00 94.06 ? 155 ASP C CB 1 ATOM 3970 C CG . ASP C 3 152 ? 32.316 -21.252 -24.608 1.00 97.25 ? 155 ASP C CG 1 ATOM 3971 O OD1 . ASP C 3 152 ? 32.664 -22.394 -24.238 1.00 94.45 ? 155 ASP C OD1 1 ATOM 3972 O OD2 . ASP C 3 152 ? 33.122 -20.309 -24.774 1.00 103.40 ? 155 ASP C OD2 1 ATOM 3973 N N . SER C 3 153 ? 31.931 -22.632 -27.550 1.00 100.67 ? 156 SER C N 1 ATOM 3974 C CA . SER C 3 153 ? 32.280 -23.885 -28.226 1.00 101.07 ? 156 SER C CA 1 ATOM 3975 C C . SER C 3 153 ? 32.549 -25.068 -27.286 1.00 96.07 ? 156 SER C C 1 ATOM 3976 O O . SER C 3 153 ? 32.664 -26.210 -27.747 1.00 96.42 ? 156 SER C O 1 ATOM 3977 C CB . SER C 3 153 ? 33.484 -23.670 -29.151 1.00 108.93 ? 156 SER C CB 1 ATOM 3978 N N . ASP C 3 154 ? 32.641 -24.802 -25.983 1.00 92.06 ? 157 ASP C N 1 ATOM 3979 C CA . ASP C 3 154 ? 33.008 -25.840 -25.015 1.00 88.21 ? 157 ASP C CA 1 ATOM 3980 C C . ASP C 3 154 ? 31.901 -26.192 -24.013 1.00 81.04 ? 157 ASP C C 1 ATOM 3981 O O . ASP C 3 154 ? 32.068 -27.089 -23.182 1.00 78.41 ? 157 ASP C O 1 ATOM 3982 C CB . ASP C 3 154 ? 34.299 -25.459 -24.284 1.00 91.45 ? 157 ASP C CB 1 ATOM 3983 N N . VAL C 3 155 ? 30.775 -25.490 -24.096 1.00 78.43 ? 158 VAL C N 1 ATOM 3984 C CA . VAL C 3 155 ? 29.624 -25.788 -23.249 1.00 72.23 ? 158 VAL C CA 1 ATOM 3985 C C . VAL C 3 155 ? 28.562 -26.508 -24.075 1.00 70.46 ? 158 VAL C C 1 ATOM 3986 O O . VAL C 3 155 ? 28.151 -26.019 -25.130 1.00 73.28 ? 158 VAL C O 1 ATOM 3987 C CB . VAL C 3 155 ? 29.014 -24.511 -22.635 1.00 71.49 ? 158 VAL C CB 1 ATOM 3988 C CG1 . VAL C 3 155 ? 27.964 -24.868 -21.592 1.00 66.06 ? 158 VAL C CG1 1 ATOM 3989 C CG2 . VAL C 3 155 ? 30.095 -23.626 -22.029 1.00 74.75 ? 158 VAL C CG2 1 ATOM 3990 N N . TYR C 3 156 ? 28.124 -27.668 -23.597 1.00 66.46 ? 159 TYR C N 1 ATOM 3991 C CA . TYR C 3 156 ? 27.117 -28.444 -24.303 1.00 65.29 ? 159 TYR C CA 1 ATOM 3992 C C . TYR C 3 156 ? 25.807 -28.449 -23.537 1.00 60.71 ? 159 TYR C C 1 ATOM 3993 O O . TYR C 3 156 ? 25.738 -28.966 -22.426 1.00 57.63 ? 159 TYR C O 1 ATOM 3994 C CB . TYR C 3 156 ? 27.588 -29.880 -24.518 1.00 66.18 ? 159 TYR C CB 1 ATOM 3995 C CG . TYR C 3 156 ? 28.951 -30.017 -25.157 1.00 71.07 ? 159 TYR C CG 1 ATOM 3996 C CD1 . TYR C 3 156 ? 29.165 -29.654 -26.486 1.00 75.97 ? 159 TYR C CD1 1 ATOM 3997 C CD2 . TYR C 3 156 ? 30.024 -30.534 -24.436 1.00 71.88 ? 159 TYR C CD2 1 ATOM 3998 C CE1 . TYR C 3 156 ? 30.422 -29.790 -27.076 1.00 81.22 ? 159 TYR C CE1 1 ATOM 3999 C CE2 . TYR C 3 156 ? 31.282 -30.676 -25.014 1.00 77.07 ? 159 TYR C CE2 1 ATOM 4000 C CZ . TYR C 3 156 ? 31.472 -30.303 -26.331 1.00 81.68 ? 159 TYR C CZ 1 ATOM 4001 O OH . TYR C 3 156 ? 32.717 -30.443 -26.897 1.00 87.70 ? 159 TYR C OH 1 ATOM 4002 N N . ILE C 3 157 ? 24.768 -27.879 -24.142 1.00 61.05 ? 160 ILE C N 1 ATOM 4003 C CA . ILE C 3 157 ? 23.433 -27.821 -23.536 1.00 57.43 ? 160 ILE C CA 1 ATOM 4004 C C . ILE C 3 157 ? 22.404 -28.565 -24.401 1.00 58.40 ? 160 ILE C C 1 ATOM 4005 O O . ILE C 3 157 ? 22.310 -28.315 -25.601 1.00 62.23 ? 160 ILE C O 1 ATOM 4006 C CB . ILE C 3 157 ? 22.993 -26.354 -23.343 1.00 57.90 ? 160 ILE C CB 1 ATOM 4007 C CG1 . ILE C 3 157 ? 23.988 -25.613 -22.442 1.00 57.37 ? 160 ILE C CG1 1 ATOM 4008 C CG2 . ILE C 3 157 ? 21.588 -26.283 -22.778 1.00 55.45 ? 160 ILE C CG2 1 ATOM 4009 C CD1 . ILE C 3 157 ? 23.901 -24.095 -22.513 1.00 59.79 ? 160 ILE C CD1 1 ATOM 4010 N N . THR C 3 158 ? 21.641 -29.476 -23.803 1.00 55.72 ? 161 THR C N 1 ATOM 4011 C CA . THR C 3 158 ? 20.567 -30.147 -24.545 1.00 57.64 ? 161 THR C CA 1 ATOM 4012 C C . THR C 3 158 ? 19.287 -29.309 -24.557 1.00 58.18 ? 161 THR C C 1 ATOM 4013 O O . THR C 3 158 ? 19.073 -28.492 -23.665 1.00 56.02 ? 161 THR C O 1 ATOM 4014 C CB . THR C 3 158 ? 20.234 -31.560 -23.995 1.00 55.81 ? 161 THR C CB 1 ATOM 4015 O OG1 . THR C 3 158 ? 19.707 -31.458 -22.672 1.00 51.79 ? 161 THR C OG1 1 ATOM 4016 C CG2 . THR C 3 158 ? 21.459 -32.451 -23.983 1.00 56.57 ? 161 THR C CG2 1 ATOM 4017 N N . ASP C 3 159 ? 18.446 -29.512 -25.573 1.00 62.07 ? 162 ASP C N 1 ATOM 4018 C CA . ASP C 3 159 ? 17.104 -28.915 -25.619 1.00 63.60 ? 162 ASP C CA 1 ATOM 4019 C C . ASP C 3 159 ? 16.187 -29.603 -24.602 1.00 60.85 ? 162 ASP C C 1 ATOM 4020 O O . ASP C 3 159 ? 16.433 -30.753 -24.221 1.00 59.54 ? 162 ASP C O 1 ATOM 4021 C CB . ASP C 3 159 ? 16.514 -29.022 -27.031 1.00 69.20 ? 162 ASP C CB 1 ATOM 4022 C CG . ASP C 3 159 ? 15.328 -28.091 -27.247 1.00 71.95 ? 162 ASP C CG 1 ATOM 4023 N N . LYS C 3 160 ? 15.141 -28.904 -24.160 1.00 60.97 ? 163 LYS C N 1 ATOM 4024 C CA . LYS C 3 160 ? 14.226 -29.437 -23.140 1.00 58.91 ? 163 LYS C CA 1 ATOM 4025 C C . LYS C 3 160 ? 13.625 -30.789 -23.529 1.00 60.96 ? 163 LYS C C 1 ATOM 4026 O O . LYS C 3 160 ? 13.504 -31.124 -24.716 1.00 64.81 ? 163 LYS C O 1 ATOM 4027 C CB . LYS C 3 160 ? 13.127 -28.424 -22.771 1.00 59.91 ? 163 LYS C CB 1 ATOM 4028 C CG . LYS C 3 160 ? 12.101 -28.124 -23.864 1.00 65.00 ? 163 LYS C CG 1 ATOM 4029 N N . CYS C 3 161 ? 13.272 -31.564 -22.510 1.00 58.97 ? 164 CYS C N 1 ATOM 4030 C CA . CYS C 3 161 ? 12.729 -32.897 -22.688 1.00 61.42 ? 164 CYS C CA 1 ATOM 4031 C C . CYS C 3 161 ? 11.838 -33.218 -21.497 1.00 59.98 ? 164 CYS C C 1 ATOM 4032 O O . CYS C 3 161 ? 12.231 -33.009 -20.350 1.00 56.59 ? 164 CYS C O 1 ATOM 4033 C CB . CYS C 3 161 ? 13.868 -33.911 -22.827 1.00 61.05 ? 164 CYS C CB 1 ATOM 4034 S SG . CYS C 3 161 ? 13.402 -35.644 -22.587 1.00 65.08 ? 164 CYS C SG 1 ATOM 4035 N N . VAL C 3 162 ? 10.643 -33.731 -21.781 1.00 63.59 ? 165 VAL C N 1 ATOM 4036 C CA . VAL C 3 162 ? 9.597 -33.932 -20.773 1.00 63.66 ? 165 VAL C CA 1 ATOM 4037 C C . VAL C 3 162 ? 9.536 -35.376 -20.250 1.00 64.40 ? 165 VAL C C 1 ATOM 4038 O O . VAL C 3 162 ? 9.742 -36.327 -21.010 1.00 67.09 ? 165 VAL C O 1 ATOM 4039 C CB . VAL C 3 162 ? 8.212 -33.552 -21.348 1.00 68.27 ? 165 VAL C CB 1 ATOM 4040 C CG1 . VAL C 3 162 ? 7.155 -33.578 -20.269 1.00 68.74 ? 165 VAL C CG1 1 ATOM 4041 C CG2 . VAL C 3 162 ? 8.263 -32.187 -22.001 1.00 69.04 ? 165 VAL C CG2 1 ATOM 4042 N N . LEU C 3 163 ? 9.247 -35.524 -18.953 1.00 62.70 ? 166 LEU C N 1 ATOM 4043 C CA . LEU C 3 163 ? 9.001 -36.838 -18.349 1.00 64.42 ? 166 LEU C CA 1 ATOM 4044 C C . LEU C 3 163 ? 7.731 -36.889 -17.496 1.00 66.56 ? 166 LEU C C 1 ATOM 4045 O O . LEU C 3 163 ? 7.423 -35.949 -16.763 1.00 64.82 ? 166 LEU C O 1 ATOM 4046 C CB . LEU C 3 163 ? 10.212 -37.312 -17.538 1.00 61.20 ? 166 LEU C CB 1 ATOM 4047 C CG . LEU C 3 163 ? 10.542 -36.729 -16.164 1.00 57.58 ? 166 LEU C CG 1 ATOM 4048 C CD1 . LEU C 3 163 ? 9.864 -37.547 -15.089 1.00 59.83 ? 166 LEU C CD1 1 ATOM 4049 C CD2 . LEU C 3 163 ? 12.046 -36.722 -15.934 1.00 54.51 ? 166 LEU C CD2 1 ATOM 4050 N N . ASP C 3 164 ? 7.009 -38.001 -17.605 1.00 71.11 ? 167 ASP C N 1 ATOM 4051 C CA . ASP C 3 164 ? 5.808 -38.251 -16.825 1.00 74.32 ? 167 ASP C CA 1 ATOM 4052 C C . ASP C 3 164 ? 6.127 -39.328 -15.795 1.00 74.60 ? 167 ASP C C 1 ATOM 4053 O O . ASP C 3 164 ? 6.591 -40.415 -16.148 1.00 76.56 ? 167 ASP C O 1 ATOM 4054 C CB . ASP C 3 164 ? 4.673 -38.715 -17.755 1.00 80.98 ? 167 ASP C CB 1 ATOM 4055 C CG . ASP C 3 164 ? 3.282 -38.693 -17.089 1.00 85.50 ? 167 ASP C CG 1 ATOM 4056 O OD1 . ASP C 3 164 ? 3.161 -38.341 -15.891 1.00 84.09 ? 167 ASP C OD1 1 ATOM 4057 O OD2 . ASP C 3 164 ? 2.296 -39.033 -17.785 1.00 91.23 ? 167 ASP C OD2 1 ATOM 4058 N N . MET C 3 165 ? 5.906 -39.013 -14.521 1.00 73.24 ? 168 MET C N 1 ATOM 4059 C CA . MET C 3 165 ? 5.975 -40.009 -13.459 1.00 75.02 ? 168 MET C CA 1 ATOM 4060 C C . MET C 3 165 ? 4.578 -40.587 -13.307 1.00 81.13 ? 168 MET C C 1 ATOM 4061 O O . MET C 3 165 ? 3.692 -39.960 -12.728 1.00 82.31 ? 168 MET C O 1 ATOM 4062 C CB . MET C 3 165 ? 6.494 -39.395 -12.155 1.00 71.44 ? 168 MET C CB 1 ATOM 4063 C CG . MET C 3 165 ? 7.984 -39.065 -12.205 1.00 67.16 ? 168 MET C CG 1 ATOM 4064 S SD . MET C 3 165 ? 8.607 -37.956 -10.917 1.00 64.49 ? 168 MET C SD 1 ATOM 4065 C CE . MET C 3 165 ? 8.802 -39.110 -9.556 1.00 67.19 ? 168 MET C CE 1 ATOM 4066 N N . ARG C 3 166 ? 4.390 -41.781 -13.858 1.00 85.77 ? 169 ARG C N 1 ATOM 4067 C CA . ARG C 3 166 ? 3.060 -42.345 -14.073 1.00 92.87 ? 169 ARG C CA 1 ATOM 4068 C C . ARG C 3 166 ? 2.250 -42.572 -12.794 1.00 96.09 ? 169 ARG C C 1 ATOM 4069 O O . ARG C 3 166 ? 1.049 -42.294 -12.765 1.00 100.24 ? 169 ARG C O 1 ATOM 4070 C CB . ARG C 3 166 ? 3.144 -43.634 -14.899 1.00 98.19 ? 169 ARG C CB 1 ATOM 4071 C CG . ARG C 3 166 ? 3.670 -43.450 -16.323 1.00 97.31 ? 169 ARG C CG 1 ATOM 4072 C CD . ARG C 3 166 ? 3.457 -44.716 -17.133 1.00 105.20 ? 169 ARG C CD 1 ATOM 4073 N NE . ARG C 3 166 ? 4.237 -44.738 -18.369 1.00 105.14 ? 169 ARG C NE 1 ATOM 4074 C CZ . ARG C 3 166 ? 4.125 -45.676 -19.311 1.00 112.26 ? 169 ARG C CZ 1 ATOM 4075 N NH1 . ARG C 3 166 ? 3.258 -46.673 -19.171 1.00 120.29 ? 169 ARG C NH1 1 ATOM 4076 N NH2 . ARG C 3 166 ? 4.877 -45.617 -20.403 1.00 111.97 ? 169 ARG C NH2 1 ATOM 4077 N N . SER C 3 167 ? 2.905 -43.074 -11.747 1.00 94.88 ? 170 SER C N 1 ATOM 4078 C CA . SER C 3 167 ? 2.240 -43.327 -10.464 1.00 98.35 ? 170 SER C CA 1 ATOM 4079 C C . SER C 3 167 ? 1.900 -42.022 -9.746 1.00 95.05 ? 170 SER C C 1 ATOM 4080 O O . SER C 3 167 ? 0.853 -41.910 -9.109 1.00 99.48 ? 170 SER C O 1 ATOM 4081 C CB . SER C 3 167 ? 3.107 -44.209 -9.561 1.00 98.77 ? 170 SER C CB 1 ATOM 4082 O OG . SER C 3 167 ? 4.188 -43.472 -9.010 1.00 92.22 ? 170 SER C OG 1 ATOM 4083 N N . MET C 3 168 ? 2.794 -41.044 -9.864 1.00 87.94 ? 171 MET C N 1 ATOM 4084 C CA . MET C 3 168 ? 2.635 -39.740 -9.225 1.00 84.83 ? 171 MET C CA 1 ATOM 4085 C C . MET C 3 168 ? 1.711 -38.786 -9.980 1.00 85.52 ? 171 MET C C 1 ATOM 4086 O O . MET C 3 168 ? 1.263 -37.783 -9.416 1.00 85.36 ? 171 MET C O 1 ATOM 4087 C CB . MET C 3 168 ? 4.003 -39.085 -9.058 1.00 78.19 ? 171 MET C CB 1 ATOM 4088 C CG . MET C 3 168 ? 4.735 -39.495 -7.805 1.00 78.23 ? 171 MET C CG 1 ATOM 4089 S SD . MET C 3 168 ? 4.110 -38.594 -6.380 1.00 81.09 ? 171 MET C SD 1 ATOM 4090 N N . ASP C 3 169 ? 1.434 -39.102 -11.247 1.00 86.95 ? 172 ASP C N 1 ATOM 4091 C CA . ASP C 3 169 ? 0.701 -38.220 -12.173 1.00 87.85 ? 172 ASP C CA 1 ATOM 4092 C C . ASP C 3 169 ? 1.418 -36.869 -12.313 1.00 81.76 ? 172 ASP C C 1 ATOM 4093 O O . ASP C 3 169 ? 0.799 -35.829 -12.552 1.00 82.74 ? 172 ASP C O 1 ATOM 4094 C CB . ASP C 3 169 ? -0.772 -38.056 -11.752 1.00 94.23 ? 172 ASP C CB 1 ATOM 4095 C CG . ASP C 3 169 ? -1.671 -37.652 -12.908 1.00 97.96 ? 172 ASP C CG 1 ATOM 4096 N N . PHE C 3 170 ? 2.740 -36.914 -12.173 1.00 76.14 ? 173 PHE C N 1 ATOM 4097 C CA . PHE C 3 170 ? 3.582 -35.728 -12.183 1.00 70.77 ? 173 PHE C CA 1 ATOM 4098 C C . PHE C 3 170 ? 4.307 -35.605 -13.512 1.00 68.44 ? 173 PHE C C 1 ATOM 4099 O O . PHE C 3 170 ? 4.783 -36.597 -14.058 1.00 68.78 ? 173 PHE C O 1 ATOM 4100 C CB . PHE C 3 170 ? 4.591 -35.803 -11.032 1.00 67.08 ? 173 PHE C CB 1 ATOM 4101 C CG . PHE C 3 170 ? 5.437 -34.574 -10.878 0.70 62.30 ? 173 PHE C CG 1 ATOM 4102 C CD1 . PHE C 3 170 ? 4.897 -33.399 -10.369 0.70 63.05 ? 173 PHE C CD1 1 ATOM 4103 C CD2 . PHE C 3 170 ? 6.780 -34.596 -11.226 0.70 57.98 ? 173 PHE C CD2 1 ATOM 4104 C CE1 . PHE C 3 170 ? 5.679 -32.260 -10.223 0.70 59.88 ? 173 PHE C CE1 1 ATOM 4105 C CE2 . PHE C 3 170 ? 7.571 -33.464 -11.082 0.70 54.62 ? 173 PHE C CE2 1 ATOM 4106 C CZ . PHE C 3 170 ? 7.020 -32.293 -10.580 0.70 55.79 ? 173 PHE C CZ 1 ATOM 4107 N N . LYS C 3 171 ? 4.381 -34.382 -14.027 1.00 66.99 ? 174 LYS C N 1 ATOM 4108 C CA . LYS C 3 171 ? 5.094 -34.100 -15.269 1.00 65.29 ? 174 LYS C CA 1 ATOM 4109 C C . LYS C 3 171 ? 6.090 -32.956 -15.071 1.00 61.02 ? 174 LYS C C 1 ATOM 4110 O O . LYS C 3 171 ? 5.786 -31.978 -14.382 1.00 61.08 ? 174 LYS C O 1 ATOM 4111 C CB . LYS C 3 171 ? 4.100 -33.779 -16.390 1.00 69.79 ? 174 LYS C CB 1 ATOM 4112 C CG . LYS C 3 171 ? 3.545 -35.013 -17.103 1.00 73.92 ? 174 LYS C CG 1 ATOM 4113 C CD . LYS C 3 171 ? 2.243 -34.728 -17.847 1.00 79.36 ? 174 LYS C CD 1 ATOM 4114 C CE . LYS C 3 171 ? 1.024 -35.107 -17.017 1.00 83.66 ? 174 LYS C CE 1 ATOM 4115 N N . SER C 3 172 ? 7.278 -33.084 -15.661 1.00 58.19 ? 175 SER C N 1 ATOM 4116 C CA . SER C 3 172 ? 8.335 -32.079 -15.484 1.00 54.77 ? 175 SER C CA 1 ATOM 4117 C C . SER C 3 172 ? 9.257 -31.920 -16.693 1.00 53.83 ? 175 SER C C 1 ATOM 4118 O O . SER C 3 172 ? 9.590 -32.905 -17.370 1.00 54.63 ? 175 SER C O 1 ATOM 4119 C CB . SER C 3 172 ? 9.185 -32.404 -14.251 1.00 51.94 ? 175 SER C CB 1 ATOM 4120 O OG . SER C 3 172 ? 10.023 -33.532 -14.480 1.00 50.94 ? 175 SER C OG 1 ATOM 4121 N N . ASN C 3 173 ? 9.674 -30.677 -16.939 1.00 52.81 ? 176 ASN C N 1 ATOM 4122 C CA . ASN C 3 173 ? 10.689 -30.361 -17.940 1.00 51.85 ? 176 ASN C CA 1 ATOM 4123 C C . ASN C 3 173 ? 12.098 -30.504 -17.378 1.00 48.12 ? 176 ASN C C 1 ATOM 4124 O O . ASN C 3 173 ? 12.299 -30.405 -16.164 1.00 46.27 ? 176 ASN C O 1 ATOM 4125 C CB . ASN C 3 173 ? 10.492 -28.938 -18.447 1.00 53.70 ? 176 ASN C CB 1 ATOM 4126 C CG . ASN C 3 173 ? 9.178 -28.750 -19.166 1.00 58.97 ? 176 ASN C CG 1 ATOM 4127 O OD1 . ASN C 3 173 ? 8.582 -29.707 -19.660 1.00 62.26 ? 176 ASN C OD1 1 ATOM 4128 N ND2 . ASN C 3 173 ? 8.717 -27.505 -19.237 1.00 62.05 ? 176 ASN C ND2 1 ATOM 4129 N N . SER C 3 174 ? 13.071 -30.736 -18.259 1.00 47.64 ? 177 SER C N 1 ATOM 4130 C CA . SER C 3 174 ? 14.479 -30.858 -17.855 1.00 45.12 ? 177 SER C CA 1 ATOM 4131 C C . SER C 3 174 ? 15.448 -30.619 -19.007 1.00 45.58 ? 177 SER C C 1 ATOM 4132 O O . SER C 3 174 ? 15.254 -31.147 -20.100 1.00 48.09 ? 177 SER C O 1 ATOM 4133 C CB . SER C 3 174 ? 14.761 -32.229 -17.207 1.00 44.50 ? 177 SER C CB 1 ATOM 4134 O OG . SER C 3 174 ? 14.263 -33.306 -17.989 1.00 46.95 ? 177 SER C OG 1 ATOM 4135 N N . ALA C 3 175 ? 16.484 -29.821 -18.750 1.00 43.97 ? 178 ALA C N 1 ATOM 4136 C CA . ALA C 3 175 ? 17.597 -29.623 -19.686 1.00 44.58 ? 178 ALA C CA 1 ATOM 4137 C C . ALA C 3 175 ? 18.935 -29.859 -18.982 1.00 42.76 ? 178 ALA C C 1 ATOM 4138 O O . ALA C 3 175 ? 19.055 -29.615 -17.780 1.00 41.45 ? 178 ALA C O 1 ATOM 4139 C CB . ALA C 3 175 ? 17.546 -28.234 -20.288 1.00 46.37 ? 178 ALA C CB 1 ATOM 4140 N N . VAL C 3 176 ? 19.936 -30.334 -19.721 1.00 43.46 ? 179 VAL C N 1 ATOM 4141 C CA . VAL C 3 176 ? 21.225 -30.702 -19.122 1.00 42.49 ? 179 VAL C CA 1 ATOM 4142 C C . VAL C 3 176 ? 22.391 -29.951 -19.756 1.00 44.22 ? 179 VAL C C 1 ATOM 4143 O O . VAL C 3 176 ? 22.417 -29.752 -20.969 1.00 46.75 ? 179 VAL C O 1 ATOM 4144 C CB . VAL C 3 176 ? 21.475 -32.239 -19.199 1.00 42.98 ? 179 VAL C CB 1 ATOM 4145 C CG1 . VAL C 3 176 ? 22.871 -32.597 -18.733 1.00 43.36 ? 179 VAL C CG1 1 ATOM 4146 C CG2 . VAL C 3 176 ? 20.461 -32.987 -18.362 1.00 41.78 ? 179 VAL C CG2 1 ATOM 4147 N N . ALA C 3 177 ? 23.353 -29.545 -18.929 1.00 43.70 ? 180 ALA C N 1 ATOM 4148 C CA . ALA C 3 177 ? 24.575 -28.891 -19.407 1.00 46.05 ? 180 ALA C CA 1 ATOM 4149 C C . ALA C 3 177 ? 25.841 -29.454 -18.764 1.00 46.66 ? 180 ALA C C 1 ATOM 4150 O O . ALA C 3 177 ? 25.836 -29.835 -17.596 1.00 45.12 ? 180 ALA C O 1 ATOM 4151 C CB . ALA C 3 177 ? 24.496 -27.391 -19.180 1.00 46.89 ? 180 ALA C CB 1 ATOM 4152 N N . TRP C 3 178 ? 26.922 -29.498 -19.538 1.00 49.70 ? 181 TRP C N 1 ATOM 4153 C CA . TRP C 3 178 ? 28.247 -29.869 -19.034 1.00 51.82 ? 181 TRP C CA 1 ATOM 4154 C C . TRP C 3 178 ? 29.341 -29.222 -19.880 1.00 55.90 ? 181 TRP C C 1 ATOM 4155 O O . TRP C 3 178 ? 29.118 -28.912 -21.050 1.00 57.59 ? 181 TRP C O 1 ATOM 4156 C CB . TRP C 3 178 ? 28.421 -31.394 -18.993 1.00 52.31 ? 181 TRP C CB 1 ATOM 4157 C CG . TRP C 3 178 ? 28.511 -32.033 -20.339 1.00 54.89 ? 181 TRP C CG 1 ATOM 4158 C CD1 . TRP C 3 178 ? 29.645 -32.451 -20.971 1.00 59.13 ? 181 TRP C CD1 1 ATOM 4159 C CD2 . TRP C 3 178 ? 27.424 -32.319 -21.227 1.00 54.58 ? 181 TRP C CD2 1 ATOM 4160 N NE1 . TRP C 3 178 ? 29.334 -32.981 -22.199 1.00 61.68 ? 181 TRP C NE1 1 ATOM 4161 C CE2 . TRP C 3 178 ? 27.977 -32.911 -22.383 1.00 58.90 ? 181 TRP C CE2 1 ATOM 4162 C CE3 . TRP C 3 178 ? 26.035 -32.136 -21.159 1.00 51.34 ? 181 TRP C CE3 1 ATOM 4163 C CZ2 . TRP C 3 178 ? 27.188 -33.323 -23.464 1.00 59.93 ? 181 TRP C CZ2 1 ATOM 4164 C CZ3 . TRP C 3 178 ? 25.254 -32.540 -22.236 1.00 52.25 ? 181 TRP C CZ3 1 ATOM 4165 C CH2 . TRP C 3 178 ? 25.832 -33.126 -23.370 1.00 56.50 ? 181 TRP C CH2 1 ATOM 4166 N N . SER C 3 179 ? 30.515 -29.020 -19.289 1.00 58.24 ? 182 SER C N 1 ATOM 4167 C CA . SER C 3 179 ? 31.627 -28.383 -19.989 1.00 63.05 ? 182 SER C CA 1 ATOM 4168 C C . SER C 3 179 ? 32.945 -29.064 -19.671 1.00 66.68 ? 182 SER C C 1 ATOM 4169 O O . SER C 3 179 ? 33.238 -29.339 -18.511 1.00 66.26 ? 182 SER C O 1 ATOM 4170 C CB . SER C 3 179 ? 31.702 -26.897 -19.631 1.00 64.17 ? 182 SER C CB 1 ATOM 4171 O OG . SER C 3 179 ? 32.952 -26.322 -19.976 1.00 69.58 ? 182 SER C OG 1 ATOM 4172 N N . ASN C 3 180 ? 33.736 -29.330 -20.709 1.00 71.21 ? 183 ASN C N 1 ATOM 4173 C CA . ASN C 3 180 ? 35.081 -29.887 -20.543 1.00 76.04 ? 183 ASN C CA 1 ATOM 4174 C C . ASN C 3 180 ? 35.945 -28.990 -19.657 1.00 78.76 ? 183 ASN C C 1 ATOM 4175 O O . ASN C 3 180 ? 36.667 -29.479 -18.788 1.00 80.68 ? 183 ASN C O 1 ATOM 4176 C CB . ASN C 3 180 ? 35.753 -30.099 -21.904 1.00 81.15 ? 183 ASN C CB 1 ATOM 4177 N N . LYS C 3 181 ? 35.840 -27.680 -19.881 1.00 79.62 ? 184 LYS C N 1 ATOM 4178 C CA . LYS C 3 181 ? 36.551 -26.672 -19.105 1.00 82.86 ? 184 LYS C CA 1 ATOM 4179 C C . LYS C 3 181 ? 35.902 -26.478 -17.744 1.00 79.02 ? 184 LYS C C 1 ATOM 4180 O O . LYS C 3 181 ? 36.121 -27.266 -16.827 1.00 78.56 ? 184 LYS C O 1 ATOM 4181 C CB . LYS C 3 181 ? 36.568 -25.341 -19.855 1.00 85.86 ? 184 LYS C CB 1 ATOM 4182 N N . ASP C 3 183 ? 36.035 -24.430 -14.072 1.00 88.84 ? 186 ASP C N 1 ATOM 4183 C CA . ASP C 3 183 ? 35.844 -23.018 -14.396 1.00 91.08 ? 186 ASP C CA 1 ATOM 4184 C C . ASP C 3 183 ? 34.433 -22.763 -14.931 1.00 85.64 ? 186 ASP C C 1 ATOM 4185 O O . ASP C 3 183 ? 34.085 -21.635 -15.296 1.00 87.36 ? 186 ASP C O 1 ATOM 4186 C CB . ASP C 3 183 ? 36.899 -22.550 -15.407 1.00 96.96 ? 186 ASP C CB 1 ATOM 4187 N N . PHE C 3 184 ? 33.633 -23.824 -14.964 1.00 79.82 ? 187 PHE C N 1 ATOM 4188 C CA . PHE C 3 184 ? 32.260 -23.772 -15.449 1.00 74.73 ? 187 PHE C CA 1 ATOM 4189 C C . PHE C 3 184 ? 31.307 -24.014 -14.288 1.00 70.93 ? 187 PHE C C 1 ATOM 4190 O O . PHE C 3 184 ? 31.231 -25.130 -13.753 1.00 68.60 ? 187 PHE C O 1 ATOM 4191 C CB . PHE C 3 184 ? 32.057 -24.824 -16.544 1.00 72.20 ? 187 PHE C CB 1 ATOM 4192 C CG . PHE C 3 184 ? 30.620 -25.064 -16.914 1.00 66.83 ? 187 PHE C CG 1 ATOM 4193 C CD1 . PHE C 3 184 ? 29.910 -24.130 -17.658 1.00 66.70 ? 187 PHE C CD1 1 ATOM 4194 C CD2 . PHE C 3 184 ? 29.985 -26.246 -16.545 1.00 62.54 ? 187 PHE C CD2 1 ATOM 4195 C CE1 . PHE C 3 184 ? 28.587 -24.365 -18.007 1.00 62.93 ? 187 PHE C CE1 1 ATOM 4196 C CE2 . PHE C 3 184 ? 28.662 -26.491 -16.895 1.00 58.03 ? 187 PHE C CE2 1 ATOM 4197 C CZ . PHE C 3 184 ? 27.965 -25.555 -17.627 1.00 58.50 ? 187 PHE C CZ 1 ATOM 4198 N N . ALA C 3 185 ? 30.583 -22.963 -13.907 1.00 70.93 ? 188 ALA C N 1 ATOM 4199 C CA . ALA C 3 185 ? 29.639 -23.034 -12.793 1.00 68.16 ? 188 ALA C CA 1 ATOM 4200 C C . ALA C 3 185 ? 28.233 -23.398 -13.263 1.00 63.17 ? 188 ALA C C 1 ATOM 4201 O O . ALA C 3 185 ? 27.804 -22.986 -14.338 1.00 63.05 ? 188 ALA C O 1 ATOM 4202 C CB . ALA C 3 185 ? 29.618 -21.711 -12.045 1.00 71.99 ? 188 ALA C CB 1 ATOM 4203 N N . CYS C 3 186 ? 27.513 -24.165 -12.455 1.00 59.71 ? 189 CYS C N 1 ATOM 4204 C CA . CYS C 3 186 ? 26.137 -24.490 -12.789 1.00 55.90 ? 189 CYS C CA 1 ATOM 4205 C C . CYS C 3 186 ? 25.183 -23.321 -12.576 1.00 56.08 ? 189 CYS C C 1 ATOM 4206 O O . CYS C 3 186 ? 24.125 -23.257 -13.194 1.00 54.32 ? 189 CYS C O 1 ATOM 4207 C CB . CYS C 3 186 ? 25.675 -25.751 -12.063 1.00 53.33 ? 189 CYS C CB 1 ATOM 4208 S SG . CYS C 3 186 ? 26.326 -27.271 -12.837 1.00 54.59 ? 189 CYS C SG 1 ATOM 4209 N N . ALA C 3 187 ? 25.569 -22.391 -11.711 1.00 59.08 ? 190 ALA C N 1 ATOM 4210 C CA . ALA C 3 187 ? 24.833 -21.137 -11.554 1.00 60.78 ? 190 ALA C CA 1 ATOM 4211 C C . ALA C 3 187 ? 24.806 -20.345 -12.853 1.00 62.01 ? 190 ALA C C 1 ATOM 4212 O O . ALA C 3 187 ? 23.778 -19.778 -13.208 1.00 62.10 ? 190 ALA C O 1 ATOM 4213 C CB . ALA C 3 187 ? 25.423 -20.297 -10.428 1.00 65.55 ? 190 ALA C CB 1 ATOM 4214 N N . ASN C 3 188 ? 25.930 -20.316 -13.564 1.00 63.41 ? 191 ASN C N 1 ATOM 4215 C CA . ASN C 3 188 ? 25.994 -19.593 -14.826 1.00 65.80 ? 191 ASN C CA 1 ATOM 4216 C C . ASN C 3 188 ? 26.346 -20.458 -16.024 1.00 64.18 ? 191 ASN C C 1 ATOM 4217 O O . ASN C 3 188 ? 27.427 -20.356 -16.608 1.00 67.06 ? 191 ASN C O 1 ATOM 4218 C CB . ASN C 3 188 ? 26.872 -18.350 -14.710 1.00 71.86 ? 191 ASN C CB 1 ATOM 4219 C CG . ASN C 3 188 ? 26.154 -17.217 -14.025 1.00 73.85 ? 191 ASN C CG 1 ATOM 4220 O OD1 . ASN C 3 188 ? 25.155 -16.711 -14.529 1.00 73.15 ? 191 ASN C OD1 1 ATOM 4221 N ND2 . ASN C 3 188 ? 26.640 -16.828 -12.858 1.00 76.17 ? 191 ASN C ND2 1 ATOM 4222 N N . ALA C 3 189 ? 25.384 -21.305 -16.372 1.00 60.30 ? 192 ALA C N 1 ATOM 4223 C CA . ALA C 3 189 ? 25.490 -22.241 -17.472 1.00 58.82 ? 192 ALA C CA 1 ATOM 4224 C C . ALA C 3 189 ? 24.405 -21.901 -18.477 1.00 59.31 ? 192 ALA C C 1 ATOM 4225 O O . ALA C 3 189 ? 24.690 -21.626 -19.644 1.00 62.30 ? 192 ALA C O 1 ATOM 4226 C CB . ALA C 3 189 ? 25.309 -23.650 -16.961 1.00 54.51 ? 192 ALA C CB 1 ATOM 4227 N N . PHE C 3 190 ? 23.159 -21.895 -18.011 1.00 57.18 ? 193 PHE C N 1 ATOM 4228 C CA . PHE C 3 190 ? 22.028 -21.565 -18.860 1.00 58.25 ? 193 PHE C CA 1 ATOM 4229 C C . PHE C 3 190 ? 21.917 -20.048 -19.061 1.00 63.30 ? 193 PHE C C 1 ATOM 4230 O O . PHE C 3 190 ? 20.837 -19.506 -19.316 1.00 64.88 ? 193 PHE C O 1 ATOM 4231 C CB . PHE C 3 190 ? 20.749 -22.185 -18.296 1.00 54.82 ? 193 PHE C CB 1 ATOM 4232 C CG . PHE C 3 190 ? 20.786 -23.684 -18.248 1.00 51.29 ? 193 PHE C CG 1 ATOM 4233 C CD1 . PHE C 3 190 ? 21.234 -24.351 -17.112 1.00 49.21 ? 193 PHE C CD1 1 ATOM 4234 C CD2 . PHE C 3 190 ? 20.392 -24.438 -19.345 1.00 51.53 ? 193 PHE C CD2 1 ATOM 4235 C CE1 . PHE C 3 190 ? 21.280 -25.750 -17.067 1.00 45.68 ? 193 PHE C CE1 1 ATOM 4236 C CE2 . PHE C 3 190 ? 20.438 -25.843 -19.306 1.00 48.43 ? 193 PHE C CE2 1 ATOM 4237 C CZ . PHE C 3 190 ? 20.882 -26.490 -18.169 1.00 45.45 ? 193 PHE C CZ 1 ATOM 4238 N N . ASN C 3 191 ? 23.065 -19.380 -18.980 1.00 66.70 ? 194 ASN C N 1 ATOM 4239 C CA . ASN C 3 191 ? 23.156 -17.924 -19.079 1.00 72.63 ? 194 ASN C CA 1 ATOM 4240 C C . ASN C 3 191 ? 22.710 -17.343 -20.424 1.00 76.82 ? 194 ASN C C 1 ATOM 4241 O O . ASN C 3 191 ? 22.567 -16.122 -20.557 1.00 82.25 ? 194 ASN C O 1 ATOM 4242 C CB . ASN C 3 191 ? 24.579 -17.446 -18.735 1.00 75.92 ? 194 ASN C CB 1 ATOM 4243 C CG . ASN C 3 191 ? 25.621 -17.893 -19.756 1.00 77.14 ? 194 ASN C CG 1 ATOM 4244 O OD1 . ASN C 3 191 ? 26.179 -17.075 -20.491 1.00 82.11 ? 194 ASN C OD1 1 ATOM 4245 N ND2 . ASN C 3 191 ? 25.888 -19.196 -19.803 1.00 73.30 ? 194 ASN C ND2 1 ATOM 4246 N N . ASN C 3 192 ? 22.494 -18.212 -21.413 1.00 75.22 ? 195 ASN C N 1 ATOM 4247 C CA . ASN C 3 192 ? 22.043 -17.764 -22.736 1.00 79.67 ? 195 ASN C CA 1 ATOM 4248 C C . ASN C 3 192 ? 20.533 -17.928 -22.948 1.00 78.81 ? 195 ASN C C 1 ATOM 4249 O O . ASN C 3 192 ? 19.976 -17.443 -23.938 1.00 83.29 ? 195 ASN C O 1 ATOM 4250 C CB . ASN C 3 192 ? 22.842 -18.440 -23.856 1.00 80.51 ? 195 ASN C CB 1 ATOM 4251 C CG . ASN C 3 192 ? 23.044 -17.530 -25.059 1.00 87.61 ? 195 ASN C CG 1 ATOM 4252 O OD1 . ASN C 3 192 ? 22.134 -16.814 -25.476 1.00 90.84 ? 195 ASN C OD1 1 ATOM 4253 N ND2 . ASN C 3 192 ? 24.247 -17.556 -25.622 1.00 90.70 ? 195 ASN C ND2 1 ATOM 4254 N N . SER C 3 193 ? 19.883 -18.603 -22.003 1.00 73.67 ? 196 SER C N 1 ATOM 4255 C CA . SER C 3 193 ? 18.432 -18.757 -22.005 1.00 73.14 ? 196 SER C CA 1 ATOM 4256 C C . SER C 3 193 ? 17.748 -17.649 -21.194 1.00 75.73 ? 196 SER C C 1 ATOM 4257 O O . SER C 3 193 ? 18.416 -16.862 -20.514 1.00 77.38 ? 196 SER C O 1 ATOM 4258 C CB . SER C 3 193 ? 18.057 -20.128 -21.439 1.00 67.17 ? 196 SER C CB 1 ATOM 4259 O OG . SER C 3 193 ? 18.768 -21.156 -22.103 1.00 65.52 ? 196 SER C OG 1 ATOM 4260 N N . ILE C 3 194 ? 16.420 -17.582 -21.290 1.00 76.85 ? 197 ILE C N 1 ATOM 4261 C CA . ILE C 3 194 ? 15.624 -16.736 -20.402 1.00 79.02 ? 197 ILE C CA 1 ATOM 4262 C C . ILE C 3 194 ? 15.296 -17.558 -19.155 1.00 73.52 ? 197 ILE C C 1 ATOM 4263 O O . ILE C 3 194 ? 14.426 -18.436 -19.178 1.00 71.23 ? 197 ILE C O 1 ATOM 4264 C CB . ILE C 3 194 ? 14.330 -16.224 -21.076 1.00 83.83 ? 197 ILE C CB 1 ATOM 4265 N N . ILE C 3 195 ? 16.033 -17.295 -18.081 1.00 72.13 ? 198 ILE C N 1 ATOM 4266 C CA . ILE C 3 195 ? 15.818 -17.965 -16.806 1.00 67.79 ? 198 ILE C CA 1 ATOM 4267 C C . ILE C 3 195 ? 14.761 -17.216 -15.984 1.00 70.98 ? 198 ILE C C 1 ATOM 4268 O O . ILE C 3 195 ? 14.735 -15.981 -15.985 1.00 76.35 ? 198 ILE C O 1 ATOM 4269 C CB . ILE C 3 195 ? 17.131 -18.066 -16.008 1.00 65.76 ? 198 ILE C CB 1 ATOM 4270 N N . PRO C 3 196 ? 13.873 -17.958 -15.293 1.00 68.38 ? 199 PRO C N 1 ATOM 4271 C CA . PRO C 3 196 ? 12.889 -17.333 -14.400 1.00 71.78 ? 199 PRO C CA 1 ATOM 4272 C C . PRO C 3 196 ? 13.534 -16.506 -13.271 1.00 74.26 ? 199 PRO C C 1 ATOM 4273 O O . PRO C 3 196 ? 14.739 -16.613 -13.024 1.00 72.52 ? 199 PRO C O 1 ATOM 4274 C CB . PRO C 3 196 ? 12.138 -18.537 -13.815 1.00 67.88 ? 199 PRO C CB 1 ATOM 4275 C CG . PRO C 3 196 ? 12.303 -19.610 -14.818 1.00 63.81 ? 199 PRO C CG 1 ATOM 4276 C CD . PRO C 3 196 ? 13.659 -19.413 -15.409 1.00 63.13 ? 199 PRO C CD 1 ATOM 4277 N N . GLU C 3 197 ? 12.736 -15.681 -12.599 1.00 79.11 ? 200 GLU C N 1 ATOM 4278 C CA . GLU C 3 197 ? 13.231 -14.911 -11.458 1.00 82.42 ? 200 GLU C CA 1 ATOM 4279 C C . GLU C 3 197 ? 13.375 -15.817 -10.233 1.00 78.56 ? 200 GLU C C 1 ATOM 4280 O O . GLU C 3 197 ? 14.401 -15.797 -9.549 1.00 78.21 ? 200 GLU C O 1 ATOM 4281 C CB . GLU C 3 197 ? 12.309 -13.725 -11.155 1.00 89.73 ? 200 GLU C CB 1 ATOM 4282 N N . ASP C 3 198 ? 12.349 -16.629 -9.988 1.00 76.27 ? 201 ASP C N 1 ATOM 4283 C CA . ASP C 3 198 ? 12.275 -17.493 -8.810 1.00 73.64 ? 201 ASP C CA 1 ATOM 4284 C C . ASP C 3 198 ? 13.022 -18.826 -8.987 1.00 67.03 ? 201 ASP C C 1 ATOM 4285 O O . ASP C 3 198 ? 12.588 -19.872 -8.486 1.00 64.40 ? 201 ASP C O 1 ATOM 4286 C CB . ASP C 3 198 ? 10.804 -17.734 -8.442 1.00 75.54 ? 201 ASP C CB 1 ATOM 4287 C CG . ASP C 3 198 ? 9.980 -18.239 -9.620 1.00 73.95 ? 201 ASP C CG 1 ATOM 4288 N N . THR C 3 199 ? 14.149 -18.778 -9.694 1.00 65.00 ? 202 THR C N 1 ATOM 4289 C CA . THR C 3 199 ? 14.930 -19.973 -9.982 1.00 59.51 ? 202 THR C CA 1 ATOM 4290 C C . THR C 3 199 ? 15.819 -20.310 -8.792 1.00 58.95 ? 202 THR C C 1 ATOM 4291 O O . THR C 3 199 ? 16.367 -19.414 -8.154 1.00 62.33 ? 202 THR C O 1 ATOM 4292 C CB . THR C 3 199 ? 15.763 -19.823 -11.278 1.00 58.54 ? 202 THR C CB 1 ATOM 4293 O OG1 . THR C 3 199 ? 14.955 -19.225 -12.299 1.00 60.52 ? 202 THR C OG1 1 ATOM 4294 C CG2 . THR C 3 199 ? 16.255 -21.185 -11.773 1.00 53.35 ? 202 THR C CG2 1 ATOM 4295 N N . PHE C 3 200 ? 15.940 -21.607 -8.500 1.00 55.24 ? 203 PHE C N 1 ATOM 4296 C CA . PHE C 3 200 ? 16.662 -22.085 -7.323 1.00 55.20 ? 203 PHE C CA 1 ATOM 4297 C C . PHE C 3 200 ? 18.102 -22.427 -7.673 1.00 53.39 ? 203 PHE C C 1 ATOM 4298 O O . PHE C 3 200 ? 18.362 -23.317 -8.471 1.00 49.83 ? 203 PHE C O 1 ATOM 4299 C CB . PHE C 3 200 ? 15.923 -23.271 -6.684 1.00 53.61 ? 203 PHE C CB 1 ATOM 4300 C CG . PHE C 3 200 ? 16.566 -23.807 -5.420 1.00 54.74 ? 203 PHE C CG 1 ATOM 4301 C CD1 . PHE C 3 200 ? 17.137 -22.954 -4.479 1.00 58.69 ? 203 PHE C CD1 1 ATOM 4302 C CD2 . PHE C 3 200 ? 16.567 -25.176 -5.160 1.00 52.56 ? 203 PHE C CD2 1 ATOM 4303 C CE1 . PHE C 3 200 ? 17.725 -23.459 -3.318 1.00 60.09 ? 203 PHE C CE1 1 ATOM 4304 C CE2 . PHE C 3 200 ? 17.145 -25.682 -3.992 1.00 54.15 ? 203 PHE C CE2 1 ATOM 4305 C CZ . PHE C 3 200 ? 17.724 -24.819 -3.076 1.00 57.68 ? 203 PHE C CZ 1 ATOM 4306 N N . PHE C 3 201 ? 19.025 -21.687 -7.068 1.00 56.73 ? 204 PHE C N 1 ATOM 4307 C CA . PHE C 3 201 ? 20.450 -21.807 -7.352 1.00 56.67 ? 204 PHE C CA 1 ATOM 4308 C C . PHE C 3 201 ? 21.262 -22.122 -6.096 1.00 59.14 ? 204 PHE C C 1 ATOM 4309 O O . PHE C 3 201 ? 21.867 -21.215 -5.501 1.00 63.36 ? 204 PHE C O 1 ATOM 4310 C CB . PHE C 3 201 ? 20.971 -20.519 -7.978 1.00 59.72 ? 204 PHE C CB 1 ATOM 4311 C CG . PHE C 3 201 ? 20.673 -20.389 -9.435 1.00 57.22 ? 204 PHE C CG 1 ATOM 4312 C CD1 . PHE C 3 201 ? 19.719 -19.487 -9.880 1.00 58.76 ? 204 PHE C CD1 1 ATOM 4313 C CD2 . PHE C 3 201 ? 21.358 -21.154 -10.366 1.00 54.21 ? 204 PHE C CD2 1 ATOM 4314 C CE1 . PHE C 3 201 ? 19.444 -19.349 -11.229 1.00 58.02 ? 204 PHE C CE1 1 ATOM 4315 C CE2 . PHE C 3 201 ? 21.089 -21.027 -11.720 1.00 53.76 ? 204 PHE C CE2 1 ATOM 4316 C CZ . PHE C 3 201 ? 20.128 -20.121 -12.153 1.00 55.45 ? 204 PHE C CZ 1 ATOM 4317 N N . PRO C 3 202 ? 21.296 -23.413 -5.706 1.00 56.92 ? 205 PRO C N 1 ATOM 4318 C CA . PRO C 3 202 ? 21.951 -23.907 -4.498 1.00 59.66 ? 205 PRO C CA 1 ATOM 4319 C C . PRO C 3 202 ? 23.473 -23.800 -4.555 1.00 62.10 ? 205 PRO C C 1 ATOM 4320 O O . PRO C 3 202 ? 24.084 -24.295 -5.500 1.00 59.72 ? 205 PRO C O 1 ATOM 4321 C CB . PRO C 3 202 ? 21.544 -25.386 -4.458 1.00 56.36 ? 205 PRO C CB 1 ATOM 4322 C CG . PRO C 3 202 ? 20.432 -25.520 -5.418 1.00 52.88 ? 205 PRO C CG 1 ATOM 4323 C CD . PRO C 3 202 ? 20.695 -24.513 -6.470 1.00 52.40 ? 205 PRO C CD 1 ATOM 4324 N N . SER C 3 203 ? 24.071 -23.158 -3.551 1.00 67.78 ? 206 SER C N 1 ATOM 4325 C CA . SER C 3 203 ? 25.530 -23.100 -3.432 1.00 71.51 ? 206 SER C CA 1 ATOM 4326 C C . SER C 3 203 ? 26.103 -24.515 -3.354 1.00 70.18 ? 206 SER C C 1 ATOM 4327 O O . SER C 3 203 ? 25.510 -25.383 -2.704 1.00 69.45 ? 206 SER C O 1 ATOM 4328 C CB . SER C 3 203 ? 25.959 -22.276 -2.215 1.00 78.24 ? 206 SER C CB 1 ATOM 4329 O OG . SER C 3 203 ? 26.149 -20.917 -2.568 1.00 81.38 ? 206 SER C OG 1 ATOM 4330 N N . PRO C 3 204 ? 27.244 -24.757 -4.033 1.00 70.69 ? 207 PRO C N 1 ATOM 4331 C CA . PRO C 3 204 ? 27.813 -26.099 -4.138 1.00 69.54 ? 207 PRO C CA 1 ATOM 4332 C C . PRO C 3 204 ? 28.948 -26.342 -3.143 1.00 75.31 ? 207 PRO C C 1 ATOM 4333 O O . PRO C 3 204 ? 28.778 -27.096 -2.184 1.00 76.90 ? 207 PRO C O 1 ATOM 4334 C CB . PRO C 3 204 ? 28.350 -26.126 -5.573 1.00 67.29 ? 207 PRO C CB 1 ATOM 4335 C CG . PRO C 3 204 ? 28.507 -24.638 -5.979 1.00 69.42 ? 207 PRO C CG 1 ATOM 4336 C CD . PRO C 3 204 ? 28.021 -23.793 -4.832 1.00 72.53 ? 207 PRO C CD 1 ATOM 4337 N N . ALA D 4 3 ? 1.660 -58.559 -39.833 1.00 114.21 ? 3 ALA D N 1 ATOM 4338 C CA . ALA D 4 3 ? 2.848 -57.709 -39.518 1.00 107.72 ? 3 ALA D CA 1 ATOM 4339 C C . ALA D 4 3 ? 3.905 -57.763 -40.625 1.00 101.58 ? 3 ALA D C 1 ATOM 4340 O O . ALA D 4 3 ? 4.013 -58.759 -41.344 1.00 103.55 ? 3 ALA D O 1 ATOM 4341 C CB . ALA D 4 3 ? 3.453 -58.120 -38.177 1.00 111.74 ? 3 ALA D CB 1 ATOM 4342 N N . VAL D 4 4 ? 4.671 -56.682 -40.763 1.00 94.97 ? 4 VAL D N 1 ATOM 4343 C CA . VAL D 4 4 ? 5.801 -56.633 -41.695 1.00 89.76 ? 4 VAL D CA 1 ATOM 4344 C C . VAL D 4 4 ? 7.097 -56.528 -40.893 1.00 88.67 ? 4 VAL D C 1 ATOM 4345 O O . VAL D 4 4 ? 7.172 -55.768 -39.926 1.00 88.37 ? 4 VAL D O 1 ATOM 4346 C CB . VAL D 4 4 ? 5.707 -55.436 -42.676 1.00 83.62 ? 4 VAL D CB 1 ATOM 4347 C CG1 . VAL D 4 4 ? 6.773 -55.545 -43.765 1.00 79.58 ? 4 VAL D CG1 1 ATOM 4348 C CG2 . VAL D 4 4 ? 4.317 -55.342 -43.299 1.00 85.36 ? 4 VAL D CG2 1 ATOM 4349 N N . THR D 4 5 ? 8.109 -57.294 -41.293 1.00 88.86 ? 5 THR D N 1 ATOM 4350 C CA . THR D 4 5 ? 9.379 -57.326 -40.572 1.00 88.91 ? 5 THR D CA 1 ATOM 4351 C C . THR D 4 5 ? 10.555 -57.061 -41.504 1.00 84.49 ? 5 THR D C 1 ATOM 4352 O O . THR D 4 5 ? 10.611 -57.588 -42.615 1.00 84.27 ? 5 THR D O 1 ATOM 4353 C CB . THR D 4 5 ? 9.599 -58.677 -39.872 1.00 96.01 ? 5 THR D CB 1 ATOM 4354 O OG1 . THR D 4 5 ? 8.358 -59.389 -39.790 1.00 101.14 ? 5 THR D OG1 1 ATOM 4355 C CG2 . THR D 4 5 ? 10.167 -58.466 -38.474 1.00 98.35 ? 5 THR D CG2 1 ATOM 4356 N N . GLN D 4 6 ? 11.491 -56.238 -41.044 1.00 81.76 ? 6 GLN D N 1 ATOM 4357 C CA . GLN D 4 6 ? 12.688 -55.922 -41.815 1.00 78.48 ? 6 GLN D CA 1 ATOM 4358 C C . GLN D 4 6 ? 13.932 -56.324 -41.043 1.00 81.32 ? 6 GLN D C 1 ATOM 4359 O O . GLN D 4 6 ? 14.016 -56.105 -39.830 1.00 83.27 ? 6 GLN D O 1 ATOM 4360 C CB . GLN D 4 6 ? 12.763 -54.423 -42.114 1.00 72.99 ? 6 GLN D CB 1 ATOM 4361 C CG . GLN D 4 6 ? 11.574 -53.843 -42.867 1.00 70.69 ? 6 GLN D CG 1 ATOM 4362 C CD . GLN D 4 6 ? 11.716 -52.348 -43.134 1.00 66.76 ? 6 GLN D CD 1 ATOM 4363 O OE1 . GLN D 4 6 ? 10.721 -51.629 -43.242 1.00 66.11 ? 6 GLN D OE1 1 ATOM 4364 N NE2 . GLN D 4 6 ? 12.955 -51.875 -43.244 1.00 64.92 ? 6 GLN D NE2 1 ATOM 4365 N N . SER D 4 7 ? 14.891 -56.920 -41.746 1.00 82.30 ? 7 SER D N 1 ATOM 4366 C CA . SER D 4 7 ? 16.225 -57.145 -41.188 1.00 84.89 ? 7 SER D CA 1 ATOM 4367 C C . SER D 4 7 ? 17.279 -56.782 -42.238 1.00 82.39 ? 7 SER D C 1 ATOM 4368 O O . SER D 4 7 ? 17.125 -57.138 -43.410 1.00 81.90 ? 7 SER D O 1 ATOM 4369 C CB . SER D 4 7 ? 16.403 -58.581 -40.682 1.00 91.91 ? 7 SER D CB 1 ATOM 4370 O OG . SER D 4 7 ? 16.958 -59.420 -41.677 1.00 94.26 ? 7 SER D OG 1 ATOM 4371 N N . PRO D 4 8 ? 18.344 -56.063 -41.827 1.00 81.49 ? 8 PRO D N 1 ATOM 4372 C CA . PRO D 4 8 ? 18.603 -55.635 -40.449 1.00 82.78 ? 8 PRO D CA 1 ATOM 4373 C C . PRO D 4 8 ? 17.731 -54.446 -40.038 1.00 78.57 ? 8 PRO D C 1 ATOM 4374 O O . PRO D 4 8 ? 16.941 -53.957 -40.852 1.00 74.83 ? 8 PRO D O 1 ATOM 4375 C CB . PRO D 4 8 ? 20.083 -55.244 -40.481 1.00 83.54 ? 8 PRO D CB 1 ATOM 4376 C CG . PRO D 4 8 ? 20.329 -54.812 -41.882 1.00 80.12 ? 8 PRO D CG 1 ATOM 4377 C CD . PRO D 4 8 ? 19.375 -55.572 -42.762 1.00 79.71 ? 8 PRO D CD 1 ATOM 4378 N N . ARG D 4 9 ? 17.858 -54.012 -38.785 1.00 79.89 ? 9 ARG D N 1 ATOM 4379 C CA . ARG D 4 9 ? 17.169 -52.816 -38.308 1.00 76.79 ? 9 ARG D CA 1 ATOM 4380 C C . ARG D 4 9 ? 18.044 -51.567 -38.466 1.00 73.79 ? 9 ARG D C 1 ATOM 4381 O O . ARG D 4 9 ? 17.557 -50.514 -38.884 1.00 69.93 ? 9 ARG D O 1 ATOM 4382 C CB . ARG D 4 9 ? 16.708 -52.993 -36.857 1.00 80.93 ? 9 ARG D CB 1 ATOM 4383 C CG . ARG D 4 9 ? 15.392 -53.757 -36.701 1.00 83.22 ? 9 ARG D CG 1 ATOM 4384 C CD . ARG D 4 9 ? 14.178 -52.848 -36.875 1.00 79.87 ? 9 ARG D CD 1 ATOM 4385 N N . ASN D 4 10 ? 19.329 -51.697 -38.127 1.00 76.16 ? 10 ASN D N 1 ATOM 4386 C CA . ASN D 4 10 ? 20.332 -50.645 -38.347 1.00 74.41 ? 10 ASN D CA 1 ATOM 4387 C C . ASN D 4 10 ? 21.557 -51.210 -39.060 1.00 76.16 ? 10 ASN D C 1 ATOM 4388 O O . ASN D 4 10 ? 21.917 -52.368 -38.845 1.00 80.21 ? 10 ASN D O 1 ATOM 4389 C CB . ASN D 4 10 ? 20.752 -49.981 -37.028 1.00 76.80 ? 10 ASN D CB 1 ATOM 4390 C CG . ASN D 4 10 ? 19.719 -48.994 -36.510 1.00 74.50 ? 10 ASN D CG 1 ATOM 4391 N N . LYS D 4 11 ? 22.187 -50.396 -39.909 1.00 73.91 ? 11 LYS D N 1 ATOM 4392 C CA . LYS D 4 11 ? 23.383 -50.821 -40.648 1.00 76.23 ? 11 LYS D CA 1 ATOM 4393 C C . LYS D 4 11 ? 24.334 -49.670 -40.974 1.00 75.94 ? 11 LYS D C 1 ATOM 4394 O O . LYS D 4 11 ? 23.921 -48.643 -41.522 1.00 72.40 ? 11 LYS D O 1 ATOM 4395 C CB . LYS D 4 11 ? 23.001 -51.558 -41.935 1.00 74.96 ? 11 LYS D CB 1 ATOM 4396 N N . VAL D 4 12 ? 25.606 -49.857 -40.626 1.00 80.37 ? 12 VAL D N 1 ATOM 4397 C CA . VAL D 4 12 ? 26.670 -48.935 -41.018 1.00 81.60 ? 12 VAL D CA 1 ATOM 4398 C C . VAL D 4 12 ? 27.476 -49.537 -42.174 1.00 84.13 ? 12 VAL D C 1 ATOM 4399 O O . VAL D 4 12 ? 28.077 -50.602 -42.026 1.00 88.70 ? 12 VAL D O 1 ATOM 4400 C CB . VAL D 4 12 ? 27.601 -48.598 -39.834 1.00 85.89 ? 12 VAL D CB 1 ATOM 4401 N N . ALA D 4 13 ? 27.478 -48.855 -43.320 1.00 81.96 ? 13 ALA D N 1 ATOM 4402 C CA . ALA D 4 13 ? 28.123 -49.362 -44.538 1.00 84.51 ? 13 ALA D CA 1 ATOM 4403 C C . ALA D 4 13 ? 29.241 -48.453 -45.067 1.00 87.67 ? 13 ALA D C 1 ATOM 4404 O O . ALA D 4 13 ? 29.246 -47.246 -44.819 1.00 86.27 ? 13 ALA D O 1 ATOM 4405 C CB . ALA D 4 13 ? 27.081 -49.605 -45.619 1.00 80.49 ? 13 ALA D CB 1 ATOM 4406 N N . VAL D 4 14 ? 30.179 -49.049 -45.801 1.00 92.67 ? 14 VAL D N 1 ATOM 4407 C CA . VAL D 4 14 ? 31.299 -48.322 -46.404 1.00 97.17 ? 14 VAL D CA 1 ATOM 4408 C C . VAL D 4 14 ? 30.970 -47.953 -47.848 1.00 95.79 ? 14 VAL D C 1 ATOM 4409 O O . VAL D 4 14 ? 30.264 -48.693 -48.533 1.00 93.78 ? 14 VAL D O 1 ATOM 4410 C CB . VAL D 4 14 ? 32.594 -49.173 -46.412 1.00 105.06 ? 14 VAL D CB 1 ATOM 4411 C CG1 . VAL D 4 14 ? 33.830 -48.279 -46.485 1.00 110.60 ? 14 VAL D CG1 1 ATOM 4412 C CG2 . VAL D 4 14 ? 32.663 -50.070 -45.188 1.00 106.78 ? 14 VAL D CG2 1 ATOM 4413 N N . THR D 4 15 ? 31.490 -46.814 -48.304 1.00 97.68 ? 15 THR D N 1 ATOM 4414 C CA . THR D 4 15 ? 31.348 -46.389 -49.699 1.00 98.05 ? 15 THR D CA 1 ATOM 4415 C C . THR D 4 15 ? 31.920 -47.449 -50.642 1.00 103.11 ? 15 THR D C 1 ATOM 4416 O O . THR D 4 15 ? 33.091 -47.821 -50.538 1.00 109.78 ? 15 THR D O 1 ATOM 4417 C CB . THR D 4 15 ? 32.036 -45.025 -49.947 1.00 101.40 ? 15 THR D CB 1 ATOM 4418 O OG1 . THR D 4 15 ? 31.505 -44.054 -49.039 1.00 97.44 ? 15 THR D OG1 1 ATOM 4419 C CG2 . THR D 4 15 ? 31.816 -44.544 -51.379 1.00 102.18 ? 15 THR D CG2 1 ATOM 4420 N N . GLY D 4 16 ? 31.074 -47.938 -51.546 1.00 100.54 ? 16 GLY D N 1 ATOM 4421 C CA . GLY D 4 16 ? 31.455 -48.984 -52.491 1.00 105.45 ? 16 GLY D CA 1 ATOM 4422 C C . GLY D 4 16 ? 31.207 -50.387 -51.967 1.00 105.43 ? 16 GLY D C 1 ATOM 4423 O O . GLY D 4 16 ? 31.556 -51.369 -52.624 1.00 110.21 ? 16 GLY D O 1 ATOM 4424 N N . GLY D 4 17 ? 30.609 -50.479 -50.781 1.00 100.92 ? 17 GLY D N 1 ATOM 4425 C CA . GLY D 4 17 ? 30.290 -51.765 -50.162 1.00 101.29 ? 17 GLY D CA 1 ATOM 4426 C C . GLY D 4 17 ? 28.952 -52.305 -50.627 1.00 96.80 ? 17 GLY D C 1 ATOM 4427 O O . GLY D 4 17 ? 28.152 -51.575 -51.217 1.00 92.33 ? 17 GLY D O 1 ATOM 4428 N N . LYS D 4 18 ? 28.711 -53.589 -50.364 1.00 98.75 ? 18 LYS D N 1 ATOM 4429 C CA . LYS D 4 18 ? 27.473 -54.249 -50.783 1.00 95.69 ? 18 LYS D CA 1 ATOM 4430 C C . LYS D 4 18 ? 26.498 -54.413 -49.618 1.00 91.33 ? 18 LYS D C 1 ATOM 4431 O O . LYS D 4 18 ? 26.679 -55.275 -48.753 1.00 94.22 ? 18 LYS D O 1 ATOM 4432 C CB . LYS D 4 18 ? 27.772 -55.601 -51.439 1.00 101.71 ? 18 LYS D CB 1 ATOM 4433 N N . VAL D 4 19 ? 25.468 -53.570 -49.606 1.00 85.21 ? 19 VAL D N 1 ATOM 4434 C CA . VAL D 4 19 ? 24.443 -53.601 -48.570 1.00 81.33 ? 19 VAL D CA 1 ATOM 4435 C C . VAL D 4 19 ? 23.140 -54.201 -49.097 1.00 79.24 ? 19 VAL D C 1 ATOM 4436 O O . VAL D 4 19 ? 22.719 -53.913 -50.222 1.00 77.76 ? 19 VAL D O 1 ATOM 4437 C CB . VAL D 4 19 ? 24.175 -52.197 -48.002 1.00 76.73 ? 19 VAL D CB 1 ATOM 4438 N N . THR D 4 20 ? 22.516 -55.040 -48.273 1.00 79.90 ? 20 THR D N 1 ATOM 4439 C CA . THR D 4 20 ? 21.268 -55.715 -48.619 1.00 79.04 ? 20 THR D CA 1 ATOM 4440 C C . THR D 4 20 ? 20.281 -55.550 -47.475 1.00 76.45 ? 20 THR D C 1 ATOM 4441 O O . THR D 4 20 ? 20.638 -55.751 -46.311 1.00 78.33 ? 20 THR D O 1 ATOM 4442 C CB . THR D 4 20 ? 21.492 -57.225 -48.843 1.00 84.94 ? 20 THR D CB 1 ATOM 4443 O OG1 . THR D 4 20 ? 22.831 -57.455 -49.300 1.00 89.43 ? 20 THR D OG1 1 ATOM 4444 C CG2 . THR D 4 20 ? 20.497 -57.780 -49.858 1.00 84.89 ? 20 THR D CG2 1 ATOM 4445 N N . LEU D 4 21 ? 19.045 -55.180 -47.801 1.00 72.97 ? 21 LEU D N 1 ATOM 4446 C CA . LEU D 4 21 ? 17.999 -54.997 -46.787 1.00 71.23 ? 21 LEU D CA 1 ATOM 4447 C C . LEU D 4 21 ? 16.844 -55.969 -47.023 1.00 73.06 ? 21 LEU D C 1 ATOM 4448 O O . LEU D 4 21 ? 15.999 -55.738 -47.884 1.00 71.04 ? 21 LEU D O 1 ATOM 4449 C CB . LEU D 4 21 ? 17.488 -53.546 -46.766 1.00 66.26 ? 21 LEU D CB 1 ATOM 4450 C CG . LEU D 4 21 ? 18.436 -52.422 -46.347 1.00 64.24 ? 21 LEU D CG 1 ATOM 4451 N N . SER D 4 22 ? 16.821 -57.062 -46.267 1.00 77.75 ? 22 SER D N 1 ATOM 4452 C CA . SER D 4 22 ? 15.765 -58.066 -46.412 1.00 80.98 ? 22 SER D CA 1 ATOM 4453 C C . SER D 4 22 ? 14.457 -57.597 -45.767 1.00 79.17 ? 22 SER D C 1 ATOM 4454 O O . SER D 4 22 ? 14.471 -56.914 -44.733 1.00 77.77 ? 22 SER D O 1 ATOM 4455 C CB . SER D 4 22 ? 16.203 -59.416 -45.829 1.00 87.47 ? 22 SER D CB 1 ATOM 4456 N N . CYS D 4 23 ? 13.339 -57.957 -46.396 1.00 79.85 ? 23 CYS D N 1 ATOM 4457 C CA . CYS D 4 23 ? 12.010 -57.638 -45.883 1.00 79.38 ? 23 CYS D CA 1 ATOM 4458 C C . CYS D 4 23 ? 11.106 -58.860 -45.918 1.00 84.63 ? 23 CYS D C 1 ATOM 4459 O O . CYS D 4 23 ? 11.150 -59.648 -46.862 1.00 87.10 ? 23 CYS D O 1 ATOM 4460 C CB . CYS D 4 23 ? 11.382 -56.496 -46.678 1.00 74.65 ? 23 CYS D CB 1 ATOM 4461 S SG . CYS D 4 23 ? 9.607 -56.252 -46.384 1.00 76.19 ? 23 CYS D SG 1 ATOM 4462 N N . ASN D 4 24 ? 10.279 -59.001 -44.889 1.00 87.16 ? 24 ASN D N 1 ATOM 4463 C CA . ASN D 4 24 ? 9.444 -60.183 -44.737 1.00 93.58 ? 24 ASN D CA 1 ATOM 4464 C C . ASN D 4 24 ? 8.033 -59.885 -44.238 1.00 94.92 ? 24 ASN D C 1 ATOM 4465 O O . ASN D 4 24 ? 7.828 -58.992 -43.412 1.00 92.88 ? 24 ASN D O 1 ATOM 4466 C CB . ASN D 4 24 ? 10.119 -61.191 -43.804 1.00 99.20 ? 24 ASN D CB 1 ATOM 4467 C CG . ASN D 4 24 ? 9.606 -62.598 -44.005 1.00 106.65 ? 24 ASN D CG 1 ATOM 4468 O OD1 . ASN D 4 24 ? 8.978 -63.177 -43.117 1.00 112.16 ? 24 ASN D OD1 1 ATOM 4469 N ND2 . ASN D 4 24 ? 9.858 -63.155 -45.185 1.00 107.45 ? 24 ASN D ND2 1 ATOM 4470 N N . GLN D 4 25 ? 7.070 -60.648 -44.750 1.00 99.14 ? 25 GLN D N 1 ATOM 4471 C CA . GLN D 4 25 ? 5.685 -60.587 -44.297 1.00 102.34 ? 25 GLN D CA 1 ATOM 4472 C C . GLN D 4 25 ? 5.012 -61.941 -44.480 1.00 110.27 ? 25 GLN D C 1 ATOM 4473 O O . GLN D 4 25 ? 5.283 -62.649 -45.453 1.00 111.72 ? 25 GLN D O 1 ATOM 4474 C CB . GLN D 4 25 ? 4.908 -59.490 -45.034 1.00 97.74 ? 25 GLN D CB 1 ATOM 4475 C CG . GLN D 4 25 ? 5.036 -59.512 -46.561 1.00 95.27 ? 25 GLN D CG 1 ATOM 4476 C CD . GLN D 4 25 ? 4.017 -60.407 -47.252 1.00 100.65 ? 25 GLN D CD 1 ATOM 4477 O OE1 . GLN D 4 25 ? 2.997 -60.783 -46.671 1.00 105.98 ? 25 GLN D OE1 1 ATOM 4478 N NE2 . GLN D 4 25 ? 4.289 -60.743 -48.507 1.00 100.13 ? 25 GLN D NE2 1 ATOM 4479 N N . THR D 4 26 ? 4.141 -62.296 -43.540 1.00 116.17 ? 26 THR D N 1 ATOM 4480 C CA . THR D 4 26 ? 3.404 -63.557 -43.604 1.00 124.95 ? 26 THR D CA 1 ATOM 4481 C C . THR D 4 26 ? 1.895 -63.336 -43.745 1.00 127.91 ? 26 THR D C 1 ATOM 4482 O O . THR D 4 26 ? 1.095 -64.228 -43.444 1.00 136.33 ? 26 THR D O 1 ATOM 4483 C CB . THR D 4 26 ? 3.705 -64.464 -42.383 1.00 132.30 ? 26 THR D CB 1 ATOM 4484 O OG1 . THR D 4 26 ? 3.860 -63.659 -41.207 1.00 130.47 ? 26 THR D OG1 1 ATOM 4485 C CG2 . THR D 4 26 ? 4.978 -65.269 -42.613 1.00 133.40 ? 26 THR D CG2 1 ATOM 4486 N N . ASN D 4 27 ? 1.515 -62.149 -44.218 1.00 121.76 ? 27 ASN D N 1 ATOM 4487 C CA . ASN D 4 27 ? 0.105 -61.808 -44.425 1.00 124.44 ? 27 ASN D CA 1 ATOM 4488 C C . ASN D 4 27 ? -0.437 -62.273 -45.776 1.00 126.02 ? 27 ASN D C 1 ATOM 4489 O O . ASN D 4 27 ? -1.556 -61.915 -46.159 1.00 127.88 ? 27 ASN D O 1 ATOM 4490 C CB . ASN D 4 27 ? -0.125 -60.305 -44.247 1.00 118.51 ? 27 ASN D CB 1 ATOM 4491 C CG . ASN D 4 27 ? 0.006 -59.861 -42.805 1.00 119.56 ? 27 ASN D CG 1 ATOM 4492 O OD1 . ASN D 4 27 ? 1.106 -59.577 -42.326 1.00 115.97 ? 27 ASN D OD1 1 ATOM 4493 N ND2 . ASN D 4 27 ? -1.123 -59.786 -42.105 1.00 125.35 ? 27 ASN D ND2 1 ATOM 4494 N N . ASN D 4 28 ? 0.363 -63.071 -46.484 1.00 125.92 ? 28 ASN D N 1 ATOM 4495 C CA . ASN D 4 28 ? -0.016 -63.671 -47.769 1.00 128.47 ? 28 ASN D CA 1 ATOM 4496 C C . ASN D 4 28 ? -0.434 -62.629 -48.812 1.00 123.09 ? 28 ASN D C 1 ATOM 4497 O O . ASN D 4 28 ? -1.442 -62.789 -49.504 1.00 126.94 ? 28 ASN D O 1 ATOM 4498 C CB . ASN D 4 28 ? -1.103 -64.747 -47.574 1.00 138.76 ? 28 ASN D CB 1 ATOM 4499 C CG . ASN D 4 28 ? -1.181 -65.719 -48.736 1.00 142.93 ? 28 ASN D CG 1 ATOM 4500 N N . HIS D 4 29 ? 0.349 -61.558 -48.912 1.00 114.81 ? 29 HIS D N 1 ATOM 4501 C CA . HIS D 4 29 ? 0.079 -60.497 -49.880 1.00 109.88 ? 29 HIS D CA 1 ATOM 4502 C C . HIS D 4 29 ? 0.678 -60.805 -51.253 1.00 108.42 ? 29 HIS D C 1 ATOM 4503 O O . HIS D 4 29 ? 1.235 -61.886 -51.472 1.00 111.64 ? 29 HIS D O 1 ATOM 4504 C CB . HIS D 4 29 ? 0.570 -59.142 -49.355 1.00 102.82 ? 29 HIS D CB 1 ATOM 4505 C CG . HIS D 4 29 ? -0.336 -58.527 -48.332 1.00 104.59 ? 29 HIS D CG 1 ATOM 4506 N ND1 . HIS D 4 29 ? 0.104 -58.138 -47.085 1.00 103.10 ? 29 HIS D ND1 1 ATOM 4507 C CD2 . HIS D 4 29 ? -1.660 -58.244 -48.368 1.00 108.59 ? 29 HIS D CD2 1 ATOM 4508 C CE1 . HIS D 4 29 ? -0.908 -57.634 -46.400 1.00 105.90 ? 29 HIS D CE1 1 ATOM 4509 N NE2 . HIS D 4 29 ? -1.990 -57.689 -47.156 1.00 109.35 ? 29 HIS D NE2 1 ATOM 4510 N N . ASN D 4 30 ? 0.547 -59.854 -52.175 1.00 104.34 ? 30 ASN D N 1 ATOM 4511 C CA . ASN D 4 30 ? 1.066 -60.011 -53.532 1.00 103.30 ? 30 ASN D CA 1 ATOM 4512 C C . ASN D 4 30 ? 1.842 -58.787 -54.020 1.00 96.09 ? 30 ASN D C 1 ATOM 4513 O O . ASN D 4 30 ? 2.728 -58.900 -54.867 1.00 94.57 ? 30 ASN D O 1 ATOM 4514 C CB . ASN D 4 30 ? -0.067 -60.363 -54.504 1.00 108.71 ? 30 ASN D CB 1 ATOM 4515 N N . ASN D 4 31 ? 1.507 -57.621 -53.479 1.00 92.37 ? 31 ASN D N 1 ATOM 4516 C CA . ASN D 4 31 ? 2.215 -56.390 -53.820 1.00 86.36 ? 31 ASN D CA 1 ATOM 4517 C C . ASN D 4 31 ? 3.134 -55.940 -52.696 1.00 81.92 ? 31 ASN D C 1 ATOM 4518 O O . ASN D 4 31 ? 2.708 -55.829 -51.548 1.00 82.56 ? 31 ASN D O 1 ATOM 4519 C CB . ASN D 4 31 ? 1.229 -55.283 -54.199 1.00 86.07 ? 31 ASN D CB 1 ATOM 4520 C CG . ASN D 4 31 ? 0.381 -55.650 -55.397 1.00 90.99 ? 31 ASN D CG 1 ATOM 4521 O OD1 . ASN D 4 31 ? 0.885 -56.160 -56.399 1.00 92.37 ? 31 ASN D OD1 1 ATOM 4522 N ND2 . ASN D 4 31 ? -0.919 -55.398 -55.300 1.00 95.12 ? 31 ASN D ND2 1 ATOM 4523 N N . MET D 4 32 ? 4.398 -55.695 -53.030 1.00 78.13 ? 32 MET D N 1 ATOM 4524 C CA . MET D 4 32 ? 5.402 -55.312 -52.036 1.00 74.41 ? 32 MET D CA 1 ATOM 4525 C C . MET D 4 32 ? 6.233 -54.124 -52.496 1.00 69.58 ? 32 MET D C 1 ATOM 4526 O O . MET D 4 32 ? 6.719 -54.089 -53.624 1.00 69.46 ? 32 MET D O 1 ATOM 4527 C CB . MET D 4 32 ? 6.305 -56.494 -51.713 1.00 76.49 ? 32 MET D CB 1 ATOM 4528 C CG . MET D 4 32 ? 5.582 -57.642 -51.048 1.00 82.05 ? 32 MET D CG 1 ATOM 4529 S SD . MET D 4 32 ? 6.716 -58.803 -50.290 1.00 85.66 ? 32 MET D SD 1 ATOM 4530 C CE . MET D 4 32 ? 7.307 -57.834 -48.893 1.00 81.17 ? 32 MET D CE 1 ATOM 4531 N N . TYR D 4 33 ? 6.403 -53.155 -51.607 1.00 66.37 ? 33 TYR D N 1 ATOM 4532 C CA . TYR D 4 33 ? 6.969 -51.864 -51.980 1.00 62.62 ? 33 TYR D CA 1 ATOM 4533 C C . TYR D 4 33 ? 8.193 -51.519 -51.132 1.00 59.77 ? 33 TYR D C 1 ATOM 4534 O O . TYR D 4 33 ? 8.243 -51.856 -49.953 1.00 60.12 ? 33 TYR D O 1 ATOM 4535 C CB . TYR D 4 33 ? 5.904 -50.766 -51.836 1.00 62.41 ? 33 TYR D CB 1 ATOM 4536 C CG . TYR D 4 33 ? 4.603 -51.000 -52.594 1.00 65.73 ? 33 TYR D CG 1 ATOM 4537 C CD1 . TYR D 4 33 ? 3.705 -51.993 -52.200 1.00 69.27 ? 33 TYR D CD1 1 ATOM 4538 C CD2 . TYR D 4 33 ? 4.255 -50.201 -53.685 1.00 66.48 ? 33 TYR D CD2 1 ATOM 4539 C CE1 . TYR D 4 33 ? 2.515 -52.206 -52.885 1.00 72.92 ? 33 TYR D CE1 1 ATOM 4540 C CE2 . TYR D 4 33 ? 3.055 -50.405 -54.379 1.00 69.88 ? 33 TYR D CE2 1 ATOM 4541 C CZ . TYR D 4 33 ? 2.194 -51.412 -53.971 1.00 73.16 ? 33 TYR D CZ 1 ATOM 4542 O OH . TYR D 4 33 ? 1.011 -51.629 -54.640 0.70 77.38 ? 33 TYR D OH 1 ATOM 4543 N N . TRP D 4 34 ? 9.175 -50.861 -51.745 1.00 57.70 ? 34 TRP D N 1 ATOM 4544 C CA . TRP D 4 34 ? 10.315 -50.293 -51.024 1.00 55.76 ? 34 TRP D CA 1 ATOM 4545 C C . TRP D 4 34 ? 10.257 -48.775 -51.047 1.00 53.83 ? 34 TRP D C 1 ATOM 4546 O O . TRP D 4 34 ? 10.028 -48.178 -52.100 1.00 54.18 ? 34 TRP D O 1 ATOM 4547 C CB . TRP D 4 34 ? 11.643 -50.750 -51.628 1.00 56.22 ? 34 TRP D CB 1 ATOM 4548 C CG . TRP D 4 34 ? 12.119 -52.062 -51.106 1.00 58.90 ? 34 TRP D CG 1 ATOM 4549 C CD1 . TRP D 4 34 ? 12.189 -53.242 -51.791 1.00 62.21 ? 34 TRP D CD1 1 ATOM 4550 C CD2 . TRP D 4 34 ? 12.593 -52.339 -49.786 1.00 59.53 ? 34 TRP D CD2 1 ATOM 4551 N NE1 . TRP D 4 34 ? 12.676 -54.239 -50.978 1.00 64.35 ? 34 TRP D NE1 1 ATOM 4552 C CE2 . TRP D 4 34 ? 12.929 -53.711 -49.741 1.00 62.83 ? 34 TRP D CE2 1 ATOM 4553 C CE3 . TRP D 4 34 ? 12.765 -51.562 -48.634 1.00 58.26 ? 34 TRP D CE3 1 ATOM 4554 C CZ2 . TRP D 4 34 ? 13.428 -54.320 -48.593 1.00 65.09 ? 34 TRP D CZ2 1 ATOM 4555 C CZ3 . TRP D 4 34 ? 13.261 -52.172 -47.488 1.00 60.11 ? 34 TRP D CZ3 1 ATOM 4556 C CH2 . TRP D 4 34 ? 13.587 -53.538 -47.478 1.00 63.53 ? 34 TRP D CH2 1 ATOM 4557 N N . TYR D 4 35 ? 10.480 -48.152 -49.893 1.00 52.59 ? 35 TYR D N 1 ATOM 4558 C CA . TYR D 4 35 ? 10.448 -46.693 -49.789 1.00 51.39 ? 35 TYR D CA 1 ATOM 4559 C C . TYR D 4 35 ? 11.669 -46.089 -49.089 1.00 50.44 ? 35 TYR D C 1 ATOM 4560 O O . TYR D 4 35 ? 12.319 -46.735 -48.271 1.00 50.55 ? 35 TYR D O 1 ATOM 4561 C CB . TYR D 4 35 ? 9.203 -46.243 -49.040 1.00 52.06 ? 35 TYR D CB 1 ATOM 4562 C CG . TYR D 4 35 ? 7.881 -46.510 -49.713 1.00 53.46 ? 35 TYR D CG 1 ATOM 4563 C CD1 . TYR D 4 35 ? 7.235 -47.734 -49.560 1.00 54.70 ? 35 TYR D CD1 1 ATOM 4564 C CD2 . TYR D 4 35 ? 7.243 -45.516 -50.452 1.00 54.12 ? 35 TYR D CD2 1 ATOM 4565 C CE1 . TYR D 4 35 ? 6.000 -47.971 -50.149 1.00 57.11 ? 35 TYR D CE1 1 ATOM 4566 C CE2 . TYR D 4 35 ? 6.005 -45.746 -51.048 1.00 56.33 ? 35 TYR D CE2 1 ATOM 4567 C CZ . TYR D 4 35 ? 5.392 -46.977 -50.893 1.00 57.52 ? 35 TYR D CZ 1 ATOM 4568 O OH . TYR D 4 35 ? 4.175 -47.216 -51.479 1.00 59.88 ? 35 TYR D OH 1 ATOM 4569 N N . ARG D 4 36 ? 11.948 -44.829 -49.402 1.00 50.30 ? 36 ARG D N 1 ATOM 4570 C CA . ARG D 4 36 ? 13.020 -44.080 -48.769 1.00 50.20 ? 36 ARG D CA 1 ATOM 4571 C C . ARG D 4 36 ? 12.444 -42.836 -48.094 1.00 50.81 ? 36 ARG D C 1 ATOM 4572 O O . ARG D 4 36 ? 11.627 -42.128 -48.684 1.00 51.61 ? 36 ARG D O 1 ATOM 4573 C CB . ARG D 4 36 ? 14.056 -43.690 -49.821 1.00 50.83 ? 36 ARG D CB 1 ATOM 4574 C CG . ARG D 4 36 ? 15.209 -42.856 -49.309 1.00 51.92 ? 36 ARG D CG 1 ATOM 4575 C CD . ARG D 4 36 ? 16.123 -42.438 -50.444 1.00 54.25 ? 36 ARG D CD 1 ATOM 4576 N NE . ARG D 4 36 ? 17.287 -41.709 -49.944 1.00 56.02 ? 36 ARG D NE 1 ATOM 4577 C CZ . ARG D 4 36 ? 18.306 -41.291 -50.691 1.00 58.70 ? 36 ARG D CZ 1 ATOM 4578 N NH1 . ARG D 4 36 ? 18.330 -41.513 -52.004 1.00 59.69 ? 36 ARG D NH1 1 ATOM 4579 N NH2 . ARG D 4 36 ? 19.308 -40.640 -50.116 1.00 60.99 ? 36 ARG D NH2 1 ATOM 4580 N N . GLN D 4 37 ? 12.867 -42.579 -46.857 1.00 51.25 ? 37 GLN D N 1 ATOM 4581 C CA . GLN D 4 37 ? 12.453 -41.379 -46.126 1.00 52.69 ? 37 GLN D CA 1 ATOM 4582 C C . GLN D 4 37 ? 13.625 -40.451 -45.801 1.00 53.86 ? 37 GLN D C 1 ATOM 4583 O O . GLN D 4 37 ? 14.609 -40.863 -45.179 1.00 53.84 ? 37 GLN D O 1 ATOM 4584 C CB . GLN D 4 37 ? 11.703 -41.747 -44.845 1.00 53.32 ? 37 GLN D CB 1 ATOM 4585 C CG . GLN D 4 37 ? 11.059 -40.555 -44.155 1.00 55.29 ? 37 GLN D CG 1 ATOM 4586 C CD . GLN D 4 37 ? 9.979 -40.952 -43.167 1.00 57.13 ? 37 GLN D CD 1 ATOM 4587 O OE1 . GLN D 4 37 ? 10.237 -41.659 -42.192 1.00 57.83 ? 37 GLN D OE1 1 ATOM 4588 N NE2 . GLN D 4 37 ? 8.761 -40.485 -43.408 1.00 58.56 ? 37 GLN D NE2 1 ATOM 4589 N N . ASP D 4 38 ? 13.498 -39.196 -46.229 1.00 55.69 ? 38 ASP D N 1 ATOM 4590 C CA . ASP D 4 38 ? 14.480 -38.147 -45.950 1.00 57.78 ? 38 ASP D CA 1 ATOM 4591 C C . ASP D 4 38 ? 13.746 -36.881 -45.523 1.00 60.42 ? 38 ASP D C 1 ATOM 4592 O O . ASP D 4 38 ? 12.646 -36.616 -46.002 1.00 61.09 ? 38 ASP D O 1 ATOM 4593 C CB . ASP D 4 38 ? 15.327 -37.868 -47.193 1.00 58.66 ? 38 ASP D CB 1 ATOM 4594 C CG . ASP D 4 38 ? 16.040 -39.109 -47.710 1.00 56.99 ? 38 ASP D CG 1 ATOM 4595 N N . THR D 4 39 ? 14.350 -36.101 -44.629 1.00 62.75 ? 39 THR D N 1 ATOM 4596 C CA . THR D 4 39 ? 13.682 -34.912 -44.074 1.00 66.29 ? 39 THR D CA 1 ATOM 4597 C C . THR D 4 39 ? 13.201 -33.936 -45.148 1.00 68.75 ? 39 THR D C 1 ATOM 4598 O O . THR D 4 39 ? 13.822 -33.807 -46.209 1.00 68.87 ? 39 THR D O 1 ATOM 4599 C CB . THR D 4 39 ? 14.553 -34.160 -43.030 1.00 69.14 ? 39 THR D CB 1 ATOM 4600 O OG1 . THR D 4 39 ? 15.909 -34.076 -43.488 1.00 69.44 ? 39 THR D OG1 1 ATOM 4601 C CG2 . THR D 4 39 ? 14.508 -34.873 -41.680 1.00 68.48 ? 39 THR D CG2 1 ATOM 4602 N N . GLY D 4 40 ? 12.083 -33.269 -44.861 1.00 71.46 ? 40 GLY D N 1 ATOM 4603 C CA . GLY D 4 40 ? 11.434 -32.358 -45.807 1.00 74.72 ? 40 GLY D CA 1 ATOM 4604 C C . GLY D 4 40 ? 11.140 -32.982 -47.163 1.00 72.65 ? 40 GLY D C 1 ATOM 4605 O O . GLY D 4 40 ? 11.383 -32.360 -48.202 1.00 75.02 ? 40 GLY D O 1 ATOM 4606 N N . HIS D 4 41 ? 10.621 -34.210 -47.158 1.00 68.92 ? 41 HIS D N 1 ATOM 4607 C CA . HIS D 4 41 ? 10.359 -34.927 -48.405 1.00 67.10 ? 41 HIS D CA 1 ATOM 4608 C C . HIS D 4 41 ? 9.068 -35.729 -48.455 1.00 65.98 ? 41 HIS D C 1 ATOM 4609 O O . HIS D 4 41 ? 8.233 -35.509 -49.334 1.00 68.09 ? 41 HIS D O 1 ATOM 4610 C CB . HIS D 4 41 ? 11.551 -35.805 -48.797 1.00 64.17 ? 41 HIS D CB 1 ATOM 4611 C CG . HIS D 4 41 ? 12.312 -35.286 -49.974 1.00 66.37 ? 41 HIS D CG 1 ATOM 4612 N ND1 . HIS D 4 41 ? 12.901 -34.040 -49.988 1.00 70.72 ? 41 HIS D ND1 1 ATOM 4613 C CD2 . HIS D 4 41 ? 12.569 -35.839 -51.182 1.00 66.28 ? 41 HIS D CD2 1 ATOM 4614 C CE1 . HIS D 4 41 ? 13.493 -33.849 -51.154 1.00 72.83 ? 41 HIS D CE1 1 ATOM 4615 N NE2 . HIS D 4 41 ? 13.306 -34.925 -51.897 1.00 70.45 ? 41 HIS D NE2 1 ATOM 4616 N N . GLY D 4 42 ? 8.907 -36.667 -47.530 1.00 63.37 ? 42 GLY D N 1 ATOM 4617 C CA . GLY D 4 42 ? 7.828 -37.644 -47.644 1.00 62.35 ? 42 GLY D CA 1 ATOM 4618 C C . GLY D 4 42 ? 8.349 -38.858 -48.389 1.00 58.89 ? 42 GLY D C 1 ATOM 4619 O O . GLY D 4 42 ? 9.344 -38.766 -49.114 1.00 57.98 ? 42 GLY D O 1 ATOM 4620 N N . LEU D 4 43 ? 7.688 -39.998 -48.207 1.00 57.57 ? 43 LEU D N 1 ATOM 4621 C CA . LEU D 4 43 ? 8.198 -41.260 -48.726 1.00 54.82 ? 43 LEU D CA 1 ATOM 4622 C C . LEU D 4 43 ? 8.189 -41.283 -50.249 1.00 55.20 ? 43 LEU D C 1 ATOM 4623 O O . LEU D 4 43 ? 7.245 -40.804 -50.882 1.00 57.44 ? 43 LEU D O 1 ATOM 4624 C CB . LEU D 4 43 ? 7.412 -42.448 -48.168 1.00 54.84 ? 43 LEU D CB 1 ATOM 4625 C CG . LEU D 4 43 ? 7.630 -42.871 -46.716 1.00 54.13 ? 43 LEU D CG 1 ATOM 4626 C CD1 . LEU D 4 43 ? 6.895 -41.939 -45.779 1.00 56.77 ? 43 LEU D CD1 1 ATOM 4627 C CD2 . LEU D 4 43 ? 7.152 -44.295 -46.505 1.00 53.80 ? 43 LEU D CD2 1 ATOM 4628 N N . ARG D 4 44 ? 9.262 -41.827 -50.820 1.00 53.62 ? 44 ARG D N 1 ATOM 4629 C CA . ARG D 4 44 ? 9.405 -41.979 -52.264 1.00 54.36 ? 44 ARG D CA 1 ATOM 4630 C C . ARG D 4 44 ? 9.598 -43.458 -52.605 1.00 53.47 ? 44 ARG D C 1 ATOM 4631 O O . ARG D 4 44 ? 10.228 -44.198 -51.850 1.00 52.00 ? 44 ARG D O 1 ATOM 4632 C CB . ARG D 4 44 ? 10.581 -41.144 -52.781 1.00 54.93 ? 44 ARG D CB 1 ATOM 4633 C CG . ARG D 4 44 ? 10.402 -39.632 -52.644 1.00 56.99 ? 44 ARG D CG 1 ATOM 4634 C CD . ARG D 4 44 ? 11.638 -38.871 -53.110 1.00 58.36 ? 44 ARG D CD 1 ATOM 4635 N N . LEU D 4 45 ? 9.043 -43.886 -53.735 1.00 55.04 ? 45 LEU D N 1 ATOM 4636 C CA . LEU D 4 45 ? 9.093 -45.288 -54.137 1.00 55.14 ? 45 LEU D CA 1 ATOM 4637 C C . LEU D 4 45 ? 10.386 -45.599 -54.887 1.00 55.50 ? 45 LEU D C 1 ATOM 4638 O O . LEU D 4 45 ? 10.782 -44.852 -55.784 1.00 57.18 ? 45 LEU D O 1 ATOM 4639 C CB . LEU D 4 45 ? 7.865 -45.644 -54.985 1.00 57.32 ? 45 LEU D CB 1 ATOM 4640 C CG . LEU D 4 45 ? 7.664 -47.106 -55.392 1.00 58.14 ? 45 LEU D CG 1 ATOM 4641 C CD1 . LEU D 4 45 ? 7.425 -47.993 -54.188 1.00 57.09 ? 45 LEU D CD1 1 ATOM 4642 C CD2 . LEU D 4 45 ? 6.507 -47.221 -56.359 1.00 61.54 ? 45 LEU D CD2 1 ATOM 4643 N N . ILE D 4 46 ? 11.038 -46.699 -54.519 1.00 54.92 ? 46 ILE D N 1 ATOM 4644 C CA . ILE D 4 46 ? 12.303 -47.093 -55.143 1.00 55.99 ? 46 ILE D CA 1 ATOM 4645 C C . ILE D 4 46 ? 12.107 -48.241 -56.132 1.00 58.29 ? 46 ILE D C 1 ATOM 4646 O O . ILE D 4 46 ? 12.420 -48.103 -57.313 1.00 60.51 ? 46 ILE D O 1 ATOM 4647 C CB . ILE D 4 46 ? 13.377 -47.436 -54.081 1.00 54.92 ? 46 ILE D CB 1 ATOM 4648 C CG1 . ILE D 4 46 ? 13.763 -46.179 -53.307 1.00 53.49 ? 46 ILE D CG1 1 ATOM 4649 C CG2 . ILE D 4 46 ? 14.622 -48.034 -54.722 1.00 57.07 ? 46 ILE D CG2 1 ATOM 4650 C CD1 . ILE D 4 46 ? 14.405 -46.467 -51.980 1.00 53.13 ? 46 ILE D CD1 1 ATOM 4651 N N . HIS D 4 47 ? 11.603 -49.368 -55.631 1.00 58.58 ? 47 HIS D N 1 ATOM 4652 C CA . HIS D 4 47 ? 11.211 -50.517 -56.451 1.00 61.49 ? 47 HIS D CA 1 ATOM 4653 C C . HIS D 4 47 ? 9.929 -51.119 -55.886 1.00 61.87 ? 47 HIS D C 1 ATOM 4654 O O . HIS D 4 47 ? 9.616 -50.922 -54.715 1.00 60.36 ? 47 HIS D O 1 ATOM 4655 C CB . HIS D 4 47 ? 12.302 -51.586 -56.448 1.00 63.15 ? 47 HIS D CB 1 ATOM 4656 C CG . HIS D 4 47 ? 13.523 -51.220 -57.234 1.00 64.73 ? 47 HIS D CG 1 ATOM 4657 N ND1 . HIS D 4 47 ? 13.495 -50.989 -58.592 1.00 67.38 ? 47 HIS D ND1 1 ATOM 4658 C CD2 . HIS D 4 47 ? 14.815 -51.073 -56.855 1.00 65.19 ? 47 HIS D CD2 1 ATOM 4659 C CE1 . HIS D 4 47 ? 14.713 -50.698 -59.013 1.00 69.18 ? 47 HIS D CE1 1 ATOM 4660 N NE2 . HIS D 4 47 ? 15.533 -50.742 -57.979 1.00 67.88 ? 47 HIS D NE2 1 ATOM 4661 N N . TYR D 4 48 ? 9.192 -51.856 -56.708 1.00 64.85 ? 48 TYR D N 1 ATOM 4662 C CA . TYR D 4 48 ? 7.958 -52.508 -56.259 1.00 66.48 ? 48 TYR D CA 1 ATOM 4663 C C . TYR D 4 48 ? 7.700 -53.810 -57.024 1.00 70.74 ? 48 TYR D C 1 ATOM 4664 O O . TYR D 4 48 ? 8.236 -54.011 -58.114 1.00 72.72 ? 48 TYR D O 1 ATOM 4665 C CB . TYR D 4 48 ? 6.763 -51.547 -56.365 1.00 66.27 ? 48 TYR D CB 1 ATOM 4666 C CG . TYR D 4 48 ? 6.402 -51.138 -57.780 1.00 68.55 ? 48 TYR D CG 1 ATOM 4667 C CD1 . TYR D 4 48 ? 7.293 -50.414 -58.571 1.00 68.26 ? 48 TYR D CD1 1 ATOM 4668 C CD2 . TYR D 4 48 ? 5.163 -51.460 -58.320 1.00 71.83 ? 48 TYR D CD2 1 ATOM 4669 C CE1 . TYR D 4 48 ? 6.967 -50.037 -59.864 1.00 70.96 ? 48 TYR D CE1 1 ATOM 4670 C CE2 . TYR D 4 48 ? 4.824 -51.082 -59.611 1.00 74.65 ? 48 TYR D CE2 1 ATOM 4671 C CZ . TYR D 4 48 ? 5.730 -50.373 -60.380 1.00 74.21 ? 48 TYR D CZ 1 ATOM 4672 O OH . TYR D 4 48 ? 5.399 -49.998 -61.667 1.00 77.69 ? 48 TYR D OH 1 ATOM 4673 N N . SER D 4 49 ? 6.885 -54.692 -56.455 1.00 72.96 ? 49 SER D N 1 ATOM 4674 C CA . SER D 4 49 ? 6.682 -56.013 -57.037 1.00 77.83 ? 49 SER D CA 1 ATOM 4675 C C . SER D 4 49 ? 5.225 -56.458 -57.010 1.00 81.32 ? 49 SER D C 1 ATOM 4676 O O . SER D 4 49 ? 4.607 -56.522 -55.948 1.00 81.34 ? 49 SER D O 1 ATOM 4677 C CB . SER D 4 49 ? 7.563 -57.044 -56.332 1.00 78.99 ? 49 SER D CB 1 ATOM 4678 O OG . SER D 4 49 ? 7.458 -58.306 -56.964 1.00 84.94 ? 49 SER D OG 1 ATOM 4679 N N . TYR D 4 50 ? 4.699 -56.783 -58.190 1.00 85.06 ? 50 TYR D N 1 ATOM 4680 C CA . TYR D 4 50 ? 3.313 -57.222 -58.349 1.00 89.40 ? 50 TYR D CA 1 ATOM 4681 C C . TYR D 4 50 ? 3.108 -58.695 -58.017 1.00 94.57 ? 50 TYR D C 1 ATOM 4682 O O . TYR D 4 50 ? 2.012 -59.231 -58.206 1.00 99.50 ? 50 TYR D O 1 ATOM 4683 C CB . TYR D 4 50 ? 2.827 -56.952 -59.772 1.00 91.99 ? 50 TYR D CB 1 ATOM 4684 C CG . TYR D 4 50 ? 2.326 -55.550 -59.995 1.00 89.38 ? 50 TYR D CG 1 ATOM 4685 C CD1 . TYR D 4 50 ? 1.089 -55.143 -59.496 1.00 90.49 ? 50 TYR D CD1 1 ATOM 4686 C CD2 . TYR D 4 50 ? 3.081 -54.629 -60.717 1.00 86.73 ? 50 TYR D CD2 1 ATOM 4687 C CE1 . TYR D 4 50 ? 0.620 -53.847 -59.703 1.00 89.02 ? 50 TYR D CE1 1 ATOM 4688 C CE2 . TYR D 4 50 ? 2.620 -53.334 -60.934 1.00 85.36 ? 50 TYR D CE2 1 ATOM 4689 C CZ . TYR D 4 50 ? 1.391 -52.950 -60.423 1.00 86.41 ? 50 TYR D CZ 1 ATOM 4690 O OH . TYR D 4 50 ? 0.935 -51.670 -60.633 1.00 85.85 ? 50 TYR D OH 1 ATOM 4691 N N . GLY D 4 51 ? 4.157 -59.344 -57.522 1.00 94.25 ? 51 GLY D N 1 ATOM 4692 C CA . GLY D 4 51 ? 4.093 -60.764 -57.190 1.00 99.92 ? 51 GLY D CA 1 ATOM 4693 C C . GLY D 4 51 ? 5.453 -61.425 -57.165 1.00 100.45 ? 51 GLY D C 1 ATOM 4694 O O . GLY D 4 51 ? 6.484 -60.750 -57.251 1.00 95.98 ? 51 GLY D O 1 ATOM 4695 N N . ALA D 4 52 ? 5.445 -62.752 -57.048 1.00 106.63 ? 52 ALA D N 1 ATOM 4696 C CA . ALA D 4 52 ? 6.665 -63.551 -57.027 1.00 109.03 ? 52 ALA D CA 1 ATOM 4697 C C . ALA D 4 52 ? 7.393 -63.465 -58.363 1.00 109.82 ? 52 ALA D C 1 ATOM 4698 O O . ALA D 4 52 ? 6.760 -63.368 -59.416 1.00 111.82 ? 52 ALA D O 1 ATOM 4699 C CB . ALA D 4 52 ? 6.339 -64.995 -56.689 1.00 116.86 ? 52 ALA D CB 1 ATOM 4700 N N . GLY D 4 53 ? 8.723 -63.488 -58.307 1.00 109.02 ? 53 GLY D N 1 ATOM 4701 C CA . GLY D 4 53 ? 9.570 -63.401 -59.498 1.00 110.70 ? 53 GLY D CA 1 ATOM 4702 C C . GLY D 4 53 ? 9.383 -62.137 -60.323 1.00 106.65 ? 53 GLY D C 1 ATOM 4703 O O . GLY D 4 53 ? 9.494 -62.179 -61.549 1.00 109.77 ? 53 GLY D O 1 ATOM 4704 N N . SER D 4 54 ? 9.106 -61.017 -59.654 1.00 100.50 ? 54 SER D N 1 ATOM 4705 C CA . SER D 4 54 ? 8.824 -59.750 -60.331 1.00 97.10 ? 54 SER D CA 1 ATOM 4706 C C . SER D 4 54 ? 9.554 -58.569 -59.708 1.00 91.12 ? 54 SER D C 1 ATOM 4707 O O . SER D 4 54 ? 9.700 -58.490 -58.488 1.00 88.42 ? 54 SER D O 1 ATOM 4708 C CB . SER D 4 54 ? 7.321 -59.468 -60.329 1.00 97.11 ? 54 SER D CB 1 ATOM 4709 O OG . SER D 4 54 ? 7.060 -58.120 -60.686 1.00 93.32 ? 54 SER D OG 1 ATOM 4710 N N . THR D 4 55 ? 9.995 -57.646 -60.558 1.00 89.94 ? 55 THR D N 1 ATOM 4711 C CA . THR D 4 55 ? 10.658 -56.414 -60.114 1.00 84.98 ? 55 THR D CA 1 ATOM 4712 C C . THR D 4 55 ? 10.357 -55.265 -61.064 1.00 84.11 ? 55 THR D C 1 ATOM 4713 O O . THR D 4 55 ? 10.425 -55.425 -62.285 1.00 88.01 ? 55 THR D O 1 ATOM 4714 C CB . THR D 4 55 ? 12.200 -56.579 -59.957 1.00 85.47 ? 55 THR D CB 1 ATOM 4715 O OG1 . THR D 4 55 ? 12.813 -55.286 -59.840 1.00 81.94 ? 55 THR D OG1 1 ATOM 4716 C CG2 . THR D 4 55 ? 12.817 -57.333 -61.151 1.00 91.39 ? 55 THR D CG2 1 ATOM 4717 N N . GLU D 4 56 ? 10.030 -54.108 -60.496 1.00 79.76 ? 56 GLU D N 1 ATOM 4718 C CA . GLU D 4 56 ? 9.651 -52.941 -61.293 1.00 79.55 ? 56 GLU D CA 1 ATOM 4719 C C . GLU D 4 56 ? 10.227 -51.648 -60.727 1.00 75.48 ? 56 GLU D C 1 ATOM 4720 O O . GLU D 4 56 ? 10.056 -51.348 -59.547 1.00 72.00 ? 56 GLU D O 1 ATOM 4721 C CB . GLU D 4 56 ? 8.121 -52.834 -61.422 1.00 80.50 ? 56 GLU D CB 1 ATOM 4722 C CG . GLU D 4 56 ? 7.429 -53.988 -62.161 1.00 85.57 ? 56 GLU D CG 1 ATOM 4723 C CD . GLU D 4 56 ? 7.920 -54.179 -63.594 0.70 90.50 ? 56 GLU D CD 1 ATOM 4724 O OE1 . GLU D 4 56 ? 8.234 -53.172 -64.269 0.70 90.69 ? 56 GLU D OE1 1 ATOM 4725 O OE2 . GLU D 4 56 ? 7.989 -55.343 -64.048 0.70 94.67 ? 56 GLU D OE2 1 ATOM 4726 N N . LYS D 4 57 ? 10.908 -50.890 -61.582 1.00 76.79 ? 57 LYS D N 1 ATOM 4727 C CA . LYS D 4 57 ? 11.497 -49.607 -61.198 1.00 74.27 ? 57 LYS D CA 1 ATOM 4728 C C . LYS D 4 57 ? 10.421 -48.619 -60.758 1.00 72.17 ? 57 LYS D C 1 ATOM 4729 O O . LYS D 4 57 ? 9.409 -48.449 -61.438 1.00 74.33 ? 57 LYS D O 1 ATOM 4730 C CB . LYS D 4 57 ? 12.302 -49.008 -62.358 1.00 77.63 ? 57 LYS D CB 1 ATOM 4731 C CG . LYS D 4 57 ? 13.440 -49.880 -62.868 1.00 80.81 ? 57 LYS D CG 1 ATOM 4732 C CD . LYS D 4 57 ? 14.183 -49.197 -64.006 1.00 84.95 ? 57 LYS D CD 1 ATOM 4733 N N . GLY D 4 58 ? 10.645 -47.979 -59.615 1.00 68.76 ? 58 GLY D N 1 ATOM 4734 C CA . GLY D 4 58 ? 9.727 -46.965 -59.095 1.00 67.38 ? 58 GLY D CA 1 ATOM 4735 C C . GLY D 4 58 ? 10.068 -45.586 -59.621 1.00 68.54 ? 58 GLY D C 1 ATOM 4736 O O . GLY D 4 58 ? 10.304 -45.415 -60.816 1.00 71.90 ? 58 GLY D O 1 ATOM 4737 N N . ASP D 4 59 ? 10.097 -44.602 -58.729 1.00 66.65 ? 59 ASP D N 1 ATOM 4738 C CA . ASP D 4 59 ? 10.414 -43.227 -59.116 1.00 68.61 ? 59 ASP D CA 1 ATOM 4739 C C . ASP D 4 59 ? 11.889 -42.888 -58.908 1.00 68.39 ? 59 ASP D C 1 ATOM 4740 O O . ASP D 4 59 ? 12.484 -42.188 -59.732 1.00 71.62 ? 59 ASP D O 1 ATOM 4741 C CB . ASP D 4 59 ? 9.513 -42.228 -58.387 1.00 68.09 ? 59 ASP D CB 1 ATOM 4742 C CG . ASP D 4 59 ? 8.068 -42.313 -58.839 1.00 70.21 ? 59 ASP D CG 1 ATOM 4743 N N . ILE D 4 60 ? 12.474 -43.382 -57.815 1.00 65.35 ? 60 ILE D N 1 ATOM 4744 C CA . ILE D 4 60 ? 13.913 -43.212 -57.563 1.00 65.55 ? 60 ILE D CA 1 ATOM 4745 C C . ILE D 4 60 ? 14.658 -44.557 -57.461 1.00 65.04 ? 60 ILE D C 1 ATOM 4746 O O . ILE D 4 60 ? 14.936 -45.032 -56.355 1.00 62.81 ? 60 ILE D O 1 ATOM 4747 C CB . ILE D 4 60 ? 14.206 -42.300 -56.321 1.00 63.74 ? 60 ILE D CB 1 ATOM 4748 C CG1 . ILE D 4 60 ? 13.443 -42.768 -55.076 1.00 60.28 ? 60 ILE D CG1 1 ATOM 4749 C CG2 . ILE D 4 60 ? 13.882 -40.845 -56.633 1.00 66.13 ? 60 ILE D CG2 1 ATOM 4750 N N . PRO D 4 61 ? 14.985 -45.173 -58.618 1.00 67.90 ? 61 PRO D N 1 ATOM 4751 C CA . PRO D 4 61 ? 15.583 -46.510 -58.642 1.00 68.57 ? 61 PRO D CA 1 ATOM 4752 C C . PRO D 4 61 ? 17.105 -46.568 -58.869 1.00 71.30 ? 61 PRO D C 1 ATOM 4753 O O . PRO D 4 61 ? 17.689 -47.655 -58.802 1.00 72.43 ? 61 PRO D O 1 ATOM 4754 C CB . PRO D 4 61 ? 14.863 -47.173 -59.818 1.00 71.19 ? 61 PRO D CB 1 ATOM 4755 C CG . PRO D 4 61 ? 14.463 -46.025 -60.727 1.00 73.35 ? 61 PRO D CG 1 ATOM 4756 C CD . PRO D 4 61 ? 14.649 -44.726 -59.979 1.00 71.48 ? 61 PRO D CD 1 ATOM 4757 N N . ASP D 4 62 ? 17.729 -45.419 -59.128 1.00 73.03 ? 62 ASP D N 1 ATOM 4758 C CA . ASP D 4 62 ? 19.154 -45.354 -59.470 1.00 76.81 ? 62 ASP D CA 1 ATOM 4759 C C . ASP D 4 62 ? 20.064 -45.710 -58.292 1.00 75.41 ? 62 ASP D C 1 ATOM 4760 O O . ASP D 4 62 ? 20.189 -44.947 -57.337 1.00 73.22 ? 62 ASP D O 1 ATOM 4761 C CB . ASP D 4 62 ? 19.517 -43.974 -60.038 1.00 79.94 ? 62 ASP D CB 1 ATOM 4762 C CG . ASP D 4 62 ? 19.054 -43.790 -61.472 1.00 83.78 ? 62 ASP D CG 1 ATOM 4763 N N . GLY D 4 63 ? 20.693 -46.879 -58.376 1.00 77.44 ? 63 GLY D N 1 ATOM 4764 C CA . GLY D 4 63 ? 21.609 -47.355 -57.342 1.00 77.23 ? 63 GLY D CA 1 ATOM 4765 C C . GLY D 4 63 ? 21.070 -48.543 -56.568 1.00 74.67 ? 63 GLY D C 1 ATOM 4766 O O . GLY D 4 63 ? 21.748 -49.072 -55.686 1.00 75.17 ? 63 GLY D O 1 ATOM 4767 N N . TYR D 4 64 ? 19.857 -48.967 -56.911 1.00 72.79 ? 65 TYR D N 1 ATOM 4768 C CA . TYR D 4 64 ? 19.166 -50.020 -56.177 1.00 70.92 ? 65 TYR D CA 1 ATOM 4769 C C . TYR D 4 64 ? 18.669 -51.121 -57.103 1.00 73.43 ? 65 TYR D C 1 ATOM 4770 O O . TYR D 4 64 ? 18.198 -50.843 -58.207 1.00 74.72 ? 65 TYR D O 1 ATOM 4771 C CB . TYR D 4 64 ? 17.956 -49.445 -55.441 1.00 66.63 ? 65 TYR D CB 1 ATOM 4772 C CG . TYR D 4 64 ? 18.230 -48.270 -54.518 1.00 64.55 ? 65 TYR D CG 1 ATOM 4773 C CD1 . TYR D 4 64 ? 18.517 -48.474 -53.165 1.00 62.93 ? 65 TYR D CD1 1 ATOM 4774 C CD2 . TYR D 4 64 ? 18.163 -46.953 -54.989 1.00 64.37 ? 65 TYR D CD2 1 ATOM 4775 C CE1 . TYR D 4 64 ? 18.755 -47.405 -52.313 1.00 61.08 ? 65 TYR D CE1 1 ATOM 4776 C CE2 . TYR D 4 64 ? 18.401 -45.874 -54.142 1.00 62.78 ? 65 TYR D CE2 1 ATOM 4777 C CZ . TYR D 4 64 ? 18.696 -46.111 -52.807 1.00 61.23 ? 65 TYR D CZ 1 ATOM 4778 O OH . TYR D 4 64 ? 18.929 -45.052 -51.960 1.00 60.82 ? 65 TYR D OH 1 ATOM 4779 N N . LYS D 4 65 ? 18.761 -52.364 -56.638 1.00 74.77 ? 66 LYS D N 1 ATOM 4780 C CA . LYS D 4 65 ? 18.187 -53.522 -57.338 1.00 77.46 ? 66 LYS D CA 1 ATOM 4781 C C . LYS D 4 65 ? 17.258 -54.289 -56.401 1.00 75.71 ? 66 LYS D C 1 ATOM 4782 O O . LYS D 4 65 ? 17.640 -54.624 -55.279 1.00 75.41 ? 66 LYS D O 1 ATOM 4783 C CB . LYS D 4 65 ? 19.282 -54.465 -57.862 1.00 83.09 ? 66 LYS D CB 1 ATOM 4784 C CG . LYS D 4 65 ? 20.055 -53.948 -59.065 1.00 86.51 ? 66 LYS D CG 1 ATOM 4785 N N . ALA D 4 66 ? 16.039 -54.558 -56.856 1.00 75.28 ? 67 ALA D N 1 ATOM 4786 C CA . ALA D 4 66 ? 15.095 -55.362 -56.085 1.00 74.77 ? 67 ALA D CA 1 ATOM 4787 C C . ALA D 4 66 ? 15.106 -56.816 -56.548 1.00 79.97 ? 67 ALA D C 1 ATOM 4788 O O . ALA D 4 66 ? 15.470 -57.112 -57.690 1.00 83.67 ? 67 ALA D O 1 ATOM 4789 C CB . ALA D 4 66 ? 13.708 -54.791 -56.205 1.00 72.34 ? 67 ALA D CB 1 ATOM 4790 N N . SER D 4 67 ? 14.704 -57.721 -55.659 1.00 80.99 ? 68 SER D N 1 ATOM 4791 C CA . SER D 4 67 ? 14.577 -59.138 -56.003 1.00 86.36 ? 68 SER D CA 1 ATOM 4792 C C . SER D 4 67 ? 13.488 -59.811 -55.182 1.00 86.97 ? 68 SER D C 1 ATOM 4793 O O . SER D 4 67 ? 13.335 -59.538 -53.990 1.00 84.35 ? 68 SER D O 1 ATOM 4794 C CB . SER D 4 67 ? 15.907 -59.871 -55.804 1.00 90.53 ? 68 SER D CB 1 ATOM 4795 N N . ARG D 4 68 ? 12.736 -60.695 -55.829 1.00 91.03 ? 69 ARG D N 1 ATOM 4796 C CA . ARG D 4 68 ? 11.699 -61.455 -55.147 1.00 93.19 ? 69 ARG D CA 1 ATOM 4797 C C . ARG D 4 68 ? 11.741 -62.933 -55.535 1.00 100.71 ? 69 ARG D C 1 ATOM 4798 O O . ARG D 4 68 ? 11.283 -63.304 -56.614 1.00 103.95 ? 69 ARG D O 1 ATOM 4799 C CB . ARG D 4 68 ? 10.324 -60.850 -55.423 1.00 90.80 ? 69 ARG D CB 1 ATOM 4800 C CG . ARG D 4 68 ? 9.316 -61.159 -54.351 1.00 91.32 ? 69 ARG D CG 1 ATOM 4801 C CD . ARG D 4 68 ? 8.167 -60.198 -54.389 1.00 87.66 ? 69 ARG D CD 1 ATOM 4802 N NE . ARG D 4 68 ? 7.159 -60.537 -53.393 1.00 89.92 ? 69 ARG D NE 1 ATOM 4803 C CZ . ARG D 4 68 ? 5.879 -60.187 -53.473 1.00 90.88 ? 69 ARG D CZ 1 ATOM 4804 N NH1 . ARG D 4 68 ? 5.437 -59.483 -54.508 1.00 89.54 ? 69 ARG D NH1 1 ATOM 4805 N NH2 . ARG D 4 68 ? 5.036 -60.544 -52.514 1.00 93.87 ? 69 ARG D NH2 1 ATOM 4806 N N . PRO D 4 69 ? 12.316 -63.779 -54.658 1.00 104.26 ? 70 PRO D N 1 ATOM 4807 C CA . PRO D 4 69 ? 12.368 -65.226 -54.888 1.00 112.48 ? 70 PRO D CA 1 ATOM 4808 C C . PRO D 4 69 ? 11.114 -65.949 -54.394 1.00 116.16 ? 70 PRO D C 1 ATOM 4809 O O . PRO D 4 69 ? 10.793 -67.033 -54.884 1.00 123.19 ? 70 PRO D O 1 ATOM 4810 C CB . PRO D 4 69 ? 13.594 -65.674 -54.075 1.00 115.01 ? 70 PRO D CB 1 ATOM 4811 C CG . PRO D 4 69 ? 14.177 -64.407 -53.448 1.00 107.59 ? 70 PRO D CG 1 ATOM 4812 C CD . PRO D 4 69 ? 13.091 -63.393 -53.466 1.00 101.45 ? 70 PRO D CD 1 ATOM 4813 N N . SER D 4 70 ? 10.423 -65.345 -53.431 1.00 112.13 ? 71 SER D N 1 ATOM 4814 C CA . SER D 4 70 ? 9.201 -65.900 -52.858 1.00 115.90 ? 71 SER D CA 1 ATOM 4815 C C . SER D 4 70 ? 8.162 -64.798 -52.657 1.00 110.30 ? 71 SER D C 1 ATOM 4816 O O . SER D 4 70 ? 8.495 -63.614 -52.702 1.00 103.44 ? 71 SER D O 1 ATOM 4817 C CB . SER D 4 70 ? 9.507 -66.584 -51.524 1.00 119.80 ? 71 SER D CB 1 ATOM 4818 N N . GLN D 4 71 ? 6.906 -65.189 -52.442 1.00 114.09 ? 72 GLN D N 1 ATOM 4819 C CA . GLN D 4 71 ? 5.834 -64.232 -52.170 1.00 110.35 ? 72 GLN D CA 1 ATOM 4820 C C . GLN D 4 71 ? 6.044 -63.548 -50.819 1.00 106.65 ? 72 GLN D C 1 ATOM 4821 O O . GLN D 4 71 ? 5.805 -62.345 -50.677 1.00 100.95 ? 72 GLN D O 1 ATOM 4822 C CB . GLN D 4 71 ? 4.467 -64.918 -52.211 1.00 116.67 ? 72 GLN D CB 1 ATOM 4823 N N . GLU D 4 72 ? 6.516 -64.321 -49.842 1.00 110.63 ? 73 GLU D N 1 ATOM 4824 C CA . GLU D 4 72 ? 6.675 -63.851 -48.465 1.00 108.72 ? 73 GLU D CA 1 ATOM 4825 C C . GLU D 4 72 ? 7.806 -62.842 -48.268 1.00 101.72 ? 73 GLU D C 1 ATOM 4826 O O . GLU D 4 72 ? 7.733 -62.016 -47.359 1.00 98.39 ? 73 GLU D O 1 ATOM 4827 C CB . GLU D 4 72 ? 6.857 -65.040 -47.508 1.00 116.24 ? 73 GLU D CB 1 ATOM 4828 C CG . GLU D 4 72 ? 5.610 -65.897 -47.317 1.00 123.86 ? 73 GLU D CG 1 ATOM 4829 N N . ASN D 4 73 ? 8.836 -62.903 -49.115 1.00 100.29 ? 74 ASN D N 1 ATOM 4830 C CA . ASN D 4 73 ? 10.041 -62.078 -48.936 1.00 95.26 ? 74 ASN D CA 1 ATOM 4831 C C . ASN D 4 73 ? 10.446 -61.226 -50.145 1.00 90.41 ? 74 ASN D C 1 ATOM 4832 O O . ASN D 4 73 ? 10.316 -61.658 -51.291 1.00 92.41 ? 74 ASN D O 1 ATOM 4833 C CB . ASN D 4 73 ? 11.220 -62.947 -48.485 1.00 99.47 ? 74 ASN D CB 1 ATOM 4834 N N . PHE D 4 74 ? 10.959 -60.025 -49.865 1.00 84.80 ? 75 PHE D N 1 ATOM 4835 C CA . PHE D 4 74 ? 11.289 -59.024 -50.893 1.00 80.47 ? 75 PHE D CA 1 ATOM 4836 C C . PHE D 4 74 ? 12.521 -58.194 -50.500 1.00 77.06 ? 75 PHE D C 1 ATOM 4837 O O . PHE D 4 74 ? 12.478 -57.405 -49.554 1.00 74.02 ? 75 PHE D O 1 ATOM 4838 C CB . PHE D 4 74 ? 10.072 -58.121 -51.141 1.00 77.37 ? 75 PHE D CB 1 ATOM 4839 C CG . PHE D 4 74 ? 10.244 -57.123 -52.258 1.00 73.93 ? 75 PHE D CG 1 ATOM 4840 C CD1 . PHE D 4 74 ? 10.772 -57.501 -53.490 1.00 76.04 ? 75 PHE D CD1 1 ATOM 4841 C CD2 . PHE D 4 74 ? 9.828 -55.804 -52.089 1.00 69.66 ? 75 PHE D CD2 1 ATOM 4842 C CE1 . PHE D 4 74 ? 10.909 -56.567 -54.526 1.00 73.88 ? 75 PHE D CE1 1 ATOM 4843 C CE2 . PHE D 4 74 ? 9.952 -54.869 -53.118 1.00 67.27 ? 75 PHE D CE2 1 ATOM 4844 C CZ . PHE D 4 74 ? 10.498 -55.248 -54.336 1.00 69.24 ? 75 PHE D CZ 1 ATOM 4845 N N . SER D 4 75 ? 13.612 -58.379 -51.241 1.00 78.27 ? 76 SER D N 1 ATOM 4846 C CA . SER D 4 75 ? 14.906 -57.795 -50.880 1.00 76.70 ? 76 SER D CA 1 ATOM 4847 C C . SER D 4 75 ? 15.330 -56.633 -51.780 1.00 73.29 ? 76 SER D C 1 ATOM 4848 O O . SER D 4 75 ? 14.890 -56.523 -52.929 1.00 73.34 ? 76 SER D O 1 ATOM 4849 C CB . SER D 4 75 ? 15.995 -58.878 -50.854 1.00 81.90 ? 76 SER D CB 1 ATOM 4850 N N . LEU D 4 76 ? 16.192 -55.779 -51.229 1.00 71.04 ? 77 LEU D N 1 ATOM 4851 C CA . LEU D 4 76 ? 16.702 -54.587 -51.901 1.00 68.49 ? 77 LEU D CA 1 ATOM 4852 C C . LEU D 4 76 ? 18.230 -54.561 -51.833 1.00 70.71 ? 77 LEU D C 1 ATOM 4853 O O . LEU D 4 76 ? 18.816 -54.579 -50.744 1.00 71.12 ? 77 LEU D O 1 ATOM 4854 C CB . LEU D 4 76 ? 16.109 -53.327 -51.256 1.00 63.92 ? 77 LEU D CB 1 ATOM 4855 C CG . LEU D 4 76 ? 16.505 -51.935 -51.753 1.00 61.41 ? 77 LEU D CG 1 ATOM 4856 C CD1 . LEU D 4 76 ? 16.254 -51.793 -53.241 1.00 62.93 ? 77 LEU D CD1 1 ATOM 4857 C CD2 . LEU D 4 76 ? 15.741 -50.870 -50.995 1.00 57.87 ? 77 LEU D CD2 1 ATOM 4858 N N . ILE D 4 77 ? 18.867 -54.517 -52.999 1.00 72.90 ? 78 ILE D N 1 ATOM 4859 C CA . ILE D 4 77 ? 20.325 -54.607 -53.089 1.00 76.43 ? 78 ILE D CA 1 ATOM 4860 C C . ILE D 4 77 ? 20.962 -53.289 -53.541 1.00 75.24 ? 78 ILE D C 1 ATOM 4861 O O . ILE D 4 77 ? 20.639 -52.762 -54.612 1.00 75.00 ? 78 ILE D O 1 ATOM 4862 C CB . ILE D 4 77 ? 20.768 -55.763 -54.038 1.00 82.09 ? 78 ILE D CB 1 ATOM 4863 C CG1 . ILE D 4 77 ? 20.093 -57.083 -53.651 1.00 84.16 ? 78 ILE D CG1 1 ATOM 4864 C CG2 . ILE D 4 77 ? 22.285 -55.920 -54.039 1.00 86.63 ? 78 ILE D CG2 1 ATOM 4865 N N . LEU D 4 78 ? 21.860 -52.759 -52.712 1.00 75.22 ? 79 LEU D N 1 ATOM 4866 C CA . LEU D 4 78 ? 22.712 -51.643 -53.117 1.00 75.84 ? 79 LEU D CA 1 ATOM 4867 C C . LEU D 4 78 ? 24.070 -52.200 -53.544 1.00 81.93 ? 79 LEU D C 1 ATOM 4868 O O . LEU D 4 78 ? 24.902 -52.543 -52.698 1.00 84.28 ? 79 LEU D O 1 ATOM 4869 C CB . LEU D 4 78 ? 22.869 -50.613 -51.989 1.00 72.89 ? 79 LEU D CB 1 ATOM 4870 C CG . LEU D 4 78 ? 21.691 -49.691 -51.648 1.00 67.70 ? 79 LEU D CG 1 ATOM 4871 C CD1 . LEU D 4 78 ? 20.726 -50.361 -50.678 1.00 65.26 ? 79 LEU D CD1 1 ATOM 4872 C CD2 . LEU D 4 78 ? 22.189 -48.384 -51.059 1.00 65.98 ? 79 LEU D CD2 1 ATOM 4873 N N . GLU D 4 79 ? 24.276 -52.304 -54.857 1.00 85.18 ? 80 GLU D N 1 ATOM 4874 C CA . GLU D 4 79 ? 25.483 -52.922 -55.419 1.00 92.09 ? 80 GLU D CA 1 ATOM 4875 C C . GLU D 4 79 ? 26.755 -52.192 -54.983 1.00 94.71 ? 80 GLU D C 1 ATOM 4876 O O . GLU D 4 79 ? 27.651 -52.795 -54.383 1.00 98.67 ? 80 GLU D O 1 ATOM 4877 C CB . GLU D 4 79 ? 25.395 -53.000 -56.949 1.00 95.33 ? 80 GLU D CB 1 ATOM 4878 N N . LEU D 4 80 ? 26.817 -50.898 -55.287 1.00 93.16 ? 81 LEU D N 1 ATOM 4879 C CA . LEU D 4 80 ? 27.904 -50.039 -54.841 1.00 95.52 ? 81 LEU D CA 1 ATOM 4880 C C . LEU D 4 80 ? 27.312 -48.943 -53.969 1.00 89.79 ? 81 LEU D C 1 ATOM 4881 O O . LEU D 4 80 ? 26.664 -48.022 -54.474 1.00 87.19 ? 81 LEU D O 1 ATOM 4882 C CB . LEU D 4 80 ? 28.652 -49.437 -56.034 1.00 100.90 ? 81 LEU D CB 1 ATOM 4883 C CG . LEU D 4 80 ? 29.487 -50.388 -56.893 1.00 108.29 ? 81 LEU D CG 1 ATOM 4884 N N . ALA D 4 81 ? 27.526 -49.059 -52.659 1.00 88.56 ? 82 ALA D N 1 ATOM 4885 C CA . ALA D 4 81 ? 26.941 -48.138 -51.682 1.00 83.66 ? 82 ALA D CA 1 ATOM 4886 C C . ALA D 4 81 ? 27.544 -46.739 -51.767 1.00 85.25 ? 82 ALA D C 1 ATOM 4887 O O . ALA D 4 81 ? 28.752 -46.579 -51.950 1.00 90.68 ? 82 ALA D O 1 ATOM 4888 C CB . ALA D 4 81 ? 27.078 -48.695 -50.278 1.00 83.03 ? 82 ALA D CB 1 ATOM 4889 N N . THR D 4 82 ? 26.685 -45.733 -51.633 1.00 81.24 ? 83 THR D N 1 ATOM 4890 C CA . THR D 4 82 ? 27.088 -44.339 -51.773 1.00 83.08 ? 83 THR D CA 1 ATOM 4891 C C . THR D 4 82 ? 26.699 -43.556 -50.521 1.00 80.02 ? 83 THR D C 1 ATOM 4892 O O . THR D 4 82 ? 25.660 -43.841 -49.917 1.00 75.40 ? 83 THR D O 1 ATOM 4893 C CB . THR D 4 82 ? 26.414 -43.682 -53.001 1.00 82.70 ? 83 THR D CB 1 ATOM 4894 O OG1 . THR D 4 82 ? 26.073 -44.683 -53.969 1.00 83.03 ? 83 THR D OG1 1 ATOM 4895 C CG2 . THR D 4 82 ? 27.337 -42.647 -53.642 1.00 88.26 ? 83 THR D CG2 1 ATOM 4896 N N . PRO D 4 83 ? 27.534 -42.575 -50.116 1.00 83.33 ? 84 PRO D N 1 ATOM 4897 C CA . PRO D 4 83 ? 27.177 -41.658 -49.034 1.00 81.36 ? 84 PRO D CA 1 ATOM 4898 C C . PRO D 4 83 ? 25.865 -40.926 -49.294 1.00 77.46 ? 84 PRO D C 1 ATOM 4899 O O . PRO D 4 83 ? 25.221 -40.466 -48.354 1.00 74.99 ? 84 PRO D O 1 ATOM 4900 C CB . PRO D 4 83 ? 28.335 -40.661 -49.034 1.00 87.01 ? 84 PRO D CB 1 ATOM 4901 C CG . PRO D 4 83 ? 29.487 -41.449 -49.493 1.00 91.85 ? 84 PRO D CG 1 ATOM 4902 C CD . PRO D 4 83 ? 28.942 -42.403 -50.521 1.00 90.05 ? 84 PRO D CD 1 ATOM 4903 N N . SER D 4 84 ? 25.478 -40.830 -50.561 1.00 77.76 ? 85 SER D N 1 ATOM 4904 C CA . SER D 4 84 ? 24.236 -40.175 -50.952 1.00 75.07 ? 85 SER D CA 1 ATOM 4905 C C . SER D 4 84 ? 22.987 -41.017 -50.660 1.00 69.94 ? 85 SER D C 1 ATOM 4906 O O . SER D 4 84 ? 21.868 -40.563 -50.894 1.00 67.79 ? 85 SER D O 1 ATOM 4907 C CB . SER D 4 84 ? 24.287 -39.815 -52.439 1.00 78.16 ? 85 SER D CB 1 ATOM 4908 O OG . SER D 4 84 ? 24.390 -40.980 -53.242 1.00 78.64 ? 85 SER D OG 1 ATOM 4909 N N . GLN D 4 85 ? 23.178 -42.232 -50.148 1.00 68.87 ? 86 GLN D N 1 ATOM 4910 C CA . GLN D 4 85 ? 22.065 -43.159 -49.908 1.00 65.20 ? 86 GLN D CA 1 ATOM 4911 C C . GLN D 4 85 ? 21.817 -43.432 -48.418 1.00 63.45 ? 86 GLN D C 1 ATOM 4912 O O . GLN D 4 85 ? 21.152 -44.411 -48.053 1.00 61.62 ? 86 GLN D O 1 ATOM 4913 C CB . GLN D 4 85 ? 22.278 -44.466 -50.676 1.00 66.20 ? 86 GLN D CB 1 ATOM 4914 C CG . GLN D 4 85 ? 22.250 -44.300 -52.195 1.00 68.40 ? 86 GLN D CG 1 ATOM 4915 C CD . GLN D 4 85 ? 22.822 -45.493 -52.940 1.00 71.20 ? 86 GLN D CD 1 ATOM 4916 O OE1 . GLN D 4 85 ? 23.885 -46.015 -52.590 1.00 74.18 ? 86 GLN D OE1 1 ATOM 4917 N NE2 . GLN D 4 85 ? 22.124 -45.922 -53.985 1.00 71.04 ? 86 GLN D NE2 1 ATOM 4918 N N . THR D 4 86 ? 22.349 -42.556 -47.566 1.00 64.61 ? 87 THR D N 1 ATOM 4919 C CA . THR D 4 86 ? 22.099 -42.621 -46.134 1.00 63.51 ? 87 THR D CA 1 ATOM 4920 C C . THR D 4 86 ? 20.694 -42.099 -45.857 1.00 60.73 ? 87 THR D C 1 ATOM 4921 O O . THR D 4 86 ? 20.420 -40.909 -46.040 1.00 61.36 ? 87 THR D O 1 ATOM 4922 C CB . THR D 4 86 ? 23.134 -41.802 -45.337 1.00 66.56 ? 87 THR D CB 1 ATOM 4923 O OG1 . THR D 4 86 ? 24.440 -42.360 -45.529 1.00 69.56 ? 87 THR D OG1 1 ATOM 4924 C CG2 . THR D 4 86 ? 22.794 -41.810 -43.845 1.00 66.31 ? 87 THR D CG2 1 ATOM 4925 N N . SER D 4 87 ? 19.807 -43.003 -45.440 1.00 58.54 ? 88 SER D N 1 ATOM 4926 C CA . SER D 4 87 ? 18.411 -42.670 -45.145 1.00 56.34 ? 88 SER D CA 1 ATOM 4927 C C . SER D 4 87 ? 17.768 -43.718 -44.243 1.00 55.63 ? 88 SER D C 1 ATOM 4928 O O . SER D 4 87 ? 18.452 -44.565 -43.662 1.00 56.91 ? 88 SER D O 1 ATOM 4929 C CB . SER D 4 87 ? 17.598 -42.554 -46.437 1.00 55.07 ? 88 SER D CB 1 ATOM 4930 O OG . SER D 4 87 ? 18.276 -41.788 -47.418 1.00 56.69 ? 88 SER D OG 1 ATOM 4931 N N . VAL D 4 88 ? 16.445 -43.640 -44.126 1.00 54.41 ? 89 VAL D N 1 ATOM 4932 C CA . VAL D 4 88 ? 15.654 -44.651 -43.432 1.00 54.35 ? 89 VAL D CA 1 ATOM 4933 C C . VAL D 4 88 ? 14.775 -45.308 -44.474 1.00 53.12 ? 89 VAL D C 1 ATOM 4934 O O . VAL D 4 88 ? 14.014 -44.625 -45.159 1.00 52.31 ? 89 VAL D O 1 ATOM 4935 C CB . VAL D 4 88 ? 14.751 -44.046 -42.341 1.00 55.27 ? 89 VAL D CB 1 ATOM 4936 C CG1 . VAL D 4 88 ? 14.188 -45.145 -41.457 1.00 56.60 ? 89 VAL D CG1 1 ATOM 4937 C CG2 . VAL D 4 88 ? 15.511 -43.006 -41.502 1.00 56.85 ? 89 VAL D CG2 1 ATOM 4938 N N . TYR D 4 89 ? 14.886 -46.627 -44.605 1.00 53.70 ? 90 TYR D N 1 ATOM 4939 C CA . TYR D 4 89 ? 14.143 -47.361 -45.632 1.00 53.17 ? 90 TYR D CA 1 ATOM 4940 C C . TYR D 4 89 ? 12.974 -48.156 -45.055 1.00 54.34 ? 90 TYR D C 1 ATOM 4941 O O . TYR D 4 89 ? 13.109 -48.803 -44.020 1.00 56.16 ? 90 TYR D O 1 ATOM 4942 C CB . TYR D 4 89 ? 15.085 -48.257 -46.442 1.00 53.89 ? 90 TYR D CB 1 ATOM 4943 C CG . TYR D 4 89 ? 16.151 -47.486 -47.201 0.70 53.37 ? 90 TYR D CG 1 ATOM 4944 C CD1 . TYR D 4 89 ? 17.459 -47.406 -46.719 0.70 54.40 ? 90 TYR D CD1 1 ATOM 4945 C CD2 . TYR D 4 89 ? 15.850 -46.829 -48.396 0.70 52.17 ? 90 TYR D CD2 1 ATOM 4946 C CE1 . TYR D 4 89 ? 18.443 -46.697 -47.410 0.70 54.22 ? 90 TYR D CE1 1 ATOM 4947 C CE2 . TYR D 4 89 ? 16.827 -46.114 -49.091 0.70 52.24 ? 90 TYR D CE2 1 ATOM 4948 C CZ . TYR D 4 89 ? 18.117 -46.056 -48.590 0.70 53.30 ? 90 TYR D CZ 1 ATOM 4949 O OH . TYR D 4 89 ? 19.078 -45.353 -49.272 0.70 54.33 ? 90 TYR D OH 1 ATOM 4950 N N . PHE D 4 90 ? 11.828 -48.088 -45.728 1.00 54.07 ? 91 PHE D N 1 ATOM 4951 C CA . PHE D 4 90 ? 10.616 -48.784 -45.291 1.00 56.04 ? 91 PHE D CA 1 ATOM 4952 C C . PHE D 4 90 ? 10.170 -49.821 -46.307 1.00 57.20 ? 91 PHE D C 1 ATOM 4953 O O . PHE D 4 90 ? 10.379 -49.658 -47.511 1.00 56.03 ? 91 PHE D O 1 ATOM 4954 C CB . PHE D 4 90 ? 9.468 -47.797 -45.059 1.00 56.11 ? 91 PHE D CB 1 ATOM 4955 C CG . PHE D 4 90 ? 9.680 -46.874 -43.896 1.00 56.19 ? 91 PHE D CG 1 ATOM 4956 C CD1 . PHE D 4 90 ? 10.221 -45.606 -44.089 1.00 54.34 ? 91 PHE D CD1 1 ATOM 4957 C CD2 . PHE D 4 90 ? 9.328 -47.264 -42.610 1.00 58.79 ? 91 PHE D CD2 1 ATOM 4958 C CE1 . PHE D 4 90 ? 10.421 -44.741 -43.019 1.00 54.69 ? 91 PHE D CE1 1 ATOM 4959 C CE2 . PHE D 4 90 ? 9.527 -46.407 -41.532 1.00 59.59 ? 91 PHE D CE2 1 ATOM 4960 C CZ . PHE D 4 90 ? 10.075 -45.139 -41.742 1.00 57.50 ? 91 PHE D CZ 1 ATOM 4961 N N . CYS D 4 91 ? 9.538 -50.879 -45.811 1.00 60.32 ? 92 CYS D N 1 ATOM 4962 C CA . CYS D 4 91 ? 8.985 -51.920 -46.663 1.00 62.70 ? 92 CYS D CA 1 ATOM 4963 C C . CYS D 4 91 ? 7.486 -52.089 -46.404 1.00 65.39 ? 92 CYS D C 1 ATOM 4964 O O . CYS D 4 91 ? 7.067 -52.300 -45.263 1.00 67.78 ? 92 CYS D O 1 ATOM 4965 C CB . CYS D 4 91 ? 9.731 -53.233 -46.436 1.00 65.23 ? 92 CYS D CB 1 ATOM 4966 S SG . CYS D 4 91 ? 9.164 -54.591 -47.475 1.00 69.99 ? 92 CYS D SG 1 ATOM 4967 N N . ALA D 4 92 ? 6.685 -51.993 -47.463 1.00 65.82 ? 93 ALA D N 1 ATOM 4968 C CA . ALA D 4 92 ? 5.225 -52.089 -47.345 1.00 69.26 ? 93 ALA D CA 1 ATOM 4969 C C . ALA D 4 92 ? 4.635 -53.261 -48.130 1.00 72.78 ? 93 ALA D C 1 ATOM 4970 O O . ALA D 4 92 ? 5.327 -53.891 -48.930 1.00 72.47 ? 93 ALA D O 1 ATOM 4971 C CB . ALA D 4 92 ? 4.572 -50.782 -47.771 1.00 67.95 ? 93 ALA D CB 1 ATOM 4972 N N . SER D 4 93 ? 3.356 -53.549 -47.894 1.00 76.98 ? 94 SER D N 1 ATOM 4973 C CA . SER D 4 93 ? 2.670 -54.640 -48.593 1.00 81.47 ? 94 SER D CA 1 ATOM 4974 C C . SER D 4 93 ? 1.164 -54.411 -48.705 1.00 85.43 ? 94 SER D C 1 ATOM 4975 O O . SER D 4 93 ? 0.581 -53.670 -47.914 1.00 86.20 ? 94 SER D O 1 ATOM 4976 C CB . SER D 4 93 ? 2.934 -55.983 -47.911 1.00 85.33 ? 94 SER D CB 1 ATOM 4977 O OG . SER D 4 93 ? 2.006 -56.206 -46.866 1.00 90.10 ? 94 SER D OG 1 ATOM 4978 N N . GLY D 4 94 ? 0.550 -55.066 -49.688 1.00 88.74 ? 95 GLY D N 1 ATOM 4979 C CA . GLY D 4 94 ? -0.877 -54.930 -49.958 1.00 93.44 ? 95 GLY D CA 1 ATOM 4980 C C . GLY D 4 94 ? -1.383 -56.033 -50.871 1.00 98.40 ? 95 GLY D C 1 ATOM 4981 O O . GLY D 4 94 ? -0.592 -56.774 -51.466 1.00 97.70 ? 95 GLY D O 1 ATOM 4982 N N . ASP D 4 95 ? -2.705 -56.144 -50.980 1.00 104.10 ? 96 ASP D N 1 ATOM 4983 C CA . ASP D 4 95 ? -3.329 -57.190 -51.787 1.00 109.97 ? 96 ASP D CA 1 ATOM 4984 C C . ASP D 4 95 ? -3.693 -56.677 -53.178 1.00 109.75 ? 96 ASP D C 1 ATOM 4985 O O . ASP D 4 95 ? -3.331 -57.286 -54.189 1.00 110.42 ? 96 ASP D O 1 ATOM 4986 C CB . ASP D 4 95 ? -4.570 -57.745 -51.083 1.00 117.81 ? 96 ASP D CB 1 ATOM 4987 N N . ALA D 4 101 ? -6.718 -50.716 -52.145 1.00 112.03 ? 102 ALA D N 1 ATOM 4988 C CA . ALA D 4 101 ? -5.480 -51.253 -51.592 1.00 106.57 ? 102 ALA D CA 1 ATOM 4989 C C . ALA D 4 101 ? -5.158 -50.624 -50.242 1.00 104.50 ? 102 ALA D C 1 ATOM 4990 O O . ALA D 4 101 ? -5.222 -49.401 -50.081 1.00 103.32 ? 102 ALA D O 1 ATOM 4991 C CB . ALA D 4 101 ? -4.324 -51.047 -52.565 1.00 100.57 ? 102 ALA D CB 1 ATOM 4992 N N . GLU D 4 102 ? -4.819 -51.473 -49.275 1.00 104.81 ? 103 GLU D N 1 ATOM 4993 C CA . GLU D 4 102 ? -4.406 -51.024 -47.948 1.00 103.15 ? 103 GLU D CA 1 ATOM 4994 C C . GLU D 4 102 ? -2.938 -51.376 -47.730 1.00 96.99 ? 103 GLU D C 1 ATOM 4995 O O . GLU D 4 102 ? -2.606 -52.528 -47.440 1.00 98.23 ? 103 GLU D O 1 ATOM 4996 C CB . GLU D 4 102 ? -5.271 -51.669 -46.859 1.00 110.04 ? 103 GLU D CB 1 ATOM 4997 C CG . GLU D 4 102 ? -6.770 -51.584 -47.107 1.00 117.80 ? 103 GLU D CG 1 ATOM 4998 C CD . GLU D 4 102 ? -7.595 -51.972 -45.892 1.00 125.66 ? 103 GLU D CD 1 ATOM 4999 O OE1 . GLU D 4 102 ? -7.120 -51.772 -44.749 1.00 124.55 ? 103 GLU D OE1 1 ATOM 5000 O OE2 . GLU D 4 102 ? -8.730 -52.467 -46.084 1.00 133.41 ? 103 GLU D OE2 1 ATOM 5001 N N . GLN D 4 103 ? -2.060 -50.388 -47.884 1.00 91.06 ? 106 GLN D N 1 ATOM 5002 C CA . GLN D 4 103 ? -0.627 -50.623 -47.727 1.00 85.57 ? 106 GLN D CA 1 ATOM 5003 C C . GLN D 4 103 ? -0.222 -50.681 -46.258 1.00 85.69 ? 106 GLN D C 1 ATOM 5004 O O . GLN D 4 103 ? -0.444 -49.730 -45.503 1.00 86.12 ? 106 GLN D O 1 ATOM 5005 C CB . GLN D 4 103 ? 0.193 -49.574 -48.480 1.00 80.31 ? 106 GLN D CB 1 ATOM 5006 C CG . GLN D 4 103 ? 0.208 -49.772 -49.986 0.70 79.67 ? 106 GLN D CG 1 ATOM 5007 C CD . GLN D 4 103 ? 1.380 -49.090 -50.667 0.70 74.74 ? 106 GLN D CD 1 ATOM 5008 O OE1 . GLN D 4 103 ? 2.474 -48.995 -50.107 0.70 71.63 ? 106 GLN D OE1 1 ATOM 5009 N NE2 . GLN D 4 103 ? 1.160 -48.622 -51.890 0.70 75.00 ? 106 GLN D NE2 1 ATOM 5010 N N . PHE D 4 104 ? 0.359 -51.810 -45.859 1.00 86.04 ? 107 PHE D N 1 ATOM 5011 C CA . PHE D 4 104 ? 0.841 -51.990 -44.493 1.00 86.67 ? 107 PHE D CA 1 ATOM 5012 C C . PHE D 4 104 ? 2.362 -51.902 -44.453 1.00 81.45 ? 107 PHE D C 1 ATOM 5013 O O . PHE D 4 104 ? 3.052 -52.571 -45.223 1.00 79.80 ? 107 PHE D O 1 ATOM 5014 C CB . PHE D 4 104 ? 0.337 -53.309 -43.913 1.00 92.56 ? 107 PHE D CB 1 ATOM 5015 C CG . PHE D 4 104 ? -1.149 -53.334 -43.688 1.00 99.00 ? 107 PHE D CG 1 ATOM 5016 C CD1 . PHE D 4 104 ? -1.694 -52.871 -42.492 1.00 102.77 ? 107 PHE D CD1 1 ATOM 5017 C CD2 . PHE D 4 104 ? -2.009 -53.807 -44.676 1.00 101.69 ? 107 PHE D CD2 1 ATOM 5018 C CE1 . PHE D 4 104 ? -3.074 -52.885 -42.283 1.00 109.25 ? 107 PHE D CE1 1 ATOM 5019 C CE2 . PHE D 4 104 ? -3.386 -53.822 -44.476 1.00 108.06 ? 107 PHE D CE2 1 ATOM 5020 C CZ . PHE D 4 104 ? -3.919 -53.360 -43.278 1.00 111.98 ? 107 PHE D CZ 1 ATOM 5021 N N . PHE D 4 105 ? 2.870 -51.066 -43.551 1.00 79.50 ? 108 PHE D N 1 ATOM 5022 C CA . PHE D 4 105 ? 4.282 -50.695 -43.539 1.00 74.67 ? 108 PHE D CA 1 ATOM 5023 C C . PHE D 4 105 ? 5.087 -51.413 -42.460 1.00 76.16 ? 108 PHE D C 1 ATOM 5024 O O . PHE D 4 105 ? 4.534 -51.885 -41.465 1.00 80.84 ? 108 PHE D O 1 ATOM 5025 C CB . PHE D 4 105 ? 4.422 -49.181 -43.370 1.00 71.96 ? 108 PHE D CB 1 ATOM 5026 C CG . PHE D 4 105 ? 3.894 -48.391 -44.528 1.00 69.91 ? 108 PHE D CG 1 ATOM 5027 C CD1 . PHE D 4 105 ? 4.757 -47.909 -45.501 0.70 65.61 ? 108 PHE D CD1 1 ATOM 5028 C CD2 . PHE D 4 105 ? 2.535 -48.127 -44.647 0.70 73.10 ? 108 PHE D CD2 1 ATOM 5029 C CE1 . PHE D 4 105 ? 4.275 -47.178 -46.576 0.70 65.11 ? 108 PHE D CE1 1 ATOM 5030 C CE2 . PHE D 4 105 ? 2.044 -47.399 -45.719 0.70 72.44 ? 108 PHE D CE2 1 ATOM 5031 C CZ . PHE D 4 105 ? 2.915 -46.923 -46.686 0.70 68.39 ? 108 PHE D CZ 1 ATOM 5032 N N . GLY D 4 106 ? 6.400 -51.480 -42.668 1.00 72.98 ? 109 GLY D N 1 ATOM 5033 C CA . GLY D 4 106 ? 7.311 -52.128 -41.729 1.00 74.53 ? 109 GLY D CA 1 ATOM 5034 C C . GLY D 4 106 ? 7.980 -51.145 -40.790 1.00 73.25 ? 109 GLY D C 1 ATOM 5035 O O . GLY D 4 106 ? 7.763 -49.938 -40.907 1.00 71.03 ? 109 GLY D O 1 ATOM 5036 N N . PRO D 4 107 ? 8.812 -51.659 -39.860 1.00 75.33 ? 110 PRO D N 1 ATOM 5037 C CA . PRO D 4 107 ? 9.455 -50.881 -38.791 1.00 75.39 ? 110 PRO D CA 1 ATOM 5038 C C . PRO D 4 107 ? 10.458 -49.837 -39.291 1.00 70.87 ? 110 PRO D C 1 ATOM 5039 O O . PRO D 4 107 ? 10.691 -48.836 -38.608 1.00 70.78 ? 110 PRO D O 1 ATOM 5040 C CB . PRO D 4 107 ? 10.188 -51.948 -37.963 1.00 79.14 ? 110 PRO D CB 1 ATOM 5041 C CG . PRO D 4 107 ? 9.614 -53.262 -38.393 1.00 82.15 ? 110 PRO D CG 1 ATOM 5042 C CD . PRO D 4 107 ? 9.224 -53.073 -39.820 1.00 78.40 ? 110 PRO D CD 1 ATOM 5043 N N . GLY D 4 108 ? 11.048 -50.073 -40.462 1.00 67.97 ? 111 GLY D N 1 ATOM 5044 C CA . GLY D 4 108 ? 12.013 -49.140 -41.047 1.00 64.35 ? 111 GLY D CA 1 ATOM 5045 C C . GLY D 4 108 ? 13.457 -49.427 -40.674 1.00 64.82 ? 111 GLY D C 1 ATOM 5046 O O . GLY D 4 108 ? 13.765 -49.684 -39.504 1.00 67.73 ? 111 GLY D O 1 ATOM 5047 N N . THR D 4 109 ? 14.339 -49.376 -41.674 1.00 62.61 ? 112 THR D N 1 ATOM 5048 C CA . THR D 4 109 ? 15.773 -49.630 -41.486 1.00 63.52 ? 112 THR D CA 1 ATOM 5049 C C . THR D 4 109 ? 16.619 -48.347 -41.577 1.00 61.80 ? 112 THR D C 1 ATOM 5050 O O . THR D 4 109 ? 16.504 -47.573 -42.534 1.00 59.34 ? 112 THR D O 1 ATOM 5051 C CB . THR D 4 109 ? 16.308 -50.675 -42.507 1.00 64.20 ? 112 THR D CB 1 ATOM 5052 O OG1 . THR D 4 109 ? 15.471 -51.839 -42.504 1.00 66.05 ? 112 THR D OG1 1 ATOM 5053 C CG2 . THR D 4 109 ? 17.750 -51.081 -42.178 1.00 66.64 ? 112 THR D CG2 1 ATOM 5054 N N . ARG D 4 110 ? 17.468 -48.136 -40.573 1.00 63.62 ? 113 ARG D N 1 ATOM 5055 C CA . ARG D 4 110 ? 18.411 -47.024 -40.579 1.00 63.02 ? 113 ARG D CA 1 ATOM 5056 C C . ARG D 4 110 ? 19.743 -47.472 -41.176 1.00 64.15 ? 113 ARG D C 1 ATOM 5057 O O . ARG D 4 110 ? 20.508 -48.208 -40.550 1.00 67.13 ? 113 ARG D O 1 ATOM 5058 C CB . ARG D 4 110 ? 18.604 -46.457 -39.168 1.00 65.29 ? 113 ARG D CB 1 ATOM 5059 N N . LEU D 4 111 ? 19.997 -47.035 -42.404 1.00 62.34 ? 114 LEU D N 1 ATOM 5060 C CA . LEU D 4 111 ? 21.252 -47.316 -43.080 1.00 64.00 ? 114 LEU D CA 1 ATOM 5061 C C . LEU D 4 111 ? 22.089 -46.048 -43.176 1.00 64.52 ? 114 LEU D C 1 ATOM 5062 O O . LEU D 4 111 ? 21.701 -45.087 -43.839 1.00 62.60 ? 114 LEU D O 1 ATOM 5063 C CB . LEU D 4 111 ? 20.995 -47.898 -44.474 1.00 63.00 ? 114 LEU D CB 1 ATOM 5064 C CG . LEU D 4 111 ? 22.194 -48.193 -45.383 1.00 65.36 ? 114 LEU D CG 1 ATOM 5065 C CD1 . LEU D 4 111 ? 22.908 -49.471 -44.974 1.00 68.89 ? 114 LEU D CD1 1 ATOM 5066 C CD2 . LEU D 4 111 ? 21.739 -48.288 -46.823 1.00 64.00 ? 114 LEU D CD2 1 ATOM 5067 N N . THR D 4 112 ? 23.228 -46.054 -42.491 1.00 67.78 ? 115 THR D N 1 ATOM 5068 C CA . THR D 4 112 ? 24.211 -44.983 -42.600 1.00 69.75 ? 115 THR D CA 1 ATOM 5069 C C . THR D 4 112 ? 25.363 -45.477 -43.467 1.00 72.72 ? 115 THR D C 1 ATOM 5070 O O . THR D 4 112 ? 25.949 -46.524 -43.187 1.00 75.60 ? 115 THR D O 1 ATOM 5071 C CB . THR D 4 112 ? 24.719 -44.525 -41.203 1.00 72.51 ? 115 THR D CB 1 ATOM 5072 O OG1 . THR D 4 112 ? 23.705 -43.751 -40.549 1.00 70.54 ? 115 THR D OG1 1 ATOM 5073 C CG2 . THR D 4 112 ? 25.989 -43.676 -41.308 1.00 76.34 ? 115 THR D CG2 1 ATOM 5074 N N . VAL D 4 113 ? 25.671 -44.732 -44.526 1.00 72.81 ? 116 VAL D N 1 ATOM 5075 C CA . VAL D 4 113 ? 26.764 -45.093 -45.433 1.00 76.34 ? 116 VAL D CA 1 ATOM 5076 C C . VAL D 4 113 ? 27.912 -44.077 -45.341 1.00 80.36 ? 116 VAL D C 1 ATOM 5077 O O . VAL D 4 113 ? 27.760 -42.913 -45.718 1.00 80.00 ? 116 VAL D O 1 ATOM 5078 C CB . VAL D 4 113 ? 26.277 -45.228 -46.897 1.00 74.78 ? 116 VAL D CB 1 ATOM 5079 C CG1 . VAL D 4 113 ? 27.280 -46.019 -47.715 1.00 79.28 ? 116 VAL D CG1 1 ATOM 5080 C CG2 . VAL D 4 113 ? 24.909 -45.899 -46.956 1.00 70.30 ? 116 VAL D CG2 1 ATOM 5081 N N . LEU D 4 114 ? 29.058 -44.525 -44.840 1.00 84.92 ? 117 LEU D N 1 ATOM 5082 C CA . LEU D 4 114 ? 30.186 -43.628 -44.582 1.00 89.72 ? 117 LEU D CA 1 ATOM 5083 C C . LEU D 4 114 ? 31.334 -43.776 -45.587 1.00 95.15 ? 117 LEU D C 1 ATOM 5084 O O . LEU D 4 114 ? 31.484 -44.818 -46.232 1.00 96.21 ? 117 LEU D O 1 ATOM 5085 C CB . LEU D 4 114 ? 30.699 -43.822 -43.150 1.00 92.35 ? 117 LEU D CB 1 ATOM 5086 N N . GLU D 4 115 ? 32.134 -42.717 -45.711 1.00 99.23 ? 118 GLU D N 1 ATOM 5087 C CA . GLU D 4 115 ? 33.324 -42.721 -46.563 1.00 105.88 ? 118 GLU D CA 1 ATOM 5088 C C . GLU D 4 115 ? 34.472 -43.502 -45.920 1.00 111.73 ? 118 GLU D C 1 ATOM 5089 O O . GLU D 4 115 ? 35.029 -44.418 -46.530 1.00 115.37 ? 118 GLU D O 1 ATOM 5090 C CB . GLU D 4 115 ? 33.768 -41.288 -46.884 1.00 109.34 ? 118 GLU D CB 1 ATOM 5091 N N . ASP D 4 116 ? 34.813 -43.139 -44.686 1.00 113.16 ? 119 ASP D N 1 ATOM 5092 C CA . ASP D 4 116 ? 35.902 -43.784 -43.961 1.00 119.45 ? 119 ASP D CA 1 ATOM 5093 C C . ASP D 4 116 ? 35.430 -44.382 -42.636 1.00 116.75 ? 119 ASP D C 1 ATOM 5094 O O . ASP D 4 116 ? 34.917 -43.671 -41.767 1.00 113.86 ? 119 ASP D O 1 ATOM 5095 C CB . ASP D 4 116 ? 37.051 -42.796 -43.728 1.00 126.71 ? 119 ASP D CB 1 ATOM 5096 N N . LEU D 4 117 ? 35.615 -45.694 -42.494 1.00 91.59 ? 120 LEU D N 1 ATOM 5097 C CA . LEU D 4 117 ? 35.291 -46.412 -41.260 1.00 88.89 ? 120 LEU D CA 1 ATOM 5098 C C . LEU D 4 117 ? 36.251 -46.094 -40.108 1.00 89.89 ? 120 LEU D C 1 ATOM 5099 O O . LEU D 4 117 ? 36.039 -46.537 -38.976 1.00 88.09 ? 120 LEU D O 1 ATOM 5100 C CB . LEU D 4 117 ? 35.238 -47.922 -41.509 1.00 90.02 ? 120 LEU D CB 1 ATOM 5101 C CG . LEU D 4 117 ? 33.895 -48.462 -42.002 1.00 87.97 ? 120 LEU D CG 1 ATOM 5102 N N . LYS D 4 118 ? 37.293 -45.315 -40.397 1.00 93.40 ? 121 LYS D N 1 ATOM 5103 C CA . LYS D 4 118 ? 38.260 -44.890 -39.377 1.00 95.44 ? 121 LYS D CA 1 ATOM 5104 C C . LYS D 4 118 ? 37.751 -43.715 -38.525 1.00 92.72 ? 121 LYS D C 1 ATOM 5105 O O . LYS D 4 118 ? 38.477 -43.191 -37.675 1.00 94.65 ? 121 LYS D O 1 ATOM 5106 C CB . LYS D 4 118 ? 39.638 -44.589 -40.004 1.00 101.42 ? 121 LYS D CB 1 ATOM 5107 C CG . LYS D 4 118 ? 39.620 -43.677 -41.228 1.00 103.02 ? 121 LYS D CG 1 ATOM 5108 N N . ASN D 4 119 ? 36.499 -43.319 -38.749 1.00 88.92 ? 122 ASN D N 1 ATOM 5109 C CA . ASN D 4 119 ? 35.866 -42.245 -37.981 1.00 86.53 ? 122 ASN D CA 1 ATOM 5110 C C . ASN D 4 119 ? 34.778 -42.734 -37.017 1.00 81.84 ? 122 ASN D C 1 ATOM 5111 O O . ASN D 4 119 ? 34.158 -41.929 -36.314 1.00 79.76 ? 122 ASN D O 1 ATOM 5112 C CB . ASN D 4 119 ? 35.305 -41.168 -38.920 1.00 87.18 ? 122 ASN D CB 1 ATOM 5113 C CG . ASN D 4 119 ? 36.353 -40.145 -39.335 1.00 92.17 ? 122 ASN D CG 1 ATOM 5114 O OD1 . ASN D 4 119 ? 37.070 -39.596 -38.497 1.00 93.97 ? 122 ASN D OD1 1 ATOM 5115 N ND2 . ASN D 4 119 ? 36.437 -39.877 -40.634 1.00 95.06 ? 122 ASN D ND2 1 ATOM 5116 N N . VAL D 4 120 ? 34.569 -44.051 -36.979 1.00 80.80 ? 123 VAL D N 1 ATOM 5117 C CA . VAL D 4 120 ? 33.529 -44.669 -36.148 1.00 77.02 ? 123 VAL D CA 1 ATOM 5118 C C . VAL D 4 120 ? 34.003 -44.917 -34.707 1.00 76.87 ? 123 VAL D C 1 ATOM 5119 O O . VAL D 4 120 ? 35.064 -45.512 -34.483 1.00 79.98 ? 123 VAL D O 1 ATOM 5120 C CB . VAL D 4 120 ? 32.999 -45.986 -36.786 1.00 76.96 ? 123 VAL D CB 1 ATOM 5121 C CG1 . VAL D 4 120 ? 31.943 -46.651 -35.905 1.00 73.88 ? 123 VAL D CG1 1 ATOM 5122 C CG2 . VAL D 4 120 ? 32.431 -45.716 -38.171 1.00 77.32 ? 123 VAL D CG2 1 ATOM 5123 N N . PHE D 4 121 ? 33.200 -44.453 -33.745 1.00 73.67 ? 124 PHE D N 1 ATOM 5124 C CA . PHE D 4 121 ? 33.485 -44.602 -32.316 1.00 73.20 ? 124 PHE D CA 1 ATOM 5125 C C . PHE D 4 121 ? 32.264 -45.072 -31.516 1.00 69.58 ? 124 PHE D C 1 ATOM 5126 O O . PHE D 4 121 ? 31.143 -44.640 -31.793 1.00 67.01 ? 124 PHE D O 1 ATOM 5127 C CB . PHE D 4 121 ? 33.982 -43.277 -31.740 1.00 73.99 ? 124 PHE D CB 1 ATOM 5128 C CG . PHE D 4 121 ? 35.403 -42.952 -32.099 1.00 79.05 ? 124 PHE D CG 1 ATOM 5129 C CD1 . PHE D 4 121 ? 36.453 -43.408 -31.311 1.00 82.62 ? 124 PHE D CD1 1 ATOM 5130 C CD2 . PHE D 4 121 ? 35.693 -42.183 -33.220 1.00 81.33 ? 124 PHE D CD2 1 ATOM 5131 C CE1 . PHE D 4 121 ? 37.771 -43.108 -31.635 1.00 88.02 ? 124 PHE D CE1 1 ATOM 5132 C CE2 . PHE D 4 121 ? 37.009 -41.876 -33.553 1.00 86.52 ? 124 PHE D CE2 1 ATOM 5133 C CZ . PHE D 4 121 ? 38.050 -42.341 -32.759 1.00 89.92 ? 124 PHE D CZ 1 ATOM 5134 N N . PRO D 4 122 ? 32.483 -45.952 -30.514 1.00 70.06 ? 125 PRO D N 1 ATOM 5135 C CA . PRO D 4 122 ? 31.449 -46.344 -29.557 1.00 67.46 ? 125 PRO D CA 1 ATOM 5136 C C . PRO D 4 122 ? 31.215 -45.204 -28.565 1.00 65.58 ? 125 PRO D C 1 ATOM 5137 O O . PRO D 4 122 ? 31.945 -44.215 -28.605 1.00 67.01 ? 125 PRO D O 1 ATOM 5138 C CB . PRO D 4 122 ? 32.071 -47.547 -28.833 1.00 70.13 ? 125 PRO D CB 1 ATOM 5139 C CG . PRO D 4 122 ? 33.301 -47.886 -29.581 1.00 74.24 ? 125 PRO D CG 1 ATOM 5140 C CD . PRO D 4 122 ? 33.753 -46.633 -30.227 1.00 74.12 ? 125 PRO D CD 1 ATOM 5141 N N . PRO D 4 123 ? 30.209 -45.323 -27.677 1.00 63.14 ? 126 PRO D N 1 ATOM 5142 C CA . PRO D 4 123 ? 30.051 -44.245 -26.709 1.00 61.71 ? 126 PRO D CA 1 ATOM 5143 C C . PRO D 4 123 ? 30.709 -44.525 -25.354 1.00 63.16 ? 126 PRO D C 1 ATOM 5144 O O . PRO D 4 123 ? 30.867 -45.682 -24.959 1.00 64.71 ? 126 PRO D O 1 ATOM 5145 C CB . PRO D 4 123 ? 28.529 -44.142 -26.553 1.00 58.70 ? 126 PRO D CB 1 ATOM 5146 C CG . PRO D 4 123 ? 27.980 -45.480 -27.012 1.00 58.94 ? 126 PRO D CG 1 ATOM 5147 C CD . PRO D 4 123 ? 29.101 -46.290 -27.593 1.00 61.93 ? 126 PRO D CD 1 ATOM 5148 N N . GLU D 4 124 ? 31.106 -43.458 -24.669 1.00 63.51 ? 127 GLU D N 1 ATOM 5149 C CA . GLU D 4 124 ? 31.519 -43.534 -23.276 1.00 64.80 ? 127 GLU D CA 1 ATOM 5150 C C . GLU D 4 124 ? 30.304 -43.142 -22.443 1.00 61.64 ? 127 GLU D C 1 ATOM 5151 O O . GLU D 4 124 ? 29.746 -42.054 -22.627 1.00 60.06 ? 127 GLU D O 1 ATOM 5152 C CB . GLU D 4 124 ? 32.687 -42.579 -23.004 1.00 67.95 ? 127 GLU D CB 1 ATOM 5153 C CG . GLU D 4 124 ? 34.003 -42.965 -23.670 1.00 72.11 ? 127 GLU D CG 1 ATOM 5154 N N . VAL D 4 125 ? 29.883 -44.029 -21.544 1.00 61.43 ? 128 VAL D N 1 ATOM 5155 C CA . VAL D 4 125 ? 28.650 -43.818 -20.769 1.00 58.73 ? 128 VAL D CA 1 ATOM 5156 C C . VAL D 4 125 ? 28.964 -43.544 -19.299 1.00 59.79 ? 128 VAL D C 1 ATOM 5157 O O . VAL D 4 125 ? 29.853 -44.176 -18.729 1.00 63.05 ? 128 VAL D O 1 ATOM 5158 C CB . VAL D 4 125 ? 27.680 -45.028 -20.886 1.00 57.94 ? 128 VAL D CB 1 ATOM 5159 C CG1 . VAL D 4 125 ? 26.349 -44.725 -20.222 1.00 55.36 ? 128 VAL D CG1 1 ATOM 5160 C CG2 . VAL D 4 125 ? 27.455 -45.408 -22.344 1.00 57.60 ? 128 VAL D CG2 1 ATOM 5161 N N . ALA D 4 126 ? 28.231 -42.608 -18.694 1.00 57.78 ? 129 ALA D N 1 ATOM 5162 C CA . ALA D 4 126 ? 28.465 -42.214 -17.301 1.00 58.85 ? 129 ALA D CA 1 ATOM 5163 C C . ALA D 4 126 ? 27.188 -41.750 -16.597 1.00 56.22 ? 129 ALA D C 1 ATOM 5164 O O . ALA D 4 126 ? 26.589 -40.754 -17.005 1.00 55.08 ? 129 ALA D O 1 ATOM 5165 C CB . ALA D 4 126 ? 29.520 -41.119 -17.242 1.00 61.10 ? 129 ALA D CB 1 ATOM 5166 N N . VAL D 4 127 ? 26.773 -42.459 -15.546 1.00 56.07 ? 130 VAL D N 1 ATOM 5167 C CA . VAL D 4 127 ? 25.581 -42.061 -14.781 1.00 53.67 ? 130 VAL D CA 1 ATOM 5168 C C . VAL D 4 127 ? 25.951 -41.043 -13.712 1.00 54.26 ? 130 VAL D C 1 ATOM 5169 O O . VAL D 4 127 ? 26.851 -41.280 -12.904 1.00 56.95 ? 130 VAL D O 1 ATOM 5170 C CB . VAL D 4 127 ? 24.859 -43.267 -14.123 1.00 53.98 ? 130 VAL D CB 1 ATOM 5171 C CG1 . VAL D 4 127 ? 23.836 -42.798 -13.086 1.00 52.67 ? 130 VAL D CG1 1 ATOM 5172 C CG2 . VAL D 4 127 ? 24.174 -44.116 -15.167 1.00 53.37 ? 130 VAL D CG2 1 ATOM 5173 N N . PHE D 4 128 ? 25.253 -39.914 -13.716 1.00 52.39 ? 131 PHE D N 1 ATOM 5174 C CA . PHE D 4 128 ? 25.444 -38.880 -12.709 1.00 53.09 ? 131 PHE D CA 1 ATOM 5175 C C . PHE D 4 128 ? 24.388 -39.028 -11.624 1.00 52.10 ? 131 PHE D C 1 ATOM 5176 O O . PHE D 4 128 ? 23.213 -39.254 -11.919 1.00 50.41 ? 131 PHE D O 1 ATOM 5177 C CB . PHE D 4 128 ? 25.386 -37.502 -13.357 1.00 53.02 ? 131 PHE D CB 1 ATOM 5178 C CG . PHE D 4 128 ? 26.491 -37.257 -14.335 1.00 53.94 ? 131 PHE D CG 1 ATOM 5179 C CD1 . PHE D 4 128 ? 26.522 -37.920 -15.549 1.00 52.26 ? 131 PHE D CD1 1 ATOM 5180 C CD2 . PHE D 4 128 ? 27.510 -36.368 -14.039 1.00 56.80 ? 131 PHE D CD2 1 ATOM 5181 C CE1 . PHE D 4 128 ? 27.547 -37.702 -16.447 1.00 54.07 ? 131 PHE D CE1 1 ATOM 5182 C CE2 . PHE D 4 128 ? 28.539 -36.145 -14.937 1.00 58.49 ? 131 PHE D CE2 1 ATOM 5183 C CZ . PHE D 4 128 ? 28.556 -36.812 -16.140 1.00 57.10 ? 131 PHE D CZ 1 ATOM 5184 N N . GLU D 4 129 ? 24.816 -38.913 -10.370 1.00 53.82 ? 132 GLU D N 1 ATOM 5185 C CA . GLU D 4 129 ? 23.950 -39.175 -9.221 1.00 53.34 ? 132 GLU D CA 1 ATOM 5186 C C . GLU D 4 129 ? 23.241 -37.910 -8.729 1.00 52.65 ? 132 GLU D C 1 ATOM 5187 O O . GLU D 4 129 ? 23.758 -36.806 -8.911 1.00 53.69 ? 132 GLU D O 1 ATOM 5188 C CB . GLU D 4 129 ? 24.751 -39.831 -8.089 1.00 56.30 ? 132 GLU D CB 1 ATOM 5189 C CG . GLU D 4 129 ? 25.135 -41.289 -8.355 1.00 57.95 ? 132 GLU D CG 1 ATOM 5190 C CD . GLU D 4 129 ? 25.851 -41.954 -7.185 1.00 62.51 ? 132 GLU D CD 1 ATOM 5191 O OE1 . GLU D 4 129 ? 26.251 -41.242 -6.233 1.00 64.42 ? 132 GLU D OE1 1 ATOM 5192 O OE2 . GLU D 4 129 ? 26.017 -43.196 -7.220 1.00 64.57 ? 132 GLU D OE2 1 ATOM 5193 N N . PRO D 4 130 ? 22.055 -38.071 -8.104 1.00 51.48 ? 133 PRO D N 1 ATOM 5194 C CA . PRO D 4 130 ? 21.208 -36.959 -7.661 1.00 51.27 ? 133 PRO D CA 1 ATOM 5195 C C . PRO D 4 130 ? 21.886 -36.064 -6.638 1.00 53.47 ? 133 PRO D C 1 ATOM 5196 O O . PRO D 4 130 ? 22.663 -36.547 -5.805 1.00 55.07 ? 133 PRO D O 1 ATOM 5197 C CB . PRO D 4 130 ? 20.025 -37.659 -6.993 1.00 50.46 ? 133 PRO D CB 1 ATOM 5198 C CG . PRO D 4 130 ? 20.032 -39.028 -7.528 1.00 50.18 ? 133 PRO D CG 1 ATOM 5199 C CD . PRO D 4 130 ? 21.457 -39.371 -7.755 1.00 51.12 ? 133 PRO D CD 1 ATOM 5200 N N . SER D 4 131 ? 21.586 -34.770 -6.703 1.00 54.14 ? 134 SER D N 1 ATOM 5201 C CA . SER D 4 131 ? 22.114 -33.819 -5.744 1.00 56.79 ? 134 SER D CA 1 ATOM 5202 C C . SER D 4 131 ? 21.261 -33.835 -4.489 1.00 56.89 ? 134 SER D C 1 ATOM 5203 O O . SER D 4 131 ? 20.032 -33.864 -4.567 1.00 55.55 ? 134 SER D O 1 ATOM 5204 C CB . SER D 4 131 ? 22.125 -32.419 -6.338 1.00 58.67 ? 134 SER D CB 1 ATOM 5205 O OG . SER D 4 131 ? 20.809 -31.992 -6.618 1.00 58.08 ? 134 SER D OG 1 ATOM 5206 N N . GLU D 4 132 ? 21.917 -33.808 -3.333 1.00 59.17 ? 135 GLU D N 1 ATOM 5207 C CA . GLU D 4 132 ? 21.215 -33.760 -2.051 1.00 59.89 ? 135 GLU D CA 1 ATOM 5208 C C . GLU D 4 132 ? 20.233 -32.587 -2.008 1.00 60.42 ? 135 GLU D C 1 ATOM 5209 O O . GLU D 4 132 ? 19.113 -32.737 -1.521 1.00 59.90 ? 135 GLU D O 1 ATOM 5210 C CB . GLU D 4 132 ? 22.204 -33.693 -0.884 1.00 63.07 ? 135 GLU D CB 1 ATOM 5211 N N . ALA D 4 133 ? 20.651 -31.435 -2.539 1.00 62.19 ? 136 ALA D N 1 ATOM 5212 C CA . ALA D 4 133 ? 19.789 -30.258 -2.638 1.00 63.53 ? 136 ALA D CA 1 ATOM 5213 C C . ALA D 4 133 ? 18.448 -30.535 -3.333 1.00 61.35 ? 136 ALA D C 1 ATOM 5214 O O . ALA D 4 133 ? 17.412 -30.044 -2.898 1.00 62.52 ? 136 ALA D O 1 ATOM 5215 C CB . ALA D 4 133 ? 20.519 -29.132 -3.322 1.00 66.51 ? 136 ALA D CB 1 ATOM 5216 N N . GLU D 4 134 ? 18.466 -31.321 -4.405 1.00 58.92 ? 137 GLU D N 1 ATOM 5217 C CA . GLU D 4 134 ? 17.227 -31.737 -5.073 1.00 57.57 ? 137 GLU D CA 1 ATOM 5218 C C . GLU D 4 134 ? 16.384 -32.652 -4.174 1.00 56.44 ? 137 GLU D C 1 ATOM 5219 O O . GLU D 4 134 ? 15.156 -32.534 -4.125 1.00 57.17 ? 137 GLU D O 1 ATOM 5220 C CB . GLU D 4 134 ? 17.524 -32.419 -6.420 1.00 55.63 ? 137 GLU D CB 1 ATOM 5221 C CG . GLU D 4 134 ? 16.285 -32.745 -7.261 1.00 55.23 ? 137 GLU D CG 1 ATOM 5222 C CD . GLU D 4 134 ? 16.574 -33.701 -8.411 0.70 53.36 ? 137 GLU D CD 1 ATOM 5223 O OE1 . GLU D 4 134 ? 17.556 -33.475 -9.147 0.70 53.42 ? 137 GLU D OE1 1 ATOM 5224 O OE2 . GLU D 4 134 ? 15.808 -34.675 -8.583 0.70 51.79 ? 137 GLU D OE2 1 ATOM 5225 N N . ILE D 4 135 ? 17.051 -33.553 -3.459 1.00 55.35 ? 138 ILE D N 1 ATOM 5226 C CA . ILE D 4 135 ? 16.362 -34.480 -2.572 1.00 55.14 ? 138 ILE D CA 1 ATOM 5227 C C . ILE D 4 135 ? 15.725 -33.729 -1.401 1.00 57.51 ? 138 ILE D C 1 ATOM 5228 O O . ILE D 4 135 ? 14.651 -34.083 -0.928 1.00 57.98 ? 138 ILE D O 1 ATOM 5229 C CB . ILE D 4 135 ? 17.313 -35.594 -2.090 1.00 54.57 ? 138 ILE D CB 1 ATOM 5230 C CG1 . ILE D 4 135 ? 17.893 -36.337 -3.299 1.00 52.57 ? 138 ILE D CG1 1 ATOM 5231 C CG2 . ILE D 4 135 ? 16.582 -36.578 -1.195 1.00 55.10 ? 138 ILE D CG2 1 ATOM 5232 C CD1 . ILE D 4 135 ? 19.214 -37.019 -3.055 1.00 52.14 ? 138 ILE D CD1 1 ATOM 5233 N N . SER D 4 136 ? 16.377 -32.657 -0.976 1.00 59.86 ? 139 SER D N 1 ATOM 5234 C CA . SER D 4 136 ? 15.928 -31.877 0.170 1.00 62.79 ? 139 SER D CA 1 ATOM 5235 C C . SER D 4 136 ? 14.976 -30.740 -0.195 1.00 64.91 ? 139 SER D C 1 ATOM 5236 O O . SER D 4 136 ? 14.659 -29.904 0.654 1.00 67.74 ? 139 SER D O 1 ATOM 5237 C CB . SER D 4 136 ? 17.139 -31.318 0.922 1.00 64.86 ? 139 SER D CB 1 ATOM 5238 O OG . SER D 4 136 ? 17.912 -32.366 1.480 1.00 64.96 ? 139 SER D OG 1 ATOM 5239 N N . HIS D 4 137 ? 14.516 -30.705 -1.443 1.00 64.40 ? 140 HIS D N 1 ATOM 5240 C CA . HIS D 4 137 ? 13.643 -29.616 -1.889 1.00 67.49 ? 140 HIS D CA 1 ATOM 5241 C C . HIS D 4 137 ? 12.371 -30.087 -2.605 1.00 67.71 ? 140 HIS D C 1 ATOM 5242 O O . HIS D 4 137 ? 11.397 -29.335 -2.708 1.00 70.82 ? 140 HIS D O 1 ATOM 5243 C CB . HIS D 4 137 ? 14.437 -28.626 -2.752 1.00 68.99 ? 140 HIS D CB 1 ATOM 5244 C CG . HIS D 4 137 ? 13.606 -27.540 -3.363 1.00 72.70 ? 140 HIS D CG 1 ATOM 5245 N ND1 . HIS D 4 137 ? 12.689 -26.807 -2.642 1.00 75.98 ? 140 HIS D ND1 1 ATOM 5246 C CD2 . HIS D 4 137 ? 13.564 -27.056 -4.628 1.00 74.04 ? 140 HIS D CD2 1 ATOM 5247 C CE1 . HIS D 4 137 ? 12.108 -25.928 -3.440 1.00 79.93 ? 140 HIS D CE1 1 ATOM 5248 N NE2 . HIS D 4 137 ? 12.625 -26.055 -4.649 1.00 78.25 ? 140 HIS D NE2 1 ATOM 5249 N N . THR D 4 138 ? 12.379 -31.331 -3.079 1.00 65.19 ? 141 THR D N 1 ATOM 5250 C CA . THR D 4 138 ? 11.285 -31.847 -3.903 1.00 65.98 ? 141 THR D CA 1 ATOM 5251 C C . THR D 4 138 ? 10.742 -33.187 -3.431 1.00 65.14 ? 141 THR D C 1 ATOM 5252 O O . THR D 4 138 ? 9.601 -33.540 -3.737 1.00 67.00 ? 141 THR D O 1 ATOM 5253 C CB . THR D 4 138 ? 11.722 -32.016 -5.366 1.00 64.61 ? 141 THR D CB 1 ATOM 5254 O OG1 . THR D 4 138 ? 12.908 -32.819 -5.417 1.00 61.06 ? 141 THR D OG1 1 ATOM 5255 C CG2 . THR D 4 138 ? 11.981 -30.656 -6.012 1.00 67.16 ? 141 THR D CG2 1 ATOM 5256 N N . GLN D 4 139 ? 11.565 -33.925 -2.689 1.00 63.34 ? 142 GLN D N 1 ATOM 5257 C CA . GLN D 4 139 ? 11.274 -35.312 -2.309 1.00 62.97 ? 142 GLN D CA 1 ATOM 5258 C C . GLN D 4 139 ? 11.224 -36.200 -3.552 1.00 61.71 ? 142 GLN D C 1 ATOM 5259 O O . GLN D 4 139 ? 10.397 -37.110 -3.658 1.00 62.82 ? 142 GLN D O 1 ATOM 5260 C CB . GLN D 4 139 ? 9.986 -35.425 -1.475 1.00 65.91 ? 142 GLN D CB 1 ATOM 5261 C CG . GLN D 4 139 ? 9.862 -34.386 -0.365 1.00 68.68 ? 142 GLN D CG 1 ATOM 5262 C CD . GLN D 4 139 ? 11.149 -34.220 0.428 1.00 68.86 ? 142 GLN D CD 1 ATOM 5263 O OE1 . GLN D 4 139 ? 11.608 -35.154 1.095 1.00 69.02 ? 142 GLN D OE1 1 ATOM 5264 N NE2 . GLN D 4 139 ? 11.742 -33.027 0.354 1.00 69.36 ? 142 GLN D NE2 1 ATOM 5265 N N . LYS D 4 140 ? 12.127 -35.902 -4.486 1.00 59.93 ? 143 LYS D N 1 ATOM 5266 C CA . LYS D 4 140 ? 12.337 -36.680 -5.709 1.00 58.56 ? 143 LYS D CA 1 ATOM 5267 C C . LYS D 4 140 ? 13.814 -36.589 -6.094 1.00 56.42 ? 143 LYS D C 1 ATOM 5268 O O . LYS D 4 140 ? 14.483 -35.595 -5.797 1.00 56.47 ? 143 LYS D O 1 ATOM 5269 C CB . LYS D 4 140 ? 11.478 -36.148 -6.862 1.00 59.97 ? 143 LYS D CB 1 ATOM 5270 C CG . LYS D 4 140 ? 9.975 -36.331 -6.687 1.00 63.04 ? 143 LYS D CG 1 ATOM 5271 C CD . LYS D 4 140 ? 9.181 -35.779 -7.866 1.00 65.33 ? 143 LYS D CD 1 ATOM 5272 C CE . LYS D 4 140 ? 9.313 -34.266 -8.002 1.00 66.88 ? 143 LYS D CE 1 ATOM 5273 N NZ . LYS D 4 140 ? 8.773 -33.525 -6.830 1.00 69.41 ? 143 LYS D NZ 1 ATOM 5274 N N . ALA D 4 141 ? 14.316 -37.630 -6.755 1.00 55.03 ? 144 ALA D N 1 ATOM 5275 C CA . ALA D 4 141 ? 15.705 -37.668 -7.201 1.00 53.39 ? 144 ALA D CA 1 ATOM 5276 C C . ALA D 4 141 ? 15.776 -37.864 -8.713 1.00 52.58 ? 144 ALA D C 1 ATOM 5277 O O . ALA D 4 141 ? 14.995 -38.631 -9.280 1.00 52.99 ? 144 ALA D O 1 ATOM 5278 C CB . ALA D 4 141 ? 16.454 -38.774 -6.484 1.00 53.21 ? 144 ALA D CB 1 ATOM 5279 N N . THR D 4 142 ? 16.699 -37.161 -9.364 1.00 51.87 ? 145 THR D N 1 ATOM 5280 C CA . THR D 4 142 ? 16.886 -37.312 -10.806 1.00 51.24 ? 145 THR D CA 1 ATOM 5281 C C . THR D 4 142 ? 18.254 -37.905 -11.091 1.00 50.12 ? 145 THR D C 1 ATOM 5282 O O . THR D 4 142 ? 19.260 -37.425 -10.570 1.00 50.75 ? 145 THR D O 1 ATOM 5283 C CB . THR D 4 142 ? 16.782 -35.963 -11.547 1.00 52.51 ? 145 THR D CB 1 ATOM 5284 O OG1 . THR D 4 142 ? 15.635 -35.232 -11.089 1.00 54.88 ? 145 THR D OG1 1 ATOM 5285 C CG2 . THR D 4 142 ? 16.685 -36.179 -13.055 1.00 52.35 ? 145 THR D CG2 1 ATOM 5286 N N . LEU D 4 143 ? 18.288 -38.953 -11.907 1.00 49.17 ? 146 LEU D N 1 ATOM 5287 C CA . LEU D 4 143 ? 19.543 -39.503 -12.386 1.00 48.45 ? 146 LEU D CA 1 ATOM 5288 C C . LEU D 4 143 ? 19.736 -39.140 -13.842 1.00 48.13 ? 146 LEU D C 1 ATOM 5289 O O . LEU D 4 143 ? 18.821 -39.285 -14.662 1.00 48.18 ? 146 LEU D O 1 ATOM 5290 C CB . LEU D 4 143 ? 19.581 -41.014 -12.240 1.00 48.81 ? 146 LEU D CB 1 ATOM 5291 C CG . LEU D 4 143 ? 19.629 -41.533 -10.818 1.00 49.83 ? 146 LEU D CG 1 ATOM 5292 C CD1 . LEU D 4 143 ? 18.299 -42.171 -10.488 1.00 50.71 ? 146 LEU D CD1 1 ATOM 5293 C CD2 . LEU D 4 143 ? 20.751 -42.539 -10.709 1.00 51.37 ? 146 LEU D CD2 1 ATOM 5294 N N . VAL D 4 144 ? 20.938 -38.676 -14.159 1.00 48.23 ? 147 VAL D N 1 ATOM 5295 C CA . VAL D 4 144 ? 21.266 -38.243 -15.507 1.00 48.22 ? 147 VAL D CA 1 ATOM 5296 C C . VAL D 4 144 ? 22.243 -39.240 -16.101 1.00 48.36 ? 147 VAL D C 1 ATOM 5297 O O . VAL D 4 144 ? 23.149 -39.714 -15.415 1.00 49.15 ? 147 VAL D O 1 ATOM 5298 C CB . VAL D 4 144 ? 21.842 -36.796 -15.511 1.00 49.42 ? 147 VAL D CB 1 ATOM 5299 C CG1 . VAL D 4 144 ? 22.472 -36.448 -16.843 1.00 49.94 ? 147 VAL D CG1 1 ATOM 5300 C CG2 . VAL D 4 144 ? 20.752 -35.804 -15.187 1.00 49.69 ? 147 VAL D CG2 1 ATOM 5301 N N . CYS D 4 145 ? 22.030 -39.579 -17.366 1.00 48.27 ? 148 CYS D N 1 ATOM 5302 C CA . CYS D 4 145 ? 22.954 -40.427 -18.094 1.00 48.99 ? 148 CYS D CA 1 ATOM 5303 C C . CYS D 4 145 ? 23.502 -39.664 -19.284 1.00 49.76 ? 148 CYS D C 1 ATOM 5304 O O . CYS D 4 145 ? 22.781 -38.915 -19.943 1.00 49.97 ? 148 CYS D O 1 ATOM 5305 C CB . CYS D 4 145 ? 22.275 -41.708 -18.558 1.00 48.69 ? 148 CYS D CB 1 ATOM 5306 S SG . CYS D 4 145 ? 23.450 -42.868 -19.229 1.00 51.11 ? 148 CYS D SG 1 ATOM 5307 N N . LEU D 4 146 ? 24.783 -39.855 -19.560 1.00 51.03 ? 149 LEU D N 1 ATOM 5308 C CA . LEU D 4 146 ? 25.423 -39.142 -20.643 1.00 52.40 ? 149 LEU D CA 1 ATOM 5309 C C . LEU D 4 146 ? 26.291 -40.088 -21.462 1.00 53.62 ? 149 LEU D C 1 ATOM 5310 O O . LEU D 4 146 ? 27.315 -40.588 -20.980 1.00 55.27 ? 149 LEU D O 1 ATOM 5311 C CB . LEU D 4 146 ? 26.257 -37.997 -20.080 1.00 54.19 ? 149 LEU D CB 1 ATOM 5312 C CG . LEU D 4 146 ? 26.032 -36.622 -20.700 1.00 55.53 ? 149 LEU D CG 1 ATOM 5313 C CD1 . LEU D 4 146 ? 24.733 -36.019 -20.182 1.00 54.43 ? 149 LEU D CD1 1 ATOM 5314 C CD2 . LEU D 4 146 ? 27.200 -35.717 -20.381 1.00 58.64 ? 149 LEU D CD2 1 ATOM 5315 N N . ALA D 4 147 ? 25.861 -40.348 -22.696 1.00 53.51 ? 150 ALA D N 1 ATOM 5316 C CA . ALA D 4 147 ? 26.620 -41.174 -23.629 1.00 54.72 ? 150 ALA D CA 1 ATOM 5317 C C . ALA D 4 147 ? 27.239 -40.239 -24.652 1.00 56.48 ? 150 ALA D C 1 ATOM 5318 O O . ALA D 4 147 ? 26.519 -39.602 -25.426 1.00 56.50 ? 150 ALA D O 1 ATOM 5319 C CB . ALA D 4 147 ? 25.711 -42.193 -24.303 1.00 53.86 ? 150 ALA D CB 1 ATOM 5320 N N . THR D 4 148 ? 28.568 -40.135 -24.638 1.00 58.79 ? 151 THR D N 1 ATOM 5321 C CA . THR D 4 148 ? 29.257 -39.112 -25.433 1.00 61.30 ? 151 THR D CA 1 ATOM 5322 C C . THR D 4 148 ? 30.402 -39.646 -26.292 1.00 63.79 ? 151 THR D C 1 ATOM 5323 O O . THR D 4 148 ? 30.875 -40.772 -26.098 1.00 64.19 ? 151 THR D O 1 ATOM 5324 C CB . THR D 4 148 ? 29.815 -37.980 -24.546 1.00 63.20 ? 151 THR D CB 1 ATOM 5325 O OG1 . THR D 4 148 ? 30.871 -38.493 -23.729 1.00 65.06 ? 151 THR D OG1 1 ATOM 5326 C CG2 . THR D 4 148 ? 28.725 -37.374 -23.664 1.00 61.31 ? 151 THR D CG2 1 ATOM 5327 N N . GLY D 4 149 ? 30.841 -38.812 -27.235 1.00 66.07 ? 152 GLY D N 1 ATOM 5328 C CA . GLY D 4 149 ? 31.969 -39.120 -28.110 1.00 69.01 ? 152 GLY D CA 1 ATOM 5329 C C . GLY D 4 149 ? 31.748 -40.366 -28.936 1.00 67.79 ? 152 GLY D C 1 ATOM 5330 O O . GLY D 4 149 ? 32.490 -41.334 -28.810 1.00 69.14 ? 152 GLY D O 1 ATOM 5331 N N . PHE D 4 150 ? 30.720 -40.333 -29.779 1.00 66.09 ? 153 PHE D N 1 ATOM 5332 C CA . PHE D 4 150 ? 30.345 -41.475 -30.599 1.00 65.30 ? 153 PHE D CA 1 ATOM 5333 C C . PHE D 4 150 ? 29.858 -41.049 -31.979 1.00 66.16 ? 153 PHE D C 1 ATOM 5334 O O . PHE D 4 150 ? 29.195 -40.020 -32.128 1.00 66.12 ? 153 PHE D O 1 ATOM 5335 C CB . PHE D 4 150 ? 29.287 -42.329 -29.887 1.00 62.45 ? 153 PHE D CB 1 ATOM 5336 C CG . PHE D 4 150 ? 27.905 -41.720 -29.868 1.00 60.43 ? 153 PHE D CG 1 ATOM 5337 C CD1 . PHE D 4 150 ? 27.633 -40.575 -29.127 1.00 59.61 ? 153 PHE D CD1 1 ATOM 5338 C CD2 . PHE D 4 150 ? 26.866 -42.315 -30.571 1.00 59.73 ? 153 PHE D CD2 1 ATOM 5339 C CE1 . PHE D 4 150 ? 26.351 -40.033 -29.104 1.00 58.38 ? 153 PHE D CE1 1 ATOM 5340 C CE2 . PHE D 4 150 ? 25.583 -41.766 -30.555 1.00 58.51 ? 153 PHE D CE2 1 ATOM 5341 C CZ . PHE D 4 150 ? 25.328 -40.628 -29.824 1.00 57.54 ? 153 PHE D CZ 1 ATOM 5342 N N . TYR D 4 151 ? 30.199 -41.863 -32.977 1.00 67.47 ? 154 TYR D N 1 ATOM 5343 C CA . TYR D 4 151 ? 29.867 -41.619 -34.375 1.00 68.83 ? 154 TYR D CA 1 ATOM 5344 C C . TYR D 4 151 ? 29.840 -42.961 -35.102 1.00 69.22 ? 154 TYR D C 1 ATOM 5345 O O . TYR D 4 151 ? 30.713 -43.794 -34.872 1.00 70.12 ? 154 TYR D O 1 ATOM 5346 C CB . TYR D 4 151 ? 30.910 -40.696 -35.006 1.00 72.22 ? 154 TYR D CB 1 ATOM 5347 C CG . TYR D 4 151 ? 30.635 -40.283 -36.438 1.00 74.46 ? 154 TYR D CG 1 ATOM 5348 C CD1 . TYR D 4 151 ? 29.726 -39.264 -36.729 1.00 75.02 ? 154 TYR D CD1 1 ATOM 5349 C CD2 . TYR D 4 151 ? 31.303 -40.893 -37.500 1.00 76.59 ? 154 TYR D CD2 1 ATOM 5350 C CE1 . TYR D 4 151 ? 29.479 -38.871 -38.040 1.00 78.07 ? 154 TYR D CE1 1 ATOM 5351 C CE2 . TYR D 4 151 ? 31.065 -40.509 -38.817 1.00 79.20 ? 154 TYR D CE2 1 ATOM 5352 C CZ . TYR D 4 151 ? 30.151 -39.497 -39.082 1.00 79.92 ? 154 TYR D CZ 1 ATOM 5353 O OH . TYR D 4 151 ? 29.911 -39.111 -40.384 1.00 82.55 ? 154 TYR D OH 1 ATOM 5354 N N . PRO D 4 152 ? 28.828 -43.190 -35.964 1.00 69.19 ? 155 PRO D N 1 ATOM 5355 C CA . PRO D 4 152 ? 27.710 -42.306 -36.295 1.00 69.17 ? 155 PRO D CA 1 ATOM 5356 C C . PRO D 4 152 ? 26.632 -42.332 -35.208 1.00 66.87 ? 155 PRO D C 1 ATOM 5357 O O . PRO D 4 152 ? 26.807 -43.007 -34.189 1.00 65.06 ? 155 PRO D O 1 ATOM 5358 C CB . PRO D 4 152 ? 27.178 -42.914 -37.583 1.00 70.80 ? 155 PRO D CB 1 ATOM 5359 C CG . PRO D 4 152 ? 27.420 -44.367 -37.403 1.00 70.36 ? 155 PRO D CG 1 ATOM 5360 C CD . PRO D 4 152 ? 28.700 -44.495 -36.634 1.00 69.85 ? 155 PRO D CD 1 ATOM 5361 N N . ASP D 4 153 ? 25.536 -41.605 -35.417 1.00 67.58 ? 156 ASP D N 1 ATOM 5362 C CA . ASP D 4 153 ? 24.455 -41.570 -34.426 1.00 66.05 ? 156 ASP D CA 1 ATOM 5363 C C . ASP D 4 153 ? 23.463 -42.722 -34.595 1.00 66.04 ? 156 ASP D C 1 ATOM 5364 O O . ASP D 4 153 ? 22.480 -42.632 -35.328 1.00 67.95 ? 156 ASP D O 1 ATOM 5365 C CB . ASP D 4 153 ? 23.765 -40.197 -34.373 1.00 67.32 ? 156 ASP D CB 1 ATOM 5366 C CG . ASP D 4 153 ? 23.316 -39.706 -35.731 1.00 71.38 ? 156 ASP D CG 1 ATOM 5367 O OD1 . ASP D 4 153 ? 24.062 -39.888 -36.721 1.00 73.29 ? 156 ASP D OD1 1 ATOM 5368 O OD2 . ASP D 4 153 ? 22.209 -39.129 -35.803 1.00 73.61 ? 156 ASP D OD2 1 ATOM 5369 N N . HIS D 4 154 ? 23.759 -43.808 -33.884 1.00 64.80 ? 157 HIS D N 1 ATOM 5370 C CA . HIS D 4 154 ? 23.015 -45.066 -33.942 1.00 65.63 ? 157 HIS D CA 1 ATOM 5371 C C . HIS D 4 154 ? 22.932 -45.660 -32.536 1.00 63.93 ? 157 HIS D C 1 ATOM 5372 O O . HIS D 4 154 ? 23.557 -46.693 -32.256 1.00 64.49 ? 157 HIS D O 1 ATOM 5373 C CB . HIS D 4 154 ? 23.725 -46.061 -34.872 1.00 67.26 ? 157 HIS D CB 1 ATOM 5374 C CG . HIS D 4 154 ? 23.345 -45.928 -36.312 0.70 69.90 ? 157 HIS D CG 1 ATOM 5375 N ND1 . HIS D 4 154 ? 22.550 -46.850 -36.959 0.70 72.35 ? 157 HIS D ND1 1 ATOM 5376 C CD2 . HIS D 4 154 ? 23.652 -44.984 -37.233 0.70 71.00 ? 157 HIS D CD2 1 ATOM 5377 C CE1 . HIS D 4 154 ? 22.383 -46.480 -38.216 0.70 74.70 ? 157 HIS D CE1 1 ATOM 5378 N NE2 . HIS D 4 154 ? 23.040 -45.350 -38.407 0.70 73.93 ? 157 HIS D NE2 1 ATOM 5379 N N . VAL D 4 155 ? 22.179 -45.002 -31.651 1.00 62.41 ? 158 VAL D N 1 ATOM 5380 C CA . VAL D 4 155 ? 22.067 -45.443 -30.252 1.00 60.56 ? 158 VAL D CA 1 ATOM 5381 C C . VAL D 4 155 ? 20.633 -45.496 -29.729 1.00 60.76 ? 158 VAL D C 1 ATOM 5382 O O . VAL D 4 155 ? 19.765 -44.755 -30.189 1.00 61.75 ? 158 VAL D O 1 ATOM 5383 C CB . VAL D 4 155 ? 22.915 -44.579 -29.290 1.00 58.53 ? 158 VAL D CB 1 ATOM 5384 C CG1 . VAL D 4 155 ? 24.396 -44.854 -29.483 1.00 59.03 ? 158 VAL D CG1 1 ATOM 5385 C CG2 . VAL D 4 155 ? 22.597 -43.101 -29.462 1.00 58.47 ? 158 VAL D CG2 1 ATOM 5386 N N . GLU D 4 156 ? 20.409 -46.385 -28.762 1.00 60.51 ? 159 GLU D N 1 ATOM 5387 C CA . GLU D 4 156 ? 19.122 -46.528 -28.087 1.00 61.14 ? 159 GLU D CA 1 ATOM 5388 C C . GLU D 4 156 ? 19.363 -46.706 -26.596 1.00 59.31 ? 159 GLU D C 1 ATOM 5389 O O . GLU D 4 156 ? 19.718 -47.792 -26.141 1.00 60.27 ? 159 GLU D O 1 ATOM 5390 C CB . GLU D 4 156 ? 18.334 -47.717 -28.651 1.00 64.56 ? 159 GLU D CB 1 ATOM 5391 N N . LEU D 4 157 ? 19.175 -45.627 -25.845 1.00 57.27 ? 160 LEU D N 1 ATOM 5392 C CA . LEU D 4 157 ? 19.464 -45.609 -24.412 1.00 55.61 ? 160 LEU D CA 1 ATOM 5393 C C . LEU D 4 157 ? 18.257 -46.065 -23.582 1.00 56.70 ? 160 LEU D C 1 ATOM 5394 O O . LEU D 4 157 ? 17.174 -45.481 -23.674 1.00 57.36 ? 160 LEU D O 1 ATOM 5395 C CB . LEU D 4 157 ? 19.930 -44.203 -23.991 1.00 53.50 ? 160 LEU D CB 1 ATOM 5396 C CG . LEU D 4 157 ? 20.335 -43.936 -22.539 1.00 51.94 ? 160 LEU D CG 1 ATOM 5397 N N . SER D 4 158 ? 18.450 -47.113 -22.780 1.00 57.52 ? 161 SER D N 1 ATOM 5398 C CA . SER D 4 158 ? 17.409 -47.590 -21.862 1.00 59.24 ? 161 SER D CA 1 ATOM 5399 C C . SER D 4 158 ? 17.874 -47.608 -20.403 1.00 58.11 ? 161 SER D C 1 ATOM 5400 O O . SER D 4 158 ? 19.050 -47.843 -20.122 1.00 57.49 ? 161 SER D O 1 ATOM 5401 C CB . SER D 4 158 ? 16.886 -48.974 -22.281 1.00 63.18 ? 161 SER D CB 1 ATOM 5402 O OG . SER D 4 158 ? 17.878 -49.981 -22.163 1.00 64.42 ? 161 SER D OG 1 ATOM 5403 N N . TRP D 4 159 ? 16.942 -47.342 -19.488 1.00 58.42 ? 162 TRP D N 1 ATOM 5404 C CA . TRP D 4 159 ? 17.208 -47.404 -18.050 1.00 57.94 ? 162 TRP D CA 1 ATOM 5405 C C . TRP D 4 159 ? 16.851 -48.767 -17.473 1.00 61.47 ? 162 TRP D C 1 ATOM 5406 O O . TRP D 4 159 ? 15.951 -49.451 -17.968 1.00 64.35 ? 162 TRP D O 1 ATOM 5407 C CB . TRP D 4 159 ? 16.425 -46.331 -17.313 1.00 56.62 ? 162 TRP D CB 1 ATOM 5408 C CG . TRP D 4 159 ? 16.981 -44.973 -17.483 1.00 54.47 ? 162 TRP D CG 1 ATOM 5409 C CD1 . TRP D 4 159 ? 16.582 -44.034 -18.388 1.00 54.54 ? 162 TRP D CD1 1 ATOM 5410 C CD2 . TRP D 4 159 ? 18.044 -44.378 -16.726 1.00 52.71 ? 162 TRP D CD2 1 ATOM 5411 N NE1 . TRP D 4 159 ? 17.329 -42.888 -18.241 1.00 53.10 ? 162 TRP D NE1 1 ATOM 5412 C CE2 . TRP D 4 159 ? 18.236 -43.075 -17.230 1.00 51.43 ? 162 TRP D CE2 1 ATOM 5413 C CE3 . TRP D 4 159 ? 18.851 -44.819 -15.673 1.00 52.66 ? 162 TRP D CE3 1 ATOM 5414 C CZ2 . TRP D 4 159 ? 19.201 -42.211 -16.717 1.00 49.82 ? 162 TRP D CZ2 1 ATOM 5415 C CZ3 . TRP D 4 159 ? 19.811 -43.958 -15.166 1.00 51.31 ? 162 TRP D CZ3 1 ATOM 5416 C CH2 . TRP D 4 159 ? 19.977 -42.669 -15.688 1.00 49.70 ? 162 TRP D CH2 1 ATOM 5417 N N . TRP D 4 160 ? 17.562 -49.151 -16.416 1.00 61.94 ? 163 TRP D N 1 ATOM 5418 C CA . TRP D 4 160 ? 17.399 -50.468 -15.814 1.00 66.18 ? 163 TRP D CA 1 ATOM 5419 C C . TRP D 4 160 ? 17.436 -50.411 -14.290 1.00 66.72 ? 163 TRP D C 1 ATOM 5420 O O . TRP D 4 160 ? 18.371 -49.868 -13.703 1.00 64.90 ? 163 TRP D O 1 ATOM 5421 C CB . TRP D 4 160 ? 18.460 -51.438 -16.356 1.00 68.40 ? 163 TRP D CB 1 ATOM 5422 C CG . TRP D 4 160 ? 18.250 -51.793 -17.810 1.00 69.04 ? 163 TRP D CG 1 ATOM 5423 C CD1 . TRP D 4 160 ? 18.606 -51.047 -18.897 1.00 65.68 ? 163 TRP D CD1 1 ATOM 5424 C CD2 . TRP D 4 160 ? 17.624 -52.975 -18.325 1.00 73.61 ? 163 TRP D CD2 1 ATOM 5425 N NE1 . TRP D 4 160 ? 18.243 -51.687 -20.054 1.00 68.07 ? 163 TRP D NE1 1 ATOM 5426 C CE2 . TRP D 4 160 ? 17.638 -52.874 -19.734 1.00 73.02 ? 163 TRP D CE2 1 ATOM 5427 C CE3 . TRP D 4 160 ? 17.053 -54.109 -17.733 1.00 78.80 ? 163 TRP D CE3 1 ATOM 5428 C CZ2 . TRP D 4 160 ? 17.104 -53.865 -20.562 1.00 77.23 ? 163 TRP D CZ2 1 ATOM 5429 C CZ3 . TRP D 4 160 ? 16.519 -55.094 -18.557 1.00 83.52 ? 163 TRP D CZ3 1 ATOM 5430 C CH2 . TRP D 4 160 ? 16.550 -54.964 -19.957 1.00 82.67 ? 163 TRP D CH2 1 ATOM 5431 N N . VAL D 4 161 ? 16.401 -50.965 -13.662 1.00 69.91 ? 164 VAL D N 1 ATOM 5432 C CA . VAL D 4 161 ? 16.301 -51.034 -12.205 1.00 71.28 ? 164 VAL D CA 1 ATOM 5433 C C . VAL D 4 161 ? 16.351 -52.485 -11.709 1.00 77.36 ? 164 VAL D C 1 ATOM 5434 O O . VAL D 4 161 ? 15.445 -53.283 -11.983 1.00 81.37 ? 164 VAL D O 1 ATOM 5435 C CB . VAL D 4 161 ? 15.021 -50.338 -11.698 1.00 70.46 ? 164 VAL D CB 1 ATOM 5436 C CG1 . VAL D 4 161 ? 14.820 -50.592 -10.218 1.00 72.67 ? 164 VAL D CG1 1 ATOM 5437 C CG2 . VAL D 4 161 ? 15.086 -48.844 -11.972 1.00 65.78 ? 164 VAL D CG2 1 ATOM 5438 N N . ASN D 4 162 ? 17.428 -52.817 -10.996 1.00 78.87 ? 165 ASN D N 1 ATOM 5439 C CA . ASN D 4 162 ? 17.604 -54.126 -10.355 1.00 85.36 ? 165 ASN D CA 1 ATOM 5440 C C . ASN D 4 162 ? 17.606 -55.333 -11.301 1.00 90.24 ? 165 ASN D C 1 ATOM 5441 O O . ASN D 4 162 ? 17.721 -56.481 -10.854 1.00 96.64 ? 165 ASN D O 1 ATOM 5442 C CB . ASN D 4 162 ? 16.562 -54.324 -9.244 1.00 88.12 ? 165 ASN D CB 1 ATOM 5443 C CG . ASN D 4 162 ? 16.837 -53.472 -8.017 1.00 85.45 ? 165 ASN D CG 1 ATOM 5444 O OD1 . ASN D 4 162 ? 17.910 -53.548 -7.415 1.00 86.26 ? 165 ASN D OD1 1 ATOM 5445 N ND2 . ASN D 4 162 ? 15.852 -52.674 -7.623 1.00 82.75 ? 165 ASN D ND2 1 ATOM 5446 N N . GLY D 4 163 ? 17.487 -55.077 -12.602 1.00 87.92 ? 166 GLY D N 1 ATOM 5447 C CA . GLY D 4 163 ? 17.426 -56.147 -13.599 1.00 92.52 ? 166 GLY D CA 1 ATOM 5448 C C . GLY D 4 163 ? 16.221 -56.046 -14.514 1.00 92.55 ? 166 GLY D C 1 ATOM 5449 O O . GLY D 4 163 ? 16.083 -56.830 -15.454 1.00 95.95 ? 166 GLY D O 1 ATOM 5450 N N . LYS D 4 164 ? 15.348 -55.079 -14.231 1.00 89.46 ? 167 LYS D N 1 ATOM 5451 C CA . LYS D 4 164 ? 14.174 -54.806 -15.059 1.00 89.88 ? 167 LYS D CA 1 ATOM 5452 C C . LYS D 4 164 ? 14.289 -53.418 -15.671 1.00 83.70 ? 167 LYS D C 1 ATOM 5453 O O . LYS D 4 164 ? 14.869 -52.523 -15.067 1.00 79.38 ? 167 LYS D O 1 ATOM 5454 C CB . LYS D 4 164 ? 12.883 -54.919 -14.242 1.00 93.23 ? 167 LYS D CB 1 ATOM 5455 C CG . LYS D 4 164 ? 12.421 -56.347 -13.986 1.00 101.05 ? 167 LYS D CG 1 ATOM 5456 N N . GLU D 4 165 ? 13.735 -53.250 -16.869 1.00 84.24 ? 168 GLU D N 1 ATOM 5457 C CA . GLU D 4 165 ? 13.833 -51.992 -17.607 1.00 79.75 ? 168 GLU D CA 1 ATOM 5458 C C . GLU D 4 165 ? 12.652 -51.066 -17.313 1.00 79.25 ? 168 GLU D C 1 ATOM 5459 O O . GLU D 4 165 ? 11.500 -51.421 -17.574 1.00 83.41 ? 168 GLU D O 1 ATOM 5460 C CB . GLU D 4 165 ? 13.927 -52.272 -19.109 1.00 80.84 ? 168 GLU D CB 1 ATOM 5461 C CG . GLU D 4 165 ? 14.279 -51.049 -19.959 1.00 77.13 ? 168 GLU D CG 1 ATOM 5462 C CD . GLU D 4 165 ? 13.991 -51.250 -21.437 1.00 79.87 ? 168 GLU D CD 1 ATOM 5463 O OE1 . GLU D 4 165 ? 14.083 -52.403 -21.919 1.00 83.86 ? 168 GLU D OE1 1 ATOM 5464 O OE2 . GLU D 4 165 ? 13.669 -50.247 -22.115 1.00 78.37 ? 168 GLU D OE2 1 ATOM 5465 N N . VAL D 4 166 ? 12.946 -49.878 -16.783 1.00 74.97 ? 169 VAL D N 1 ATOM 5466 C CA . VAL D 4 166 ? 11.900 -48.902 -16.435 1.00 74.87 ? 169 VAL D CA 1 ATOM 5467 C C . VAL D 4 166 ? 11.436 -48.048 -17.610 1.00 74.36 ? 169 VAL D C 1 ATOM 5468 O O . VAL D 4 166 ? 12.243 -47.630 -18.443 1.00 71.66 ? 169 VAL D O 1 ATOM 5469 C CB . VAL D 4 166 ? 12.305 -47.949 -15.268 1.00 71.30 ? 169 VAL D CB 1 ATOM 5470 C CG1 . VAL D 4 166 ? 12.099 -48.624 -13.925 1.00 73.84 ? 169 VAL D CG1 1 ATOM 5471 C CG2 . VAL D 4 166 ? 13.731 -47.442 -15.421 1.00 66.90 ? 169 VAL D CG2 1 ATOM 5472 N N . HIS D 4 167 ? 10.128 -47.797 -17.657 1.00 77.69 ? 170 HIS D N 1 ATOM 5473 C CA . HIS D 4 167 ? 9.540 -46.866 -18.616 1.00 78.32 ? 170 HIS D CA 1 ATOM 5474 C C . HIS D 4 167 ? 9.025 -45.605 -17.916 1.00 77.12 ? 170 HIS D C 1 ATOM 5475 O O . HIS D 4 167 ? 9.078 -44.513 -18.479 1.00 76.01 ? 170 HIS D O 1 ATOM 5476 C CB . HIS D 4 167 ? 8.408 -47.528 -19.408 1.00 84.49 ? 170 HIS D CB 1 ATOM 5477 C CG . HIS D 4 167 ? 8.838 -48.713 -20.221 1.00 87.00 ? 170 HIS D CG 1 ATOM 5478 N ND1 . HIS D 4 167 ? 9.881 -48.663 -21.123 1.00 84.29 ? 170 HIS D ND1 1 ATOM 5479 C CD2 . HIS D 4 167 ? 8.342 -49.974 -20.288 1.00 92.79 ? 170 HIS D CD2 1 ATOM 5480 C CE1 . HIS D 4 167 ? 10.021 -49.847 -21.696 1.00 87.58 ? 170 HIS D CE1 1 ATOM 5481 N NE2 . HIS D 4 167 ? 9.099 -50.659 -21.209 1.00 92.96 ? 170 HIS D NE2 1 ATOM 5482 N N . SER D 4 168 ? 8.536 -45.757 -16.690 1.00 77.84 ? 171 SER D N 1 ATOM 5483 C CA . SER D 4 168 ? 7.988 -44.631 -15.945 1.00 77.33 ? 171 SER D CA 1 ATOM 5484 C C . SER D 4 168 ? 9.088 -43.737 -15.387 1.00 71.94 ? 171 SER D C 1 ATOM 5485 O O . SER D 4 168 ? 10.033 -44.214 -14.749 1.00 69.23 ? 171 SER D O 1 ATOM 5486 C CB . SER D 4 168 ? 7.078 -45.118 -14.817 1.00 80.74 ? 171 SER D CB 1 ATOM 5487 O OG . SER D 4 168 ? 6.406 -44.033 -14.201 1.00 81.32 ? 171 SER D OG 1 ATOM 5488 N N . GLY D 4 169 ? 8.949 -42.436 -15.636 1.00 71.24 ? 172 GLY D N 1 ATOM 5489 C CA . GLY D 4 169 ? 9.892 -41.430 -15.144 1.00 67.15 ? 172 GLY D CA 1 ATOM 5490 C C . GLY D 4 169 ? 11.026 -41.115 -16.104 1.00 64.25 ? 172 GLY D C 1 ATOM 5491 O O . GLY D 4 169 ? 11.938 -40.357 -15.770 1.00 61.37 ? 172 GLY D O 1 ATOM 5492 N N . VAL D 4 170 ? 10.960 -41.685 -17.304 1.00 65.46 ? 173 VAL D N 1 ATOM 5493 C CA . VAL D 4 170 ? 12.046 -41.565 -18.268 1.00 63.11 ? 173 VAL D CA 1 ATOM 5494 C C . VAL D 4 170 ? 11.795 -40.489 -19.324 1.00 64.66 ? 173 VAL D C 1 ATOM 5495 O O . VAL D 4 170 ? 10.718 -40.413 -19.919 1.00 68.41 ? 173 VAL D O 1 ATOM 5496 C CB . VAL D 4 170 ? 12.355 -42.909 -18.962 1.00 63.46 ? 173 VAL D CB 1 ATOM 5497 C CG1 . VAL D 4 170 ? 13.704 -42.842 -19.650 1.00 60.78 ? 173 VAL D CG1 1 ATOM 5498 C CG2 . VAL D 4 170 ? 12.351 -44.042 -17.955 1.00 63.81 ? 173 VAL D CG2 1 ATOM 5499 N N . CYS D 4 171 ? 12.813 -39.660 -19.528 1.00 62.39 ? 174 CYS D N 1 ATOM 5500 C CA . CYS D 4 171 ? 12.861 -38.698 -20.615 1.00 64.08 ? 174 CYS D CA 1 ATOM 5501 C C . CYS D 4 171 ? 14.171 -38.921 -21.346 1.00 61.68 ? 174 CYS D C 1 ATOM 5502 O O . CYS D 4 171 ? 15.196 -39.189 -20.721 1.00 58.76 ? 174 CYS D O 1 ATOM 5503 C CB . CYS D 4 171 ? 12.761 -37.272 -20.058 1.00 65.10 ? 174 CYS D CB 1 ATOM 5504 S SG . CYS D 4 171 ? 13.957 -36.020 -20.652 1.00 65.53 ? 174 CYS D SG 1 ATOM 5505 N N . THR D 4 172 ? 14.130 -38.845 -22.670 1.00 63.62 ? 175 THR D N 1 ATOM 5506 C CA . THR D 4 172 ? 15.337 -38.997 -23.482 1.00 62.16 ? 175 THR D CA 1 ATOM 5507 C C . THR D 4 172 ? 15.320 -37.964 -24.594 1.00 64.93 ? 175 THR D C 1 ATOM 5508 O O . THR D 4 172 ? 14.254 -37.627 -25.114 1.00 68.62 ? 175 THR D O 1 ATOM 5509 C CB . THR D 4 172 ? 15.471 -40.427 -24.073 1.00 61.79 ? 175 THR D CB 1 ATOM 5510 O OG1 . THR D 4 172 ? 15.534 -41.382 -23.008 1.00 60.23 ? 175 THR D OG1 1 ATOM 5511 C CG2 . THR D 4 172 ? 16.734 -40.561 -24.905 1.00 60.34 ? 175 THR D CG2 1 ATOM 5512 N N . ASP D 4 173 ? 16.505 -37.464 -24.942 1.00 63.91 ? 176 ASP D N 1 ATOM 5513 C CA . ASP D 4 173 ? 16.667 -36.455 -25.986 1.00 67.03 ? 176 ASP D CA 1 ATOM 5514 C C . ASP D 4 173 ? 15.924 -36.792 -27.283 1.00 70.21 ? 176 ASP D C 1 ATOM 5515 O O . ASP D 4 173 ? 15.935 -37.943 -27.734 1.00 69.23 ? 176 ASP D O 1 ATOM 5516 C CB . ASP D 4 173 ? 18.151 -36.251 -26.298 1.00 65.66 ? 176 ASP D CB 1 ATOM 5517 C CG . ASP D 4 173 ? 18.894 -35.523 -25.196 1.00 64.81 ? 176 ASP D CG 1 ATOM 5518 O OD1 . ASP D 4 173 ? 18.254 -34.821 -24.382 1.00 66.12 ? 176 ASP D OD1 1 ATOM 5519 O OD2 . ASP D 4 173 ? 20.138 -35.649 -25.155 1.00 64.27 ? 176 ASP D OD2 1 ATOM 5520 N N . PRO D 4 174 ? 15.268 -35.786 -27.883 1.00 74.73 ? 177 PRO D N 1 ATOM 5521 C CA . PRO D 4 174 ? 14.693 -36.001 -29.198 1.00 78.57 ? 177 PRO D CA 1 ATOM 5522 C C . PRO D 4 174 ? 15.790 -36.414 -30.172 1.00 77.16 ? 177 PRO D C 1 ATOM 5523 O O . PRO D 4 174 ? 15.742 -37.524 -30.699 1.00 76.69 ? 177 PRO D O 1 ATOM 5524 C CB . PRO D 4 174 ? 14.113 -34.626 -29.568 1.00 84.27 ? 177 PRO D CB 1 ATOM 5525 C CG . PRO D 4 174 ? 14.718 -33.653 -28.602 1.00 82.84 ? 177 PRO D CG 1 ATOM 5526 C CD . PRO D 4 174 ? 14.985 -34.437 -27.365 1.00 77.38 ? 177 PRO D CD 1 ATOM 5527 N N . GLN D 4 175 ? 16.781 -35.543 -30.371 1.00 77.08 ? 178 GLN D N 1 ATOM 5528 C CA . GLN D 4 175 ? 17.903 -35.794 -31.291 1.00 76.11 ? 178 GLN D CA 1 ATOM 5529 C C . GLN D 4 175 ? 19.241 -35.492 -30.602 1.00 72.83 ? 178 GLN D C 1 ATOM 5530 O O . GLN D 4 175 ? 19.308 -34.572 -29.783 1.00 73.40 ? 178 GLN D O 1 ATOM 5531 C CB . GLN D 4 175 ? 17.761 -34.950 -32.574 1.00 81.50 ? 178 GLN D CB 1 ATOM 5532 C CG . GLN D 4 175 ? 16.630 -35.376 -33.515 1.00 84.93 ? 178 GLN D CG 1 ATOM 5533 N N . PRO D 4 176 ? 20.304 -36.261 -30.929 1.00 70.10 ? 179 PRO D N 1 ATOM 5534 C CA . PRO D 4 176 ? 21.644 -36.086 -30.355 1.00 67.95 ? 179 PRO D CA 1 ATOM 5535 C C . PRO D 4 176 ? 22.254 -34.698 -30.561 1.00 71.00 ? 179 PRO D C 1 ATOM 5536 O O . PRO D 4 176 ? 21.863 -33.970 -31.473 1.00 74.95 ? 179 PRO D O 1 ATOM 5537 C CB . PRO D 4 176 ? 22.479 -37.127 -31.105 1.00 66.72 ? 179 PRO D CB 1 ATOM 5538 C CG . PRO D 4 176 ? 21.522 -38.175 -31.462 1.00 66.33 ? 179 PRO D CG 1 ATOM 5539 C CD . PRO D 4 176 ? 20.258 -37.442 -31.810 1.00 69.72 ? 179 PRO D CD 1 ATOM 5540 N N . LEU D 4 177 ? 23.205 -34.347 -29.701 1.00 69.86 ? 180 LEU D N 1 ATOM 5541 C CA . LEU D 4 177 ? 23.927 -33.093 -29.812 1.00 73.43 ? 180 LEU D CA 1 ATOM 5542 C C . LEU D 4 177 ? 25.280 -33.347 -30.460 1.00 74.20 ? 180 LEU D C 1 ATOM 5543 O O . LEU D 4 177 ? 26.033 -34.215 -30.026 1.00 71.41 ? 180 LEU D O 1 ATOM 5544 C CB . LEU D 4 177 ? 24.110 -32.458 -28.432 1.00 73.03 ? 180 LEU D CB 1 ATOM 5545 N N . LYS D 4 178 ? 25.578 -32.597 -31.513 1.00 78.71 ? 181 LYS D N 1 ATOM 5546 C CA . LYS D 4 178 ? 26.875 -32.689 -32.166 1.00 80.58 ? 181 LYS D CA 1 ATOM 5547 C C . LYS D 4 178 ? 27.917 -31.974 -31.314 1.00 82.59 ? 181 LYS D C 1 ATOM 5548 O O . LYS D 4 178 ? 27.741 -30.802 -30.957 1.00 85.93 ? 181 LYS D O 1 ATOM 5549 C CB . LYS D 4 178 ? 26.814 -32.077 -33.569 1.00 85.40 ? 181 LYS D CB 1 ATOM 5550 N N . GLU D 4 179 ? 28.994 -32.685 -30.985 1.00 81.21 ? 182 GLU D N 1 ATOM 5551 C CA . GLU D 4 179 ? 30.068 -32.132 -30.150 1.00 83.81 ? 182 GLU D CA 1 ATOM 5552 C C . GLU D 4 179 ? 30.892 -31.029 -30.826 1.00 90.28 ? 182 GLU D C 1 ATOM 5553 O O . GLU D 4 179 ? 31.567 -30.263 -30.146 1.00 93.79 ? 182 GLU D O 1 ATOM 5554 C CB . GLU D 4 179 ? 30.989 -33.243 -29.642 1.00 81.57 ? 182 GLU D CB 1 ATOM 5555 C CG . GLU D 4 179 ? 30.359 -34.125 -28.577 1.00 77.21 ? 182 GLU D CG 1 ATOM 5556 C CD . GLU D 4 179 ? 31.300 -35.202 -28.061 1.00 77.33 ? 182 GLU D CD 1 ATOM 5557 O OE1 . GLU D 4 179 ? 32.033 -35.811 -28.876 1.00 78.71 ? 182 GLU D OE1 1 ATOM 5558 O OE2 . GLU D 4 179 ? 31.300 -35.445 -26.832 1.00 76.31 ? 182 GLU D OE2 1 ATOM 5559 N N . GLN D 4 180 ? 30.840 -30.955 -32.154 1.00 92.57 ? 183 GLN D N 1 ATOM 5560 C CA . GLN D 4 180 ? 31.524 -29.902 -32.902 1.00 99.45 ? 183 GLN D CA 1 ATOM 5561 C C . GLN D 4 180 ? 30.639 -29.374 -34.036 1.00 102.19 ? 183 GLN D C 1 ATOM 5562 O O . GLN D 4 180 ? 30.596 -29.957 -35.123 1.00 101.67 ? 183 GLN D O 1 ATOM 5563 C CB . GLN D 4 180 ? 32.874 -30.391 -33.440 1.00 101.54 ? 183 GLN D CB 1 ATOM 5564 C CG . GLN D 4 180 ? 34.008 -30.396 -32.420 1.00 102.74 ? 183 GLN D CG 1 ATOM 5565 N N . PRO D 4 181 ? 29.918 -28.267 -33.780 1.00 105.63 ? 184 PRO D N 1 ATOM 5566 C CA . PRO D 4 181 ? 29.027 -27.661 -34.771 1.00 109.55 ? 184 PRO D CA 1 ATOM 5567 C C . PRO D 4 181 ? 29.771 -26.988 -35.919 1.00 116.76 ? 184 PRO D C 1 ATOM 5568 O O . PRO D 4 181 ? 29.211 -26.846 -37.007 1.00 119.64 ? 184 PRO D O 1 ATOM 5569 C CB . PRO D 4 181 ? 28.256 -26.611 -33.961 1.00 112.09 ? 184 PRO D CB 1 ATOM 5570 C CG . PRO D 4 181 ? 28.452 -26.993 -32.531 1.00 107.20 ? 184 PRO D CG 1 ATOM 5571 C CD . PRO D 4 181 ? 29.819 -27.583 -32.481 1.00 106.13 ? 184 PRO D CD 1 ATOM 5572 N N . ALA D 4 182 ? 31.015 -26.577 -35.679 1.00 120.42 ? 185 ALA D N 1 ATOM 5573 C CA . ALA D 4 182 ? 31.830 -25.929 -36.710 1.00 127.95 ? 185 ALA D CA 1 ATOM 5574 C C . ALA D 4 182 ? 32.574 -26.938 -37.595 1.00 126.09 ? 185 ALA D C 1 ATOM 5575 O O . ALA D 4 182 ? 33.529 -26.581 -38.289 1.00 131.84 ? 185 ALA D O 1 ATOM 5576 C CB . ALA D 4 182 ? 32.802 -24.938 -36.077 1.00 134.20 ? 185 ALA D CB 1 ATOM 5577 N N . LEU D 4 183 ? 32.125 -28.193 -37.560 1.00 118.68 ? 186 LEU D N 1 ATOM 5578 C CA . LEU D 4 183 ? 32.683 -29.270 -38.387 1.00 116.58 ? 186 LEU D CA 1 ATOM 5579 C C . LEU D 4 183 ? 31.579 -30.102 -39.052 1.00 112.29 ? 186 LEU D C 1 ATOM 5580 O O . LEU D 4 183 ? 30.391 -29.901 -38.784 1.00 110.79 ? 186 LEU D O 1 ATOM 5581 C CB . LEU D 4 183 ? 33.602 -30.176 -37.553 1.00 112.68 ? 186 LEU D CB 1 ATOM 5582 C CG . LEU D 4 183 ? 34.941 -29.623 -37.049 1.00 117.52 ? 186 LEU D CG 1 ATOM 5583 C CD1 . LEU D 4 183 ? 35.585 -30.598 -36.080 1.00 113.34 ? 186 LEU D CD1 1 ATOM 5584 C CD2 . LEU D 4 183 ? 35.895 -29.303 -38.197 1.00 124.28 ? 186 LEU D CD2 1 ATOM 5585 N N . ASN D 4 184 ? 31.977 -31.029 -39.921 1.00 111.06 ? 187 ASN D N 1 ATOM 5586 C CA . ASN D 4 184 ? 31.032 -31.917 -40.600 1.00 107.55 ? 187 ASN D CA 1 ATOM 5587 C C . ASN D 4 184 ? 30.996 -33.316 -39.976 1.00 100.63 ? 187 ASN D C 1 ATOM 5588 O O . ASN D 4 184 ? 29.957 -33.748 -39.468 1.00 96.64 ? 187 ASN D O 1 ATOM 5589 C CB . ASN D 4 184 ? 31.333 -31.996 -42.103 1.00 111.58 ? 187 ASN D CB 1 ATOM 5590 C CG . ASN D 4 184 ? 31.103 -30.676 -42.814 1.00 118.78 ? 187 ASN D CG 1 ATOM 5591 N N . ASP D 4 185 ? 32.139 -34.000 -39.998 1.00 99.98 ? 188 ASP D N 1 ATOM 5592 C CA . ASP D 4 185 ? 32.262 -35.380 -39.504 1.00 94.57 ? 188 ASP D CA 1 ATOM 5593 C C . ASP D 4 185 ? 32.310 -35.517 -37.972 1.00 90.84 ? 188 ASP D C 1 ATOM 5594 O O . ASP D 4 185 ? 32.786 -36.529 -37.446 1.00 88.21 ? 188 ASP D O 1 ATOM 5595 C CB . ASP D 4 185 ? 33.478 -36.072 -40.149 1.00 96.58 ? 188 ASP D CB 1 ATOM 5596 C CG . ASP D 4 185 ? 34.673 -35.135 -40.336 1.00 102.52 ? 188 ASP D CG 1 ATOM 5597 O OD1 . ASP D 4 185 ? 34.867 -34.213 -39.515 1.00 104.36 ? 188 ASP D OD1 1 ATOM 5598 O OD2 . ASP D 4 185 ? 35.426 -35.329 -41.316 1.00 106.25 ? 188 ASP D OD2 1 ATOM 5599 N N . SER D 4 186 ? 31.795 -34.503 -37.275 1.00 90.94 ? 189 SER D N 1 ATOM 5600 C CA . SER D 4 186 ? 31.782 -34.441 -35.807 1.00 87.92 ? 189 SER D CA 1 ATOM 5601 C C . SER D 4 186 ? 31.152 -35.648 -35.113 1.00 81.92 ? 189 SER D C 1 ATOM 5602 O O . SER D 4 186 ? 30.235 -36.271 -35.645 1.00 79.85 ? 189 SER D O 1 ATOM 5603 C CB . SER D 4 186 ? 31.056 -33.173 -35.349 1.00 89.63 ? 189 SER D CB 1 ATOM 5604 O OG . SER D 4 186 ? 30.727 -33.237 -33.974 1.00 85.88 ? 189 SER D OG 1 ATOM 5605 N N . ARG D 4 187 ? 31.654 -35.957 -33.920 1.00 79.83 ? 190 ARG D N 1 ATOM 5606 C CA . ARG D 4 187 ? 31.075 -36.993 -33.072 1.00 74.89 ? 190 ARG D CA 1 ATOM 5607 C C . ARG D 4 187 ? 29.915 -36.416 -32.271 1.00 72.71 ? 190 ARG D C 1 ATOM 5608 O O . ARG D 4 187 ? 29.825 -35.203 -32.083 1.00 75.18 ? 190 ARG D O 1 ATOM 5609 C CB . ARG D 4 187 ? 32.131 -37.587 -32.139 1.00 74.82 ? 190 ARG D CB 1 ATOM 5610 C CG . ARG D 4 187 ? 33.220 -38.367 -32.857 1.00 77.08 ? 190 ARG D CG 1 ATOM 5611 C CD . ARG D 4 187 ? 33.902 -39.364 -31.935 1.00 77.01 ? 190 ARG D CD 1 ATOM 5612 N NE . ARG D 4 187 ? 34.811 -38.728 -30.986 1.00 79.90 ? 190 ARG D NE 1 ATOM 5613 N N . TYR D 4 188 ? 29.030 -37.285 -31.796 1.00 68.78 ? 191 TYR D N 1 ATOM 5614 C CA . TYR D 4 188 ? 27.810 -36.842 -31.124 1.00 67.02 ? 191 TYR D CA 1 ATOM 5615 C C . TYR D 4 188 ? 27.823 -37.040 -29.599 1.00 64.59 ? 191 TYR D C 1 ATOM 5616 O O . TYR D 4 188 ? 28.830 -37.465 -29.022 1.00 64.68 ? 191 TYR D O 1 ATOM 5617 C CB . TYR D 4 188 ? 26.595 -37.534 -31.745 1.00 65.57 ? 191 TYR D CB 1 ATOM 5618 C CG . TYR D 4 188 ? 26.277 -37.099 -33.162 1.00 68.68 ? 191 TYR D CG 1 ATOM 5619 C CD1 . TYR D 4 188 ? 25.422 -36.024 -33.405 1.00 71.17 ? 191 TYR D CD1 1 ATOM 5620 C CD2 . TYR D 4 188 ? 26.814 -37.772 -34.258 1.00 69.85 ? 191 TYR D CD2 1 ATOM 5621 C CE1 . TYR D 4 188 ? 25.117 -35.621 -34.701 1.00 74.56 ? 191 TYR D CE1 1 ATOM 5622 C CE2 . TYR D 4 188 ? 26.515 -37.376 -35.563 1.00 73.11 ? 191 TYR D CE2 1 ATOM 5623 C CZ . TYR D 4 188 ? 25.665 -36.300 -35.774 1.00 75.47 ? 191 TYR D CZ 1 ATOM 5624 O OH . TYR D 4 188 ? 25.361 -35.901 -37.057 1.00 79.20 ? 191 TYR D OH 1 ATOM 5625 N N . ALA D 4 189 ? 26.699 -36.703 -28.960 1.00 62.97 ? 192 ALA D N 1 ATOM 5626 C CA . ALA D 4 189 ? 26.480 -36.911 -27.523 1.00 60.55 ? 192 ALA D CA 1 ATOM 5627 C C . ALA D 4 189 ? 24.984 -37.023 -27.257 1.00 58.81 ? 192 ALA D C 1 ATOM 5628 O O . ALA D 4 189 ? 24.180 -36.429 -27.977 1.00 60.46 ? 192 ALA D O 1 ATOM 5629 C CB . ALA D 4 189 ? 27.079 -35.779 -26.715 1.00 62.42 ? 192 ALA D CB 1 ATOM 5630 N N . LEU D 4 190 ? 24.611 -37.784 -26.230 1.00 56.28 ? 193 LEU D N 1 ATOM 5631 C CA . LEU D 4 190 ? 23.201 -38.017 -25.906 1.00 55.00 ? 193 LEU D CA 1 ATOM 5632 C C . LEU D 4 190 ? 22.983 -38.096 -24.399 1.00 53.41 ? 193 LEU D C 1 ATOM 5633 O O . LEU D 4 190 ? 23.801 -38.678 -23.678 1.00 52.59 ? 193 LEU D O 1 ATOM 5634 C CB . LEU D 4 190 ? 22.696 -39.300 -26.583 1.00 54.11 ? 193 LEU D CB 1 ATOM 5635 C CG . LEU D 4 190 ? 21.180 -39.518 -26.692 1.00 54.19 ? 193 LEU D CG 1 ATOM 5636 C CD1 . LEU D 4 190 ? 20.568 -38.740 -27.846 0.70 56.69 ? 193 LEU D CD1 1 ATOM 5637 C CD2 . LEU D 4 190 ? 20.871 -40.991 -26.846 0.70 53.73 ? 193 LEU D CD2 1 ATOM 5638 N N . SER D 4 191 ? 21.879 -37.512 -23.934 1.00 53.61 ? 194 SER D N 1 ATOM 5639 C CA . SER D 4 191 ? 21.524 -37.517 -22.512 1.00 52.38 ? 194 SER D CA 1 ATOM 5640 C C . SER D 4 191 ? 20.200 -38.229 -22.246 1.00 51.73 ? 194 SER D C 1 ATOM 5641 O O . SER D 4 191 ? 19.358 -38.345 -23.139 1.00 53.09 ? 194 SER D O 1 ATOM 5642 C CB . SER D 4 191 ? 21.444 -36.087 -21.977 1.00 54.10 ? 194 SER D CB 1 ATOM 5643 O OG . SER D 4 191 ? 20.227 -35.456 -22.357 1.00 56.01 ? 194 SER D OG 1 ATOM 5644 N N . SER D 4 192 ? 20.018 -38.690 -21.011 1.00 50.38 ? 195 SER D N 1 ATOM 5645 C CA . SER D 4 192 ? 18.773 -39.337 -20.590 1.00 50.47 ? 195 SER D CA 1 ATOM 5646 C C . SER D 4 192 ? 18.552 -39.194 -19.090 1.00 49.62 ? 195 SER D C 1 ATOM 5647 O O . SER D 4 192 ? 19.499 -39.037 -18.324 1.00 48.90 ? 195 SER D O 1 ATOM 5648 C CB . SER D 4 192 ? 18.754 -40.818 -20.986 1.00 50.42 ? 195 SER D CB 1 ATOM 5649 O OG . SER D 4 192 ? 17.451 -41.365 -20.834 1.00 51.93 ? 195 SER D OG 1 ATOM 5650 N N . ARG D 4 193 ? 17.293 -39.269 -18.675 1.00 50.41 ? 196 ARG D N 1 ATOM 5651 C CA . ARG D 4 193 ? 16.916 -38.928 -17.311 1.00 50.02 ? 196 ARG D CA 1 ATOM 5652 C C . ARG D 4 193 ? 15.903 -39.896 -16.714 1.00 50.46 ? 196 ARG D C 1 ATOM 5653 O O . ARG D 4 193 ? 14.922 -40.273 -17.365 1.00 52.33 ? 196 ARG D O 1 ATOM 5654 C CB . ARG D 4 193 ? 16.370 -37.501 -17.278 1.00 51.65 ? 196 ARG D CB 1 ATOM 5655 C CG . ARG D 4 193 ? 17.453 -36.453 -17.367 1.00 51.95 ? 196 ARG D CG 1 ATOM 5656 C CD . ARG D 4 193 ? 17.002 -35.254 -18.150 1.00 55.70 ? 196 ARG D CD 1 ATOM 5657 N NE . ARG D 4 193 ? 17.325 -35.380 -19.568 1.00 57.21 ? 196 ARG D NE 1 ATOM 5658 C CZ . ARG D 4 193 ? 17.465 -34.346 -20.397 1.00 60.19 ? 196 ARG D CZ 1 ATOM 5659 N NH1 . ARG D 4 193 ? 17.761 -34.553 -21.675 1.00 60.73 ? 196 ARG D NH1 1 ATOM 5660 N NH2 . ARG D 4 193 ? 17.320 -33.101 -19.950 1.00 62.38 ? 196 ARG D NH2 1 ATOM 5661 N N . LEU D 4 194 ? 16.158 -40.298 -15.473 1.00 49.30 ? 197 LEU D N 1 ATOM 5662 C CA . LEU D 4 194 ? 15.254 -41.162 -14.728 1.00 50.15 ? 197 LEU D CA 1 ATOM 5663 C C . LEU D 4 194 ? 14.989 -40.548 -13.377 1.00 50.06 ? 197 LEU D C 1 ATOM 5664 O O . LEU D 4 194 ? 15.887 -40.472 -12.539 1.00 49.05 ? 197 LEU D O 1 ATOM 5665 C CB . LEU D 4 194 ? 15.848 -42.559 -14.545 1.00 50.08 ? 197 LEU D CB 1 ATOM 5666 C CG . LEU D 4 194 ? 15.166 -43.465 -13.517 1.00 51.45 ? 197 LEU D CG 1 ATOM 5667 C CD1 . LEU D 4 194 ? 13.779 -43.924 -13.981 1.00 54.42 ? 197 LEU D CD1 1 ATOM 5668 C CD2 . LEU D 4 194 ? 16.051 -44.644 -13.221 1.00 52.37 ? 197 LEU D CD2 1 ATOM 5669 N N . ARG D 4 195 ? 13.753 -40.116 -13.162 1.00 51.87 ? 198 ARG D N 1 ATOM 5670 C CA . ARG D 4 195 ? 13.404 -39.460 -11.914 1.00 52.31 ? 198 ARG D CA 1 ATOM 5671 C C . ARG D 4 195 ? 12.495 -40.324 -11.047 1.00 54.09 ? 198 ARG D C 1 ATOM 5672 O O . ARG D 4 195 ? 11.341 -40.588 -11.387 1.00 56.67 ? 198 ARG D O 1 ATOM 5673 C CB . ARG D 4 195 ? 12.811 -38.068 -12.170 1.00 53.76 ? 198 ARG D CB 1 ATOM 5674 C CG . ARG D 4 195 ? 12.243 -37.389 -10.942 1.00 54.78 ? 198 ARG D CG 1 ATOM 5675 C CD . ARG D 4 195 ? 11.726 -36.014 -11.269 1.00 57.10 ? 198 ARG D CD 1 ATOM 5676 N NE . ARG D 4 195 ? 12.531 -34.971 -10.645 1.00 57.08 ? 198 ARG D NE 1 ATOM 5677 C CZ . ARG D 4 195 ? 12.254 -33.671 -10.708 1.00 60.38 ? 198 ARG D CZ 1 ATOM 5678 N NH1 . ARG D 4 195 ? 13.039 -32.794 -10.093 1.00 60.70 ? 198 ARG D NH1 1 ATOM 5679 N NH2 . ARG D 4 195 ? 11.194 -33.241 -11.383 1.00 63.72 ? 198 ARG D NH2 1 ATOM 5680 N N . VAL D 4 196 ? 13.058 -40.767 -9.930 1.00 53.42 ? 199 VAL D N 1 ATOM 5681 C CA . VAL D 4 196 ? 12.368 -41.573 -8.938 1.00 55.52 ? 199 VAL D CA 1 ATOM 5682 C C . VAL D 4 196 ? 12.070 -40.717 -7.714 1.00 56.05 ? 199 VAL D C 1 ATOM 5683 O O . VAL D 4 196 ? 12.527 -39.574 -7.624 1.00 54.91 ? 199 VAL D O 1 ATOM 5684 C CB . VAL D 4 196 ? 13.234 -42.782 -8.507 1.00 55.58 ? 199 VAL D CB 1 ATOM 5685 C CG1 . VAL D 4 196 ? 13.215 -43.879 -9.579 1.00 56.47 ? 199 VAL D CG1 1 ATOM 5686 C CG2 . VAL D 4 196 ? 14.673 -42.344 -8.168 1.00 52.86 ? 199 VAL D CG2 1 ATOM 5687 N N . SER D 4 197 ? 11.311 -41.270 -6.771 1.00 58.45 ? 200 SER D N 1 ATOM 5688 C CA . SER D 4 197 ? 11.065 -40.597 -5.494 1.00 59.18 ? 200 SER D CA 1 ATOM 5689 C C . SER D 4 197 ? 12.326 -40.608 -4.614 1.00 57.54 ? 200 SER D C 1 ATOM 5690 O O . SER D 4 197 ? 13.236 -41.427 -4.816 1.00 56.99 ? 200 SER D O 1 ATOM 5691 C CB . SER D 4 197 ? 9.886 -41.238 -4.758 1.00 62.61 ? 200 SER D CB 1 ATOM 5692 O OG . SER D 4 197 ? 10.248 -42.493 -4.207 1.00 63.96 ? 200 SER D OG 1 ATOM 5693 N N . ALA D 4 198 ? 12.373 -39.694 -3.647 1.00 57.35 ? 201 ALA D N 1 ATOM 5694 C CA . ALA D 4 198 ? 13.519 -39.565 -2.757 1.00 56.37 ? 201 ALA D CA 1 ATOM 5695 C C . ALA D 4 198 ? 13.705 -40.792 -1.869 1.00 57.87 ? 201 ALA D C 1 ATOM 5696 O O . ALA D 4 198 ? 14.834 -41.232 -1.645 1.00 57.70 ? 201 ALA D O 1 ATOM 5697 C CB . ALA D 4 198 ? 13.396 -38.314 -1.915 1.00 56.96 ? 201 ALA D CB 1 ATOM 5698 N N . THR D 4 199 ? 12.600 -41.347 -1.377 1.00 59.94 ? 202 THR D N 1 ATOM 5699 C CA . THR D 4 199 ? 12.658 -42.535 -0.518 1.00 62.44 ? 202 THR D CA 1 ATOM 5700 C C . THR D 4 199 ? 13.101 -43.785 -1.287 1.00 62.83 ? 202 THR D C 1 ATOM 5701 O O . THR D 4 199 ? 13.624 -44.730 -0.696 1.00 64.83 ? 202 THR D O 1 ATOM 5702 C CB . THR D 4 199 ? 11.324 -42.791 0.221 1.00 65.60 ? 202 THR D CB 1 ATOM 5703 O OG1 . THR D 4 199 ? 10.276 -42.998 -0.733 1.00 66.83 ? 202 THR D OG1 1 ATOM 5704 C CG2 . THR D 4 199 ? 10.967 -41.607 1.130 1.00 65.41 ? 202 THR D CG2 1 ATOM 5705 N N . PHE D 4 200 ? 12.904 -43.772 -2.603 1.00 61.32 ? 203 PHE D N 1 ATOM 5706 C CA . PHE D 4 200 ? 13.390 -44.843 -3.464 1.00 61.94 ? 203 PHE D CA 1 ATOM 5707 C C . PHE D 4 200 ? 14.900 -44.772 -3.650 1.00 60.32 ? 203 PHE D C 1 ATOM 5708 O O . PHE D 4 200 ? 15.588 -45.789 -3.576 1.00 62.23 ? 203 PHE D O 1 ATOM 5709 C CB . PHE D 4 200 ? 12.699 -44.816 -4.825 1.00 61.22 ? 203 PHE D CB 1 ATOM 5710 C CG . PHE D 4 200 ? 12.897 -46.077 -5.629 1.00 63.23 ? 203 PHE D CG 1 ATOM 5711 C CD1 . PHE D 4 200 ? 13.892 -46.154 -6.599 1.00 61.14 ? 203 PHE D CD1 1 ATOM 5712 C CD2 . PHE D 4 200 ? 12.093 -47.194 -5.409 1.00 67.26 ? 203 PHE D CD2 1 ATOM 5713 C CE1 . PHE D 4 200 ? 14.078 -47.321 -7.338 1.00 62.86 ? 203 PHE D CE1 1 ATOM 5714 C CE2 . PHE D 4 200 ? 12.274 -48.360 -6.142 1.00 69.30 ? 203 PHE D CE2 1 ATOM 5715 C CZ . PHE D 4 200 ? 13.265 -48.424 -7.107 1.00 66.90 ? 203 PHE D CZ 1 ATOM 5716 N N . TRP D 4 201 ? 15.406 -43.566 -3.895 1.00 57.77 ? 204 TRP D N 1 ATOM 5717 C CA . TRP D 4 201 ? 16.842 -43.348 -4.081 1.00 56.94 ? 204 TRP D CA 1 ATOM 5718 C C . TRP D 4 201 ? 17.663 -43.571 -2.801 1.00 59.12 ? 204 TRP D C 1 ATOM 5719 O O . TRP D 4 201 ? 18.831 -43.954 -2.866 1.00 60.07 ? 204 TRP D O 1 ATOM 5720 C CB . TRP D 4 201 ? 17.114 -41.951 -4.651 1.00 54.37 ? 204 TRP D CB 1 ATOM 5721 C CG . TRP D 4 201 ? 18.553 -41.558 -4.535 1.00 54.76 ? 204 TRP D CG 1 ATOM 5722 C CD1 . TRP D 4 201 ? 19.084 -40.618 -3.695 1.00 55.14 ? 204 TRP D CD1 1 ATOM 5723 C CD2 . TRP D 4 201 ? 19.658 -42.133 -5.246 1.00 55.66 ? 204 TRP D CD2 1 ATOM 5724 N NE1 . TRP D 4 201 ? 20.450 -40.559 -3.854 1.00 56.30 ? 204 TRP D NE1 1 ATOM 5725 C CE2 . TRP D 4 201 ? 20.829 -41.477 -4.799 1.00 56.63 ? 204 TRP D CE2 1 ATOM 5726 C CE3 . TRP D 4 201 ? 19.772 -43.132 -6.225 1.00 55.73 ? 204 TRP D CE3 1 ATOM 5727 C CZ2 . TRP D 4 201 ? 22.102 -41.790 -5.298 1.00 57.83 ? 204 TRP D CZ2 1 ATOM 5728 C CZ3 . TRP D 4 201 ? 21.037 -43.440 -6.720 1.00 56.86 ? 204 TRP D CZ3 1 ATOM 5729 C CH2 . TRP D 4 201 ? 22.185 -42.769 -6.254 1.00 57.73 ? 204 TRP D CH2 1 ATOM 5730 N N . GLN D 4 202 ? 17.046 -43.328 -1.648 1.00 60.47 ? 205 GLN D N 1 ATOM 5731 C CA . GLN D 4 202 ? 17.720 -43.468 -0.357 1.00 63.15 ? 205 GLN D CA 1 ATOM 5732 C C . GLN D 4 202 ? 17.838 -44.920 0.100 1.00 67.12 ? 205 GLN D C 1 ATOM 5733 O O . GLN D 4 202 ? 18.421 -45.208 1.147 1.00 70.38 ? 205 GLN D O 1 ATOM 5734 C CB . GLN D 4 202 ? 17.014 -42.625 0.704 1.00 63.36 ? 205 GLN D CB 1 ATOM 5735 C CG . GLN D 4 202 ? 17.303 -41.130 0.591 1.00 61.79 ? 205 GLN D CG 1 ATOM 5736 C CD . GLN D 4 202 ? 16.187 -40.270 1.158 1.00 62.24 ? 205 GLN D CD 1 ATOM 5737 O OE1 . GLN D 4 202 ? 15.078 -40.754 1.422 1.00 63.69 ? 205 GLN D OE1 1 ATOM 5738 N NE2 . GLN D 4 202 ? 16.472 -38.984 1.343 1.00 60.94 ? 205 GLN D NE2 1 ATOM 5739 N N . ASN D 4 203 ? 17.285 -45.831 -0.692 1.00 67.65 ? 206 ASN D N 1 ATOM 5740 C CA . ASN D 4 203 ? 17.364 -47.253 -0.411 1.00 72.14 ? 206 ASN D CA 1 ATOM 5741 C C . ASN D 4 203 ? 18.664 -47.836 -0.962 1.00 73.55 ? 206 ASN D C 1 ATOM 5742 O O . ASN D 4 203 ? 18.949 -47.693 -2.149 1.00 70.91 ? 206 ASN D O 1 ATOM 5743 C CB . ASN D 4 203 ? 16.151 -47.962 -1.013 1.00 73.10 ? 206 ASN D CB 1 ATOM 5744 C CG . ASN D 4 203 ? 16.000 -49.384 -0.530 1.00 78.68 ? 206 ASN D CG 1 ATOM 5745 O OD1 . ASN D 4 203 ? 16.906 -50.204 -0.670 1.00 81.43 ? 206 ASN D OD1 1 ATOM 5746 N ND2 . ASN D 4 203 ? 14.839 -49.690 0.027 1.00 81.27 ? 206 ASN D ND2 1 ATOM 5747 N N . PRO D 4 204 ? 19.463 -48.486 -0.098 1.00 78.31 ? 207 PRO D N 1 ATOM 5748 C CA . PRO D 4 204 ? 20.713 -49.126 -0.514 1.00 81.15 ? 207 PRO D CA 1 ATOM 5749 C C . PRO D 4 204 ? 20.515 -50.313 -1.457 1.00 83.32 ? 207 PRO D C 1 ATOM 5750 O O . PRO D 4 204 ? 21.295 -50.482 -2.392 1.00 82.89 ? 207 PRO D O 1 ATOM 5751 C CB . PRO D 4 204 ? 21.325 -49.605 0.809 1.00 87.05 ? 207 PRO D CB 1 ATOM 5752 C CG . PRO D 4 204 ? 20.185 -49.678 1.764 1.00 88.17 ? 207 PRO D CG 1 ATOM 5753 C CD . PRO D 4 204 ? 19.280 -48.554 1.362 1.00 81.85 ? 207 PRO D CD 1 ATOM 5754 N N . ARG D 4 205 ? 19.479 -51.115 -1.213 1.00 86.20 ? 208 ARG D N 1 ATOM 5755 C CA . ARG D 4 205 ? 19.232 -52.340 -1.982 1.00 89.79 ? 208 ARG D CA 1 ATOM 5756 C C . ARG D 4 205 ? 18.805 -52.086 -3.435 1.00 85.45 ? 208 ARG D C 1 ATOM 5757 O O . ARG D 4 205 ? 18.752 -53.023 -4.248 1.00 87.84 ? 208 ARG D O 1 ATOM 5758 C CB . ARG D 4 205 ? 18.200 -53.223 -1.269 1.00 94.92 ? 208 ARG D CB 1 ATOM 5759 N N . ASN D 4 206 ? 18.510 -50.823 -3.751 1.00 79.58 ? 209 ASN D N 1 ATOM 5760 C CA . ASN D 4 206 ? 18.112 -50.430 -5.104 1.00 75.74 ? 209 ASN D CA 1 ATOM 5761 C C . ASN D 4 206 ? 19.304 -50.211 -6.033 1.00 73.87 ? 209 ASN D C 1 ATOM 5762 O O . ASN D 4 206 ? 20.295 -49.580 -5.660 1.00 72.78 ? 209 ASN D O 1 ATOM 5763 C CB . ASN D 4 206 ? 17.176 -49.217 -5.078 1.00 71.37 ? 209 ASN D CB 1 ATOM 5764 C CG . ASN D 4 206 ? 15.764 -49.575 -4.615 1.00 73.99 ? 209 ASN D CG 1 ATOM 5765 O OD1 . ASN D 4 206 ? 15.334 -50.727 -4.714 1.00 78.43 ? 209 ASN D OD1 1 ATOM 5766 N ND2 . ASN D 4 206 ? 15.037 -48.582 -4.112 1.00 71.90 ? 209 ASN D ND2 1 ATOM 5767 N N . HIS D 4 207 ? 19.191 -50.752 -7.244 1.00 74.20 ? 210 HIS D N 1 ATOM 5768 C CA . HIS D 4 207 ? 20.285 -50.766 -8.213 1.00 73.57 ? 210 HIS D CA 1 ATOM 5769 C C . HIS D 4 207 ? 19.888 -50.090 -9.525 1.00 69.20 ? 210 HIS D C 1 ATOM 5770 O O . HIS D 4 207 ? 18.794 -50.310 -10.054 1.00 69.01 ? 210 HIS D O 1 ATOM 5771 C CB . HIS D 4 207 ? 20.753 -52.207 -8.456 1.00 79.22 ? 210 HIS D CB 1 ATOM 5772 C CG . HIS D 4 207 ? 21.802 -52.339 -9.516 1.00 79.63 ? 210 HIS D CG 1 ATOM 5773 N ND1 . HIS D 4 207 ? 23.061 -51.790 -9.392 1.00 79.64 ? 210 HIS D ND1 1 ATOM 5774 C CD2 . HIS D 4 207 ? 21.785 -52.973 -10.713 1.00 81.21 ? 210 HIS D CD2 1 ATOM 5775 C CE1 . HIS D 4 207 ? 23.771 -52.074 -10.470 1.00 80.55 ? 210 HIS D CE1 1 ATOM 5776 N NE2 . HIS D 4 207 ? 23.020 -52.793 -11.287 1.00 81.31 ? 210 HIS D NE2 1 ATOM 5777 N N . PHE D 4 208 ? 20.796 -49.269 -10.038 1.00 66.34 ? 211 PHE D N 1 ATOM 5778 C CA . PHE D 4 208 ? 20.543 -48.493 -11.237 1.00 62.72 ? 211 PHE D CA 1 ATOM 5779 C C . PHE D 4 208 ? 21.579 -48.818 -12.302 1.00 63.15 ? 211 PHE D C 1 ATOM 5780 O O . PHE D 4 208 ? 22.725 -49.143 -11.984 1.00 65.42 ? 211 PHE D O 1 ATOM 5781 C CB . PHE D 4 208 ? 20.553 -47.004 -10.904 1.00 59.27 ? 211 PHE D CB 1 ATOM 5782 C CG . PHE D 4 208 ? 19.512 -46.602 -9.886 1.00 59.60 ? 211 PHE D CG 1 ATOM 5783 C CD1 . PHE D 4 208 ? 19.777 -46.699 -8.518 1.00 61.65 ? 211 PHE D CD1 1 ATOM 5784 C CD2 . PHE D 4 208 ? 18.267 -46.123 -10.293 1.00 58.36 ? 211 PHE D CD2 1 ATOM 5785 C CE1 . PHE D 4 208 ? 18.815 -46.326 -7.576 1.00 61.70 ? 211 PHE D CE1 1 ATOM 5786 C CE2 . PHE D 4 208 ? 17.302 -45.747 -9.356 1.00 58.47 ? 211 PHE D CE2 1 ATOM 5787 C CZ . PHE D 4 208 ? 17.576 -45.850 -7.999 1.00 59.92 ? 211 PHE D CZ 1 ATOM 5788 N N . ARG D 4 209 ? 21.161 -48.744 -13.565 1.00 61.59 ? 212 ARG D N 1 ATOM 5789 C CA . ARG D 4 209 ? 22.016 -49.081 -14.704 1.00 62.03 ? 212 ARG D CA 1 ATOM 5790 C C . ARG D 4 209 ? 21.516 -48.405 -15.979 1.00 59.09 ? 212 ARG D C 1 ATOM 5791 O O . ARG D 4 209 ? 20.394 -48.647 -16.425 1.00 59.20 ? 212 ARG D O 1 ATOM 5792 C CB . ARG D 4 209 ? 22.080 -50.607 -14.905 1.00 66.61 ? 212 ARG D CB 1 ATOM 5793 C CG . ARG D 4 209 ? 23.249 -51.087 -15.762 1.00 68.31 ? 212 ARG D CG 1 ATOM 5794 C CD . ARG D 4 209 ? 23.129 -52.563 -16.103 1.00 73.15 ? 212 ARG D CD 1 ATOM 5795 N NE . ARG D 4 209 ? 22.182 -52.806 -17.189 1.00 72.60 ? 212 ARG D NE 1 ATOM 5796 N N . CYS D 4 210 ? 22.350 -47.539 -16.546 1.00 57.17 ? 213 CYS D N 1 ATOM 5797 C CA . CYS D 4 210 ? 22.107 -46.971 -17.870 1.00 55.27 ? 213 CYS D CA 1 ATOM 5798 C C . CYS D 4 210 ? 22.564 -48.004 -18.895 1.00 56.97 ? 213 CYS D C 1 ATOM 5799 O O . CYS D 4 210 ? 23.537 -48.721 -18.662 1.00 59.24 ? 213 CYS D O 1 ATOM 5800 C CB . CYS D 4 210 ? 22.890 -45.665 -18.040 1.00 53.25 ? 213 CYS D CB 1 ATOM 5801 S SG . CYS D 4 210 ? 22.408 -44.650 -19.464 1.00 52.84 ? 213 CYS D SG 1 ATOM 5802 N N . GLN D 4 211 ? 21.863 -48.093 -20.018 1.00 56.35 ? 214 GLN D N 1 ATOM 5803 C CA . GLN D 4 211 ? 22.200 -49.082 -21.033 1.00 58.41 ? 214 GLN D CA 1 ATOM 5804 C C . GLN D 4 211 ? 22.143 -48.457 -22.417 1.00 56.90 ? 214 GLN D C 1 ATOM 5805 O O . GLN D 4 211 ? 21.064 -48.114 -22.908 1.00 56.47 ? 214 GLN D O 1 ATOM 5806 C CB . GLN D 4 211 ? 21.247 -50.278 -20.950 1.00 61.52 ? 214 GLN D CB 1 ATOM 5807 C CG . GLN D 4 211 ? 21.759 -51.539 -21.597 1.00 65.18 ? 214 GLN D CG 1 ATOM 5808 C CD . GLN D 4 211 ? 20.783 -52.103 -22.611 1.00 68.19 ? 214 GLN D CD 1 ATOM 5809 O OE1 . GLN D 4 211 ? 20.577 -53.320 -22.689 1.00 73.04 ? 214 GLN D OE1 1 ATOM 5810 N NE2 . GLN D 4 211 ? 20.178 -51.222 -23.405 1.00 65.64 ? 214 GLN D NE2 1 ATOM 5811 N N . VAL D 4 212 ? 23.309 -48.308 -23.039 1.00 56.70 ? 215 VAL D N 1 ATOM 5812 C CA . VAL D 4 212 ? 23.400 -47.711 -24.372 1.00 55.62 ? 215 VAL D CA 1 ATOM 5813 C C . VAL D 4 212 ? 23.826 -48.744 -25.426 1.00 58.17 ? 215 VAL D C 1 ATOM 5814 O O . VAL D 4 212 ? 24.932 -49.294 -25.371 1.00 59.88 ? 215 VAL D O 1 ATOM 5815 C CB . VAL D 4 212 ? 24.309 -46.452 -24.385 1.00 53.85 ? 215 VAL D CB 1 ATOM 5816 C CG1 . VAL D 4 212 ? 24.442 -45.894 -25.787 1.00 53.53 ? 215 VAL D CG1 1 ATOM 5817 C CG2 . VAL D 4 212 ? 23.743 -45.387 -23.463 1.00 51.41 ? 215 VAL D CG2 1 ATOM 5818 N N . GLN D 4 213 ? 22.917 -48.998 -26.368 1.00 58.87 ? 216 GLN D N 1 ATOM 5819 C CA . GLN D 4 213 ? 23.120 -49.940 -27.464 1.00 61.51 ? 216 GLN D CA 1 ATOM 5820 C C . GLN D 4 213 ? 23.577 -49.183 -28.704 1.00 60.63 ? 216 GLN D C 1 ATOM 5821 O O . GLN D 4 213 ? 22.824 -48.399 -29.276 1.00 59.57 ? 216 GLN D O 1 ATOM 5822 C CB . GLN D 4 213 ? 21.823 -50.705 -27.741 1.00 63.85 ? 216 GLN D CB 1 ATOM 5823 C CG . GLN D 4 213 ? 21.762 -51.412 -29.081 1.00 67.17 ? 216 GLN D CG 1 ATOM 5824 C CD . GLN D 4 213 ? 22.458 -52.750 -29.069 1.00 71.96 ? 216 GLN D CD 1 ATOM 5825 O OE1 . GLN D 4 213 ? 23.490 -52.934 -29.720 1.00 73.65 ? 216 GLN D OE1 1 ATOM 5826 N NE2 . GLN D 4 213 ? 21.899 -53.700 -28.326 1.00 75.17 ? 216 GLN D NE2 1 ATOM 5827 N N . PHE D 4 214 ? 24.823 -49.419 -29.101 1.00 61.72 ? 217 PHE D N 1 ATOM 5828 C CA . PHE D 4 214 ? 25.432 -48.711 -30.219 1.00 61.51 ? 217 PHE D CA 1 ATOM 5829 C C . PHE D 4 214 ? 25.643 -49.658 -31.387 1.00 64.59 ? 217 PHE D C 1 ATOM 5830 O O . PHE D 4 214 ? 26.092 -50.790 -31.203 1.00 67.18 ? 217 PHE D O 1 ATOM 5831 C CB . PHE D 4 214 ? 26.755 -48.077 -29.781 1.00 61.02 ? 217 PHE D CB 1 ATOM 5832 C CG . PHE D 4 214 ? 27.667 -47.696 -30.917 1.00 62.08 ? 217 PHE D CG 1 ATOM 5833 C CD1 . PHE D 4 214 ? 27.417 -46.562 -31.680 1.00 60.89 ? 217 PHE D CD1 1 ATOM 5834 C CD2 . PHE D 4 214 ? 28.788 -48.464 -31.209 1.00 64.63 ? 217 PHE D CD2 1 ATOM 5835 C CE1 . PHE D 4 214 ? 28.261 -46.207 -32.727 1.00 62.42 ? 217 PHE D CE1 1 ATOM 5836 C CE2 . PHE D 4 214 ? 29.633 -48.116 -32.252 1.00 66.23 ? 217 PHE D CE2 1 ATOM 5837 C CZ . PHE D 4 214 ? 29.369 -46.984 -33.012 1.00 64.92 ? 217 PHE D CZ 1 ATOM 5838 N N . TYR D 4 215 ? 25.314 -49.175 -32.584 1.00 64.91 ? 218 TYR D N 1 ATOM 5839 C CA . TYR D 4 215 ? 25.389 -49.962 -33.812 1.00 67.88 ? 218 TYR D CA 1 ATOM 5840 C C . TYR D 4 215 ? 26.555 -49.516 -34.686 1.00 68.49 ? 218 TYR D C 1 ATOM 5841 O O . TYR D 4 215 ? 26.533 -48.423 -35.254 1.00 67.48 ? 218 TYR D O 1 ATOM 5842 C CB . TYR D 4 215 ? 24.079 -49.841 -34.586 1.00 68.65 ? 218 TYR D CB 1 ATOM 5843 C CG . TYR D 4 215 ? 22.884 -50.390 -33.853 1.00 69.49 ? 218 TYR D CG 1 ATOM 5844 C CD1 . TYR D 4 215 ? 22.040 -49.550 -33.127 1.00 67.80 ? 218 TYR D CD1 1 ATOM 5845 C CD2 . TYR D 4 215 ? 22.593 -51.755 -33.886 1.00 73.27 ? 218 TYR D CD2 1 ATOM 5846 C CE1 . TYR D 4 215 ? 20.931 -50.059 -32.450 1.00 69.44 ? 218 TYR D CE1 1 ATOM 5847 C CE2 . TYR D 4 215 ? 21.492 -52.276 -33.219 1.00 74.89 ? 218 TYR D CE2 1 ATOM 5848 C CZ . TYR D 4 215 ? 20.664 -51.427 -32.504 1.00 73.12 ? 218 TYR D CZ 1 ATOM 5849 O OH . TYR D 4 215 ? 19.575 -51.952 -31.844 1.00 75.24 ? 218 TYR D OH 1 ATOM 5850 N N . GLY D 4 216 ? 27.570 -50.369 -34.792 1.00 70.98 ? 219 GLY D N 1 ATOM 5851 C CA . GLY D 4 216 ? 28.786 -50.040 -35.533 1.00 72.30 ? 219 GLY D CA 1 ATOM 5852 C C . GLY D 4 216 ? 29.188 -51.097 -36.538 1.00 75.99 ? 219 GLY D C 1 ATOM 5853 O O . GLY D 4 216 ? 28.336 -51.718 -37.167 1.00 77.28 ? 219 GLY D O 1 ATOM 5854 N N . LEU D 4 217 ? 30.495 -51.292 -36.679 1.00 78.48 ? 220 LEU D N 1 ATOM 5855 C CA . LEU D 4 217 ? 31.062 -52.263 -37.614 1.00 82.70 ? 220 LEU D CA 1 ATOM 5856 C C . LEU D 4 217 ? 30.657 -53.686 -37.255 1.00 85.70 ? 220 LEU D C 1 ATOM 5857 O O . LEU D 4 217 ? 30.682 -54.072 -36.086 1.00 85.82 ? 220 LEU D O 1 ATOM 5858 C CB . LEU D 4 217 ? 32.591 -52.153 -37.643 1.00 85.17 ? 220 LEU D CB 1 ATOM 5859 C CG . LEU D 4 217 ? 33.212 -50.842 -38.136 1.00 83.90 ? 220 LEU D CG 1 ATOM 5860 N N . SER D 4 218 ? 30.265 -54.451 -38.268 1.00 88.83 ? 221 SER D N 1 ATOM 5861 C CA . SER D 4 218 ? 29.973 -55.870 -38.100 1.00 93.30 ? 221 SER D CA 1 ATOM 5862 C C . SER D 4 218 ? 31.248 -56.681 -38.315 1.00 98.50 ? 221 SER D C 1 ATOM 5863 O O . SER D 4 218 ? 32.026 -56.386 -39.226 1.00 99.58 ? 221 SER D O 1 ATOM 5864 C CB . SER D 4 218 ? 28.880 -56.315 -39.073 1.00 94.81 ? 221 SER D CB 1 ATOM 5865 N N . GLU D 4 219 ? 31.445 -57.703 -37.481 1.00 102.48 ? 222 GLU D N 1 ATOM 5866 C CA . GLU D 4 219 ? 32.674 -58.519 -37.462 1.00 108.52 ? 222 GLU D CA 1 ATOM 5867 C C . GLU D 4 219 ? 33.127 -59.098 -38.815 1.00 112.99 ? 222 GLU D C 1 ATOM 5868 O O . GLU D 4 219 ? 34.153 -59.778 -38.886 1.00 118.53 ? 222 GLU D O 1 ATOM 5869 C CB . GLU D 4 219 ? 32.551 -59.641 -36.421 1.00 112.86 ? 222 GLU D CB 1 ATOM 5870 N N . ASN D 4 220 ? 32.367 -58.825 -39.874 1.00 111.30 ? 223 ASN D N 1 ATOM 5871 C CA . ASN D 4 220 ? 32.768 -59.177 -41.241 1.00 115.05 ? 223 ASN D CA 1 ATOM 5872 C C . ASN D 4 220 ? 33.502 -58.031 -41.959 1.00 112.51 ? 223 ASN D C 1 ATOM 5873 O O . ASN D 4 220 ? 33.860 -58.151 -43.139 1.00 115.00 ? 223 ASN D O 1 ATOM 5874 C CB . ASN D 4 220 ? 31.556 -59.642 -42.057 1.00 115.98 ? 223 ASN D CB 1 ATOM 5875 N N . ASP D 4 221 ? 33.720 -56.930 -41.234 1.00 108.09 ? 224 ASP D N 1 ATOM 5876 C CA . ASP D 4 221 ? 34.415 -55.747 -41.754 1.00 106.08 ? 224 ASP D CA 1 ATOM 5877 C C . ASP D 4 221 ? 35.861 -55.688 -41.267 1.00 109.04 ? 224 ASP D C 1 ATOM 5878 O O . ASP D 4 221 ? 36.130 -55.836 -40.070 1.00 109.19 ? 224 ASP D O 1 ATOM 5879 C CB . ASP D 4 221 ? 33.672 -54.465 -41.359 1.00 99.97 ? 224 ASP D CB 1 ATOM 5880 N N . GLU D 4 222 ? 36.782 -55.467 -42.204 1.00 111.94 ? 225 GLU D N 1 ATOM 5881 C CA . GLU D 4 222 ? 38.215 -55.432 -41.908 1.00 116.21 ? 225 GLU D CA 1 ATOM 5882 C C . GLU D 4 222 ? 38.605 -54.171 -41.137 1.00 113.19 ? 225 GLU D C 1 ATOM 5883 O O . GLU D 4 222 ? 38.131 -53.074 -41.444 1.00 108.82 ? 225 GLU D O 1 ATOM 5884 C CB . GLU D 4 222 ? 39.035 -55.544 -43.198 1.00 120.54 ? 225 GLU D CB 1 ATOM 5885 N N . TRP D 4 223 ? 39.474 -54.343 -40.141 1.00 116.33 ? 226 TRP D N 1 ATOM 5886 C CA . TRP D 4 223 ? 39.912 -53.246 -39.276 1.00 114.57 ? 226 TRP D CA 1 ATOM 5887 C C . TRP D 4 223 ? 41.428 -53.255 -39.071 1.00 121.09 ? 226 TRP D C 1 ATOM 5888 O O . TRP D 4 223 ? 42.017 -54.300 -38.784 1.00 126.69 ? 226 TRP D O 1 ATOM 5889 C CB . TRP D 4 223 ? 39.183 -53.315 -37.929 1.00 111.16 ? 226 TRP D CB 1 ATOM 5890 C CG . TRP D 4 223 ? 39.454 -52.152 -37.022 1.00 108.90 ? 226 TRP D CG 1 ATOM 5891 C CD1 . TRP D 4 223 ? 40.114 -52.183 -35.829 1.00 111.60 ? 226 TRP D CD1 1 ATOM 5892 C CD2 . TRP D 4 223 ? 39.073 -50.788 -37.236 1.00 104.36 ? 226 TRP D CD2 1 ATOM 5893 N NE1 . TRP D 4 223 ? 40.165 -50.924 -35.282 1.00 108.82 ? 226 TRP D NE1 1 ATOM 5894 C CE2 . TRP D 4 223 ? 39.535 -50.048 -36.126 1.00 104.47 ? 226 TRP D CE2 1 ATOM 5895 C CE3 . TRP D 4 223 ? 38.386 -50.119 -38.257 1.00 100.86 ? 226 TRP D CE3 1 ATOM 5896 C CZ2 . TRP D 4 223 ? 39.334 -48.669 -36.008 1.00 101.19 ? 226 TRP D CZ2 1 ATOM 5897 C CZ3 . TRP D 4 223 ? 38.188 -48.751 -38.141 1.00 97.89 ? 226 TRP D CZ3 1 ATOM 5898 C CH2 . TRP D 4 223 ? 38.661 -48.040 -37.024 1.00 98.13 ? 226 TRP D CH2 1 ATOM 5899 N N . THR D 4 224 ? 42.045 -52.082 -39.209 1.00 121.13 ? 227 THR D N 1 ATOM 5900 C CA . THR D 4 224 ? 43.507 -51.963 -39.196 1.00 128.18 ? 227 THR D CA 1 ATOM 5901 C C . THR D 4 224 ? 44.064 -51.129 -38.043 1.00 128.97 ? 227 THR D C 1 ATOM 5902 O O . THR D 4 224 ? 45.077 -51.498 -37.447 1.00 135.43 ? 227 THR D O 1 ATOM 5903 C CB . THR D 4 224 ? 44.052 -51.384 -40.530 1.00 130.42 ? 227 THR D CB 1 ATOM 5904 O OG1 . THR D 4 224 ? 43.350 -50.176 -40.856 1.00 124.80 ? 227 THR D OG1 1 ATOM 5905 C CG2 . THR D 4 224 ? 43.894 -52.388 -41.671 1.00 132.30 ? 227 THR D CG2 1 ATOM 5906 N N . GLN D 4 225 ? 43.402 -50.014 -37.737 1.00 123.13 ? 228 GLN D N 1 ATOM 5907 C CA . GLN D 4 225 ? 43.896 -49.035 -36.757 1.00 123.95 ? 228 GLN D CA 1 ATOM 5908 C C . GLN D 4 225 ? 44.327 -49.643 -35.421 1.00 127.19 ? 228 GLN D C 1 ATOM 5909 O O . GLN D 4 225 ? 43.737 -50.622 -34.954 1.00 125.71 ? 228 GLN D O 1 ATOM 5910 C CB . GLN D 4 225 ? 42.862 -47.928 -36.525 1.00 116.87 ? 228 GLN D CB 1 ATOM 5911 C CG . GLN D 4 225 ? 42.560 -47.086 -37.759 1.00 115.05 ? 228 GLN D CG 1 ATOM 5912 N N . ASP D 4 226 ? 45.351 -49.042 -34.815 1.00 132.24 ? 229 ASP D N 1 ATOM 5913 C CA . ASP D 4 226 ? 45.996 -49.570 -33.604 1.00 137.37 ? 229 ASP D CA 1 ATOM 5914 C C . ASP D 4 226 ? 45.158 -49.505 -32.311 1.00 132.39 ? 229 ASP D C 1 ATOM 5915 O O . ASP D 4 226 ? 45.639 -49.887 -31.242 1.00 136.81 ? 229 ASP D O 1 ATOM 5916 C CB . ASP D 4 226 ? 47.359 -48.899 -33.391 1.00 145.25 ? 229 ASP D CB 1 ATOM 5917 N N . ARG D 4 227 ? 43.919 -49.024 -32.405 1.00 123.82 ? 230 ARG D N 1 ATOM 5918 C CA . ARG D 4 227 ? 42.997 -49.065 -31.267 1.00 118.87 ? 230 ARG D CA 1 ATOM 5919 C C . ARG D 4 227 ? 42.016 -50.242 -31.406 1.00 115.61 ? 230 ARG D C 1 ATOM 5920 O O . ARG D 4 227 ? 42.169 -51.072 -32.306 1.00 118.00 ? 230 ARG D O 1 ATOM 5921 C CB . ARG D 4 227 ? 42.270 -47.719 -31.089 1.00 112.76 ? 230 ARG D CB 1 ATOM 5922 C CG . ARG D 4 227 ? 41.205 -47.398 -32.140 1.00 106.65 ? 230 ARG D CG 1 ATOM 5923 C CD . ARG D 4 227 ? 40.565 -46.033 -31.895 1.00 101.88 ? 230 ARG D CD 1 ATOM 5924 N NE . ARG D 4 227 ? 39.250 -45.908 -32.529 1.00 95.62 ? 230 ARG D NE 1 ATOM 5925 C CZ . ARG D 4 227 ? 39.038 -45.529 -33.790 1.00 94.78 ? 230 ARG D CZ 1 ATOM 5926 N NH1 . ARG D 4 227 ? 40.053 -45.232 -34.594 1.00 99.40 ? 230 ARG D NH1 1 ATOM 5927 N NH2 . ARG D 4 227 ? 37.799 -45.447 -34.252 1.00 89.82 ? 230 ARG D NH2 1 ATOM 5928 N N . ALA D 4 228 ? 41.026 -50.313 -30.514 1.00 110.73 ? 231 ALA D N 1 ATOM 5929 C CA . ALA D 4 228 ? 40.024 -51.386 -30.526 1.00 108.06 ? 231 ALA D CA 1 ATOM 5930 C C . ALA D 4 228 ? 39.052 -51.255 -31.696 1.00 102.74 ? 231 ALA D C 1 ATOM 5931 O O . ALA D 4 228 ? 38.740 -50.142 -32.123 1.00 98.80 ? 231 ALA D O 1 ATOM 5932 C CB . ALA D 4 228 ? 39.261 -51.410 -29.206 1.00 105.01 ? 231 ALA D CB 1 ATOM 5933 N N . LYS D 4 229 ? 38.580 -52.393 -32.206 1.00 103.40 ? 232 LYS D N 1 ATOM 5934 C CA . LYS D 4 229 ? 37.599 -52.419 -33.295 1.00 99.32 ? 232 LYS D CA 1 ATOM 5935 C C . LYS D 4 229 ? 36.229 -51.929 -32.811 1.00 92.83 ? 232 LYS D C 1 ATOM 5936 O O . LYS D 4 229 ? 35.682 -52.469 -31.845 1.00 92.41 ? 232 LYS D O 1 ATOM 5937 C CB . LYS D 4 229 ? 37.483 -53.823 -33.892 1.00 102.93 ? 232 LYS D CB 1 ATOM 5938 N N . PRO D 4 230 ? 35.668 -50.905 -33.486 1.00 88.43 ? 233 PRO D N 1 ATOM 5939 C CA . PRO D 4 230 ? 34.437 -50.254 -33.038 1.00 82.85 ? 233 PRO D CA 1 ATOM 5940 C C . PRO D 4 230 ? 33.167 -51.029 -33.411 1.00 81.10 ? 233 PRO D C 1 ATOM 5941 O O . PRO D 4 230 ? 32.330 -50.532 -34.166 1.00 78.38 ? 233 PRO D O 1 ATOM 5942 C CB . PRO D 4 230 ? 34.487 -48.901 -33.753 1.00 80.81 ? 233 PRO D CB 1 ATOM 5943 C CG . PRO D 4 230 ? 35.259 -49.156 -34.998 1.00 84.33 ? 233 PRO D CG 1 ATOM 5944 C CD . PRO D 4 230 ? 36.146 -50.353 -34.768 1.00 89.34 ? 233 PRO D CD 1 ATOM 5945 N N . VAL D 4 231 ? 33.027 -52.232 -32.858 1.00 83.45 ? 234 VAL D N 1 ATOM 5946 C CA . VAL D 4 231 ? 31.910 -53.124 -33.184 1.00 83.36 ? 234 VAL D CA 1 ATOM 5947 C C . VAL D 4 231 ? 30.600 -52.682 -32.533 1.00 79.01 ? 234 VAL D C 1 ATOM 5948 O O . VAL D 4 231 ? 30.590 -51.791 -31.686 1.00 76.11 ? 234 VAL D O 1 ATOM 5949 C CB . VAL D 4 231 ? 32.211 -54.597 -32.785 1.00 88.61 ? 234 VAL D CB 1 ATOM 5950 C CG1 . VAL D 4 231 ? 33.472 -55.104 -33.481 1.00 93.77 ? 234 VAL D CG1 1 ATOM 5951 C CG2 . VAL D 4 231 ? 32.331 -54.744 -31.266 1.00 89.26 ? 234 VAL D CG2 1 ATOM 5952 N N . THR D 4 232 ? 29.500 -53.309 -32.943 1.00 79.20 ? 235 THR D N 1 ATOM 5953 C CA . THR D 4 232 ? 28.211 -53.133 -32.283 1.00 76.45 ? 235 THR D CA 1 ATOM 5954 C C . THR D 4 232 ? 28.288 -53.741 -30.883 1.00 77.64 ? 235 THR D C 1 ATOM 5955 O O . THR D 4 232 ? 28.677 -54.903 -30.720 1.00 82.14 ? 235 THR D O 1 ATOM 5956 C CB . THR D 4 232 ? 27.059 -53.765 -33.104 1.00 77.93 ? 235 THR D CB 1 ATOM 5957 O OG1 . THR D 4 232 ? 26.810 -52.969 -34.269 1.00 76.47 ? 235 THR D OG1 1 ATOM 5958 C CG2 . THR D 4 232 ? 25.774 -53.852 -32.287 1.00 76.92 ? 235 THR D CG2 1 ATOM 5959 N N . GLN D 4 233 ? 27.925 -52.938 -29.883 1.00 74.06 ? 236 GLN D N 1 ATOM 5960 C CA . GLN D 4 233 ? 28.067 -53.306 -28.476 1.00 74.79 ? 236 GLN D CA 1 ATOM 5961 C C . GLN D 4 233 ? 27.067 -52.576 -27.584 1.00 70.99 ? 236 GLN D C 1 ATOM 5962 O O . GLN D 4 233 ? 26.466 -51.577 -27.987 1.00 67.46 ? 236 GLN D O 1 ATOM 5963 C CB . GLN D 4 233 ? 29.490 -53.011 -27.999 1.00 76.02 ? 236 GLN D CB 1 ATOM 5964 C CG . GLN D 4 233 ? 29.982 -51.615 -28.354 1.00 72.72 ? 236 GLN D CG 1 ATOM 5965 C CD . GLN D 4 233 ? 31.392 -51.353 -27.878 1.00 75.22 ? 236 GLN D CD 1 ATOM 5966 O OE1 . GLN D 4 233 ? 31.660 -51.318 -26.676 1.00 75.96 ? 236 GLN D OE1 1 ATOM 5967 N NE2 . GLN D 4 233 ? 32.306 -51.159 -28.821 1.00 77.35 ? 236 GLN D NE2 1 ATOM 5968 N N . ILE D 4 234 ? 26.905 -53.091 -26.368 1.00 72.31 ? 237 ILE D N 1 ATOM 5969 C CA . ILE D 4 234 ? 26.051 -52.489 -25.353 1.00 69.29 ? 237 ILE D CA 1 ATOM 5970 C C . ILE D 4 234 ? 26.935 -51.962 -24.223 1.00 68.83 ? 237 ILE D C 1 ATOM 5971 O O . ILE D 4 234 ? 27.561 -52.740 -23.495 1.00 72.49 ? 237 ILE D O 1 ATOM 5972 C CB . ILE D 4 234 ? 25.037 -53.514 -24.788 1.00 71.84 ? 237 ILE D CB 1 ATOM 5973 C CG1 . ILE D 4 234 ? 24.126 -54.048 -25.891 1.00 73.40 ? 237 ILE D CG1 1 ATOM 5974 C CG2 . ILE D 4 234 ? 24.193 -52.898 -23.699 1.00 69.36 ? 237 ILE D CG2 1 ATOM 5975 N N . VAL D 4 235 ? 26.996 -50.641 -24.086 1.00 65.12 ? 238 VAL D N 1 ATOM 5976 C CA . VAL D 4 235 ? 27.795 -50.019 -23.031 1.00 64.96 ? 238 VAL D CA 1 ATOM 5977 C C . VAL D 4 235 ? 26.869 -49.536 -21.915 1.00 62.73 ? 238 VAL D C 1 ATOM 5978 O O . VAL D 4 235 ? 25.859 -48.878 -22.181 1.00 59.73 ? 238 VAL D O 1 ATOM 5979 C CB . VAL D 4 235 ? 28.662 -48.849 -23.561 1.00 63.56 ? 238 VAL D CB 1 ATOM 5980 C CG1 . VAL D 4 235 ? 29.745 -48.490 -22.557 1.00 65.13 ? 238 VAL D CG1 1 ATOM 5981 C CG2 . VAL D 4 235 ? 29.290 -49.203 -24.895 1.00 65.15 ? 238 VAL D CG2 1 ATOM 5982 N N . SER D 4 236 ? 27.224 -49.874 -20.674 1.00 64.86 ? 239 SER D N 1 ATOM 5983 C CA . SER D 4 236 ? 26.390 -49.609 -19.502 1.00 63.37 ? 239 SER D CA 1 ATOM 5984 C C . SER D 4 236 ? 27.152 -48.885 -18.400 1.00 63.61 ? 239 SER D C 1 ATOM 5985 O O . SER D 4 236 ? 28.311 -49.200 -18.119 1.00 66.96 ? 239 SER D O 1 ATOM 5986 C CB . SER D 4 236 ? 25.831 -50.921 -18.931 1.00 66.69 ? 239 SER D CB 1 ATOM 5987 O OG . SER D 4 236 ? 25.049 -51.627 -19.880 1.00 67.41 ? 239 SER D OG 1 ATOM 5988 N N . ALA D 4 237 ? 26.483 -47.915 -17.783 1.00 60.74 ? 240 ALA D N 1 ATOM 5989 C CA . ALA D 4 237 ? 26.963 -47.275 -16.554 1.00 61.22 ? 240 ALA D CA 1 ATOM 5990 C C . ALA D 4 237 ? 26.023 -47.626 -15.402 1.00 61.23 ? 240 ALA D C 1 ATOM 5991 O O . ALA D 4 237 ? 24.815 -47.770 -15.602 1.00 59.34 ? 240 ALA D O 1 ATOM 5992 C CB . ALA D 4 237 ? 27.060 -45.768 -16.730 1.00 58.39 ? 240 ALA D CB 1 ATOM 5993 N N . GLU D 4 238 ? 26.577 -47.769 -14.200 1.00 63.89 ? 241 GLU D N 1 ATOM 5994 C CA . GLU D 4 238 ? 25.783 -48.198 -13.047 1.00 64.75 ? 241 GLU D CA 1 ATOM 5995 C C . GLU D 4 238 ? 26.020 -47.389 -11.771 1.00 64.85 ? 241 GLU D C 1 ATOM 5996 O O . GLU D 4 238 ? 27.136 -46.950 -11.499 1.00 66.71 ? 241 GLU D O 1 ATOM 5997 C CB . GLU D 4 238 ? 25.959 -49.704 -12.787 1.00 69.66 ? 241 GLU D CB 1 ATOM 5998 C CG . GLU D 4 238 ? 27.323 -50.280 -13.159 1.00 73.71 ? 241 GLU D CG 1 ATOM 5999 C CD . GLU D 4 238 ? 27.388 -51.784 -12.969 1.00 79.09 ? 241 GLU D CD 1 ATOM 6000 N N . ALA D 4 239 ? 24.942 -47.183 -11.015 1.00 63.45 ? 242 ALA D N 1 ATOM 6001 C CA . ALA D 4 239 ? 24.982 -46.532 -9.703 1.00 63.88 ? 242 ALA D CA 1 ATOM 6002 C C . ALA D 4 239 ? 24.138 -47.298 -8.675 1.00 65.89 ? 242 ALA D C 1 ATOM 6003 O O . ALA D 4 239 ? 23.337 -48.167 -9.032 1.00 66.50 ? 242 ALA D O 1 ATOM 6004 C CB . ALA D 4 239 ? 24.516 -45.094 -9.810 1.00 59.82 ? 242 ALA D CB 1 ATOM 6005 N N . TRP D 4 240 ? 24.331 -46.975 -7.400 1.00 67.66 ? 243 TRP D N 1 ATOM 6006 C CA . TRP D 4 240 ? 23.604 -47.627 -6.311 1.00 70.13 ? 243 TRP D CA 1 ATOM 6007 C C . TRP D 4 240 ? 22.994 -46.613 -5.350 1.00 68.14 ? 243 TRP D C 1 ATOM 6008 O O . TRP D 4 240 ? 23.538 -45.521 -5.161 1.00 66.90 ? 243 TRP D O 1 ATOM 6009 C CB . TRP D 4 240 ? 24.532 -48.559 -5.540 1.00 76.11 ? 243 TRP D CB 1 ATOM 6010 C CG . TRP D 4 240 ? 24.879 -49.806 -6.270 1.00 79.68 ? 243 TRP D CG 1 ATOM 6011 C CD1 . TRP D 4 240 ? 25.699 -49.921 -7.353 1.00 79.82 ? 243 TRP D CD1 1 ATOM 6012 C CD2 . TRP D 4 240 ? 24.433 -51.128 -5.960 1.00 84.65 ? 243 TRP D CD2 1 ATOM 6013 N NE1 . TRP D 4 240 ? 25.784 -51.234 -7.744 1.00 84.38 ? 243 TRP D NE1 1 ATOM 6014 C CE2 . TRP D 4 240 ? 25.020 -51.998 -6.903 1.00 87.50 ? 243 TRP D CE2 1 ATOM 6015 C CE3 . TRP D 4 240 ? 23.591 -51.665 -4.975 1.00 87.60 ? 243 TRP D CE3 1 ATOM 6016 C CZ2 . TRP D 4 240 ? 24.789 -53.377 -6.897 1.00 93.24 ? 243 TRP D CZ2 1 ATOM 6017 C CZ3 . TRP D 4 240 ? 23.362 -53.039 -4.967 1.00 93.21 ? 243 TRP D CZ3 1 ATOM 6018 C CH2 . TRP D 4 240 ? 23.960 -53.877 -5.923 1.00 96.20 ? 243 TRP D CH2 1 ATOM 6019 N N . GLY D 4 241 ? 21.869 -46.987 -4.745 1.00 68.56 ? 244 GLY D N 1 ATOM 6020 C CA . GLY D 4 241 ? 21.199 -46.155 -3.749 1.00 67.43 ? 244 GLY D CA 1 ATOM 6021 C C . GLY D 4 241 ? 22.013 -45.969 -2.480 1.00 70.54 ? 244 GLY D C 1 ATOM 6022 O O . GLY D 4 241 ? 22.760 -46.859 -2.078 1.00 75.06 ? 244 GLY D O 1 ATOM 6023 N N . ARG D 4 242 ? 21.864 -44.808 -1.849 1.00 68.94 ? 245 ARG D N 1 ATOM 6024 C CA . ARG D 4 242 ? 22.653 -44.471 -0.671 1.00 72.20 ? 245 ARG D CA 1 ATOM 6025 C C . ARG D 4 242 ? 21.773 -44.123 0.531 1.00 72.55 ? 245 ARG D C 1 ATOM 6026 O O . ARG D 4 242 ? 20.746 -43.462 0.386 1.00 69.37 ? 245 ARG D O 1 ATOM 6027 C CB . ARG D 4 242 ? 23.611 -43.321 -0.996 1.00 71.23 ? 245 ARG D CB 1 ATOM 6028 C CG . ARG D 4 242 ? 23.018 -41.924 -0.845 1.00 68.53 ? 245 ARG D CG 1 ATOM 6029 C CD . ARG D 4 242 ? 23.387 -41.035 -2.013 1.00 67.40 ? 245 ARG D CD 1 ATOM 6030 N NE . ARG D 4 242 ? 24.816 -41.068 -2.322 1.00 70.81 ? 245 ARG D NE 1 ATOM 6031 C CZ . ARG D 4 242 ? 25.382 -40.426 -3.341 1.00 70.22 ? 245 ARG D CZ 1 ATOM 6032 N NH1 . ARG D 4 242 ? 24.649 -39.690 -4.169 1.00 66.49 ? 245 ARG D NH1 1 ATOM 6033 N NH2 . ARG D 4 242 ? 26.690 -40.521 -3.531 1.00 74.03 ? 245 ARG D NH2 1 ATOM 6034 N N . ALA D 4 243 ? 22.186 -44.571 1.714 1.00 77.07 ? 246 ALA D N 1 ATOM 6035 C CA . ALA D 4 243 ? 21.462 -44.275 2.947 1.00 78.10 ? 246 ALA D CA 1 ATOM 6036 C C . ALA D 4 243 ? 21.839 -42.894 3.482 1.00 77.24 ? 246 ALA D C 1 ATOM 6037 O O . ALA D 4 243 ? 21.421 -41.870 2.939 1.00 73.32 ? 246 ALA D O 1 ATOM 6038 C CB . ALA D 4 243 ? 21.723 -45.356 4.000 1.00 84.05 ? 246 ALA D CB 1 HETATM 6039 C C1 . NAG E 5 . ? 9.919 -47.650 -78.224 1.00 110.43 ? 400 NAG A C1 1 HETATM 6040 C C2 . NAG E 5 . ? 11.373 -47.196 -78.441 1.00 118.36 ? 400 NAG A C2 1 HETATM 6041 C C3 . NAG E 5 . ? 11.707 -46.872 -79.904 1.00 120.55 ? 400 NAG A C3 1 HETATM 6042 C C4 . NAG E 5 . ? 10.647 -46.006 -80.609 1.00 116.52 ? 400 NAG A C4 1 HETATM 6043 C C5 . NAG E 5 . ? 9.232 -46.273 -80.066 1.00 109.21 ? 400 NAG A C5 1 HETATM 6044 C C6 . NAG E 5 . ? 8.158 -46.229 -81.154 1.00 104.41 ? 400 NAG A C6 1 HETATM 6045 C C7 . NAG E 5 . ? 12.270 -46.116 -76.426 1.00 124.95 ? 400 NAG A C7 1 HETATM 6046 C C8 . NAG E 5 . ? 12.513 -44.812 -75.724 1.00 128.44 ? 400 NAG A C8 1 HETATM 6047 N N2 . NAG E 5 . ? 11.682 -46.035 -77.619 1.00 121.53 ? 400 NAG A N2 1 HETATM 6048 O O3 . NAG E 5 . ? 11.907 -48.076 -80.612 1.00 120.52 ? 400 NAG A O3 1 HETATM 6049 O O4 . NAG E 5 . ? 11.000 -44.641 -80.436 1.00 120.17 ? 400 NAG A O4 1 HETATM 6050 O O5 . NAG E 5 . ? 9.178 -47.534 -79.428 1.00 107.47 ? 400 NAG A O5 1 HETATM 6051 O O6 . NAG E 5 . ? 8.145 -47.431 -81.894 1.00 103.03 ? 400 NAG A O6 1 HETATM 6052 O O7 . NAG E 5 . ? 12.608 -47.175 -75.896 1.00 125.65 ? 400 NAG A O7 1 HETATM 6053 C C1 . NAG F 5 . ? 10.959 -43.843 -81.650 1.00 121.38 ? 401 NAG A C1 1 HETATM 6054 C C2 . NAG F 5 . ? 12.338 -43.706 -82.305 1.00 128.98 ? 401 NAG A C2 1 HETATM 6055 C C3 . NAG F 5 . ? 12.268 -42.759 -83.504 1.00 130.88 ? 401 NAG A C3 1 HETATM 6056 C C4 . NAG F 5 . ? 11.074 -43.055 -84.421 1.00 124.65 ? 401 NAG A C4 1 HETATM 6057 C C5 . NAG F 5 . ? 9.793 -43.264 -83.613 1.00 117.39 ? 401 NAG A C5 1 HETATM 6058 C C6 . NAG F 5 . ? 8.622 -43.681 -84.496 1.00 111.76 ? 401 NAG A C6 1 HETATM 6059 N N2 . NAG F 5 . ? 13.321 -43.229 -81.352 1.00 134.57 ? 401 NAG A N2 1 HETATM 6060 O O3 . NAG F 5 . ? 13.469 -42.864 -84.236 1.00 137.74 ? 401 NAG A O3 1 HETATM 6061 O O4 . NAG F 5 . ? 10.892 -41.989 -85.328 1.00 126.27 ? 401 NAG A O4 1 HETATM 6062 O O5 . NAG F 5 . ? 10.012 -44.252 -82.625 1.00 116.33 ? 401 NAG A O5 1 HETATM 6063 O O6 . NAG F 5 . ? 7.417 -43.321 -83.857 1.00 106.44 ? 401 NAG A O6 1 HETATM 6064 C C1 . NAG G 5 . ? 0.095 -39.754 -77.032 1.00 84.30 ? 314 NAG A C1 1 HETATM 6065 C C2 . NAG G 5 . ? 1.525 -39.390 -77.448 1.00 88.97 ? 314 NAG A C2 1 HETATM 6066 C C3 . NAG G 5 . ? 2.470 -39.199 -76.257 1.00 93.15 ? 314 NAG A C3 1 HETATM 6067 C C4 . NAG G 5 . ? 1.841 -38.361 -75.146 1.00 94.01 ? 314 NAG A C4 1 HETATM 6068 C C5 . NAG G 5 . ? 0.474 -38.937 -74.776 1.00 88.64 ? 314 NAG A C5 1 HETATM 6069 C C6 . NAG G 5 . ? -0.232 -38.071 -73.738 1.00 89.84 ? 314 NAG A C6 1 HETATM 6070 C C7 . NAG G 5 . ? 2.632 -40.215 -79.510 1.00 89.75 ? 314 NAG A C7 1 HETATM 6071 C C8 . NAG G 5 . ? 2.745 -38.808 -80.032 1.00 93.30 ? 314 NAG A C8 1 HETATM 6072 N N2 . NAG G 5 . ? 2.061 -40.424 -78.319 1.00 87.83 ? 314 NAG A N2 1 HETATM 6073 O O3 . NAG G 5 . ? 3.652 -38.573 -76.702 1.00 98.56 ? 314 NAG A O3 1 HETATM 6074 O O4 . NAG G 5 . ? 2.699 -38.309 -74.021 1.00 97.79 ? 314 NAG A O4 1 HETATM 6075 O O5 . NAG G 5 . ? -0.352 -38.990 -75.923 1.00 85.41 ? 314 NAG A O5 1 HETATM 6076 O O6 . NAG G 5 . ? -0.999 -37.074 -74.380 1.00 89.53 ? 314 NAG A O6 1 HETATM 6077 O O7 . NAG G 5 . ? 3.065 -41.143 -80.189 1.00 89.12 ? 314 NAG A O7 1 HETATM 6078 C C1 . NAG H 5 . ? -27.567 -51.309 -64.855 1.00 105.05 ? 501 NAG A C1 1 HETATM 6079 C C2 . NAG H 5 . ? -27.668 -51.372 -63.331 1.00 109.49 ? 501 NAG A C2 1 HETATM 6080 C C3 . NAG H 5 . ? -27.228 -52.737 -62.795 1.00 110.70 ? 501 NAG A C3 1 HETATM 6081 C C4 . NAG H 5 . ? -27.722 -53.961 -63.584 1.00 111.96 ? 501 NAG A C4 1 HETATM 6082 C C5 . NAG H 5 . ? -27.845 -53.651 -65.089 1.00 108.61 ? 501 NAG A C5 1 HETATM 6083 C C6 . NAG H 5 . ? -28.704 -54.667 -65.839 1.00 111.60 ? 501 NAG A C6 1 HETATM 6084 C C7 . NAG H 5 . ? -27.345 -49.178 -62.284 1.00 109.81 ? 501 NAG A C7 1 HETATM 6085 C C8 . NAG H 5 . ? -26.372 -48.240 -61.631 1.00 108.15 ? 501 NAG A C8 1 HETATM 6086 N N2 . NAG H 5 . ? -26.858 -50.351 -62.688 1.00 107.65 ? 501 NAG A N2 1 HETATM 6087 O O3 . NAG H 5 . ? -27.641 -52.830 -61.450 1.00 116.04 ? 501 NAG A O3 1 HETATM 6088 O O4 . NAG H 5 . ? -26.744 -54.974 -63.397 1.00 110.40 ? 501 NAG A O4 1 HETATM 6089 O O5 . NAG H 5 . ? -28.374 -52.356 -65.355 1.00 108.22 ? 501 NAG A O5 1 HETATM 6090 O O6 . NAG H 5 . ? -28.613 -54.412 -67.228 1.00 108.29 ? 501 NAG A O6 1 HETATM 6091 O O7 . NAG H 5 . ? -28.521 -48.847 -62.431 1.00 113.36 ? 501 NAG A O7 1 HETATM 6092 C C1 . NAG I 5 . ? -27.040 -56.172 -62.609 1.00 115.44 ? 502 NAG A C1 1 HETATM 6093 C C2 . NAG I 5 . ? -28.002 -56.067 -61.406 1.00 121.98 ? 502 NAG A C2 1 HETATM 6094 C C3 . NAG I 5 . ? -28.118 -57.415 -60.683 1.00 126.80 ? 502 NAG A C3 1 HETATM 6095 C C4 . NAG I 5 . ? -28.286 -58.602 -61.636 1.00 127.39 ? 502 NAG A C4 1 HETATM 6096 C C5 . NAG I 5 . ? -27.277 -58.516 -62.785 1.00 120.61 ? 502 NAG A C5 1 HETATM 6097 C C6 . NAG I 5 . ? -27.449 -59.647 -63.796 1.00 121.53 ? 502 NAG A C6 1 HETATM 6098 N N2 . NAG I 5 . ? -27.540 -55.093 -60.432 1.00 121.22 ? 502 NAG A N2 1 HETATM 6099 O O3 . NAG I 5 . ? -29.190 -57.391 -59.766 1.00 133.60 ? 502 NAG A O3 1 HETATM 6100 O O4 . NAG I 5 . ? -28.118 -59.803 -60.908 1.00 131.30 ? 502 NAG A O4 1 HETATM 6101 O O5 . NAG I 5 . ? -27.410 -57.264 -63.439 1.00 117.03 ? 502 NAG A O5 1 HETATM 6102 C C1 . DB6 J 6 . ? -9.835 -43.460 -62.979 1.00 84.38 ? 650 DB6 A C1 1 HETATM 6103 C C2 . DB6 J 6 . ? -10.122 -44.546 -64.024 1.00 80.09 ? 650 DB6 A C2 1 HETATM 6104 N N2 . DB6 J 6 . ? -11.582 -44.656 -64.076 1.00 79.80 ? 650 DB6 A N2 1 HETATM 6105 C C3 . DB6 J 6 . ? -9.506 -45.899 -63.641 1.00 79.20 ? 650 DB6 A C3 1 HETATM 6106 O O3 . DB6 J 6 . ? -8.079 -45.788 -63.739 1.00 79.87 ? 650 DB6 A O3 1 HETATM 6107 C C4 . DB6 J 6 . ? -9.962 -47.082 -64.497 1.00 75.78 ? 650 DB6 A C4 1 HETATM 6108 O O4 . DB6 J 6 . ? -9.418 -48.280 -63.925 1.00 77.01 ? 650 DB6 A O4 1 HETATM 6109 C C5 . DB6 J 6 . ? -9.533 -46.964 -65.961 1.00 71.98 ? 650 DB6 A C5 1 HETATM 6110 C C6 . DB6 J 6 . ? -9.603 -48.299 -66.693 1.00 68.73 ? 650 DB6 A C6 1 HETATM 6111 C C7 . DB6 J 6 . ? -10.885 -48.419 -67.503 1.00 66.19 ? 650 DB6 A C7 1 HETATM 6112 C C8 . DB6 J 6 . ? -11.114 -49.867 -67.901 1.00 64.64 ? 650 DB6 A C8 1 HETATM 6113 C C9 . DB6 J 6 . ? -10.977 -50.059 -69.405 0.70 61.73 ? 650 DB6 A C9 1 HETATM 6114 C C10 . DB6 J 6 . ? -11.155 -51.527 -69.770 0.70 60.95 ? 650 DB6 A C10 1 HETATM 6115 C C11 . DB6 J 6 . ? -9.851 -52.125 -70.279 0.70 60.20 ? 650 DB6 A C11 1 HETATM 6116 C C12 . DB6 J 6 . ? -10.003 -53.624 -70.492 0.70 60.58 ? 650 DB6 A C12 1 HETATM 6117 C C13 . DB6 J 6 . ? -8.872 -54.380 -69.812 0.70 62.25 ? 650 DB6 A C13 1 HETATM 6118 C C14 . DB6 J 6 . ? -8.921 -55.860 -70.172 0.70 63.22 ? 650 DB6 A C14 1 HETATM 6119 C C15 . DB6 J 6 . ? -7.805 -56.232 -71.145 0.70 63.03 ? 650 DB6 A C15 1 HETATM 6120 C C16 . DB6 J 6 . ? -6.639 -56.891 -70.413 0.70 65.27 ? 650 DB6 A C16 1 HETATM 6121 C C17 . DB6 J 6 . ? -5.304 -56.528 -71.051 0.70 65.12 ? 650 DB6 A C17 1 HETATM 6122 C C18 . DB6 J 6 . ? -4.545 -55.542 -70.194 0.70 65.69 ? 650 DB6 A C18 1 HETATM 6123 C C1A . DB6 J 6 . ? -10.452 -43.598 -60.558 1.00 90.61 ? 650 DB6 A C1A 1 HETATM 6124 O O1A . DB6 J 6 . ? -9.593 -43.984 -61.668 1.00 87.14 ? 650 DB6 A O1A 1 HETATM 6125 C C2A . DB6 J 6 . ? -10.801 -44.543 -59.454 1.00 92.56 ? 650 DB6 A C2A 1 HETATM 6126 O O2A . DB6 J 6 . ? -10.196 -45.822 -59.668 1.00 90.76 ? 650 DB6 A O2A 1 HETATM 6127 C C3A . DB6 J 6 . ? -12.320 -44.693 -59.419 1.00 92.60 ? 650 DB6 A C3A 1 HETATM 6128 O O3A . DB6 J 6 . ? -12.699 -45.053 -58.086 1.00 96.38 ? 650 DB6 A O3A 1 HETATM 6129 C C4A . DB6 J 6 . ? -13.136 -43.452 -59.817 1.00 93.69 ? 650 DB6 A C4A 1 HETATM 6130 O O4A . DB6 J 6 . ? -14.289 -43.908 -60.537 1.00 91.69 ? 650 DB6 A O4A 1 HETATM 6131 O O5A . DB6 J 6 . ? -14.073 -40.747 -61.412 1.00 94.35 ? 650 DB6 A O5A 1 HETATM 6132 C C5M . DB6 J 6 . ? -12.456 -42.367 -60.676 1.00 92.75 ? 650 DB6 A C5M 1 HETATM 6133 C C6A . DB6 J 6 . ? -13.080 -41.000 -60.410 1.00 96.09 ? 650 DB6 A C6A 1 HETATM 6134 O O6A . DB6 J 6 . ? -11.042 -42.279 -60.486 1.00 92.93 ? 650 DB6 A O6A 1 HETATM 6135 C CAA . DB6 J 6 . ? -12.305 -43.996 -64.988 1.00 78.93 ? 650 DB6 A CAA 1 HETATM 6136 O OAA . DB6 J 6 . ? -11.810 -43.260 -65.833 1.00 77.75 ? 650 DB6 A OAA 1 HETATM 6137 C CAB . DB6 J 6 . ? -13.805 -44.196 -64.923 1.00 79.76 ? 650 DB6 A CAB 1 HETATM 6138 C CAC . DB6 J 6 . ? -14.470 -43.985 -66.284 1.00 78.20 ? 650 DB6 A CAC 1 HETATM 6139 C CAD . DB6 J 6 . ? -14.330 -45.216 -67.184 1.00 75.77 ? 650 DB6 A CAD 1 HETATM 6140 C CAE . DB6 J 6 . ? -15.215 -45.104 -68.423 1.00 74.39 ? 650 DB6 A CAE 1 HETATM 6141 C CAF . DB6 J 6 . ? -14.675 -45.917 -69.598 1.00 71.98 ? 650 DB6 A CAF 1 HETATM 6142 C CAG . DB6 J 6 . ? -14.644 -45.066 -70.869 1.00 70.89 ? 650 DB6 A CAG 1 HETATM 6143 C CAH . DB6 J 6 . ? -14.698 -45.904 -72.145 0.70 68.47 ? 650 DB6 A CAH 1 HETATM 6144 C CAI . DB6 J 6 . ? -15.178 -45.060 -73.325 0.70 67.67 ? 650 DB6 A CAI 1 HETATM 6145 C CAJ . DB6 J 6 . ? -14.378 -45.345 -74.594 0.70 65.90 ? 650 DB6 A CAJ 1 HETATM 6146 C CAK . DB6 J 6 . ? -14.654 -44.272 -75.624 0.70 65.76 ? 650 DB6 A CAK 1 HETATM 6147 C CAL . DB6 J 6 . ? -13.858 -43.207 -75.720 0.70 66.44 ? 650 DB6 A CAL 1 HETATM 6148 C CAM . DB6 J 6 . ? -14.144 -42.134 -76.745 0.70 66.65 ? 650 DB6 A CAM 1 HETATM 6149 C CAN . DB6 J 6 . ? -14.848 -40.972 -76.080 0.70 68.63 ? 650 DB6 A CAN 1 HETATM 6150 C CAO . DB6 J 6 . ? -16.045 -40.574 -76.508 0.70 69.26 ? 650 DB6 A CAO 1 HETATM 6151 C CAP . DB6 J 6 . ? -16.747 -39.412 -75.837 0.70 72.61 ? 650 DB6 A CAP 1 HETATM 6152 C CAQ . DB6 J 6 . ? -18.156 -39.209 -76.397 0.70 73.39 ? 650 DB6 A CAQ 1 HETATM 6153 C CAR . DB6 J 6 . ? -19.167 -40.124 -75.710 0.70 73.85 ? 650 DB6 A CAR 1 HETATM 6154 C CAS . DB6 J 6 . ? -20.445 -39.387 -75.325 0.70 77.08 ? 650 DB6 A CAS 1 HETATM 6155 C CAT . DB6 J 6 . ? -21.230 -40.154 -74.279 0.70 78.16 ? 650 DB6 A CAT 1 HETATM 6156 O O . HOH K 7 . ? -28.038 -53.002 -71.511 1.00 75.39 ? 303 HOH A O 1 HETATM 6157 O O . HOH K 7 . ? -7.365 -55.190 -81.071 1.00 53.71 ? 304 HOH A O 1 HETATM 6158 O O . HOH K 7 . ? -22.723 -57.484 -127.775 1.00 55.63 ? 305 HOH A O 1 HETATM 6159 O O . HOH K 7 . ? -23.476 -39.073 -122.940 1.00 67.84 ? 306 HOH A O 1 HETATM 6160 O O . HOH K 7 . ? -21.411 -60.299 -112.523 1.00 37.30 ? 307 HOH A O 1 HETATM 6161 O O . HOH K 7 . ? -23.882 -63.428 -127.083 1.00 72.30 ? 308 HOH A O 1 HETATM 6162 O O . HOH K 7 . ? -13.003 -63.052 -123.125 1.00 55.52 ? 309 HOH A O 1 HETATM 6163 O O . HOH K 7 . ? -11.157 -65.031 -123.937 1.00 57.50 ? 310 HOH A O 1 HETATM 6164 O O . HOH K 7 . ? -28.373 -34.458 -75.851 1.00 88.91 ? 311 HOH A O 1 HETATM 6165 O O . HOH K 7 . ? -36.861 -36.582 -108.762 1.00 78.92 ? 312 HOH A O 1 HETATM 6166 O O . HOH L 7 . ? -3.793 -32.682 -98.127 1.00 75.31 ? 100 HOH B O 1 HETATM 6167 O O . HOH L 7 . ? -12.504 -38.213 -124.026 1.00 56.13 ? 101 HOH B O 1 HETATM 6168 O O . HOH L 7 . ? -5.037 -42.699 -115.008 1.00 53.10 ? 102 HOH B O 1 HETATM 6169 O O . HOH M 7 . ? 22.538 -19.509 -15.503 1.00 54.88 ? 211 HOH C O 1 HETATM 6170 O O . HOH M 7 . ? 22.410 -22.184 -0.951 1.00 63.39 ? 212 HOH C O 1 HETATM 6171 O O . HOH M 7 . ? 4.684 -30.551 -47.187 1.00 69.89 ? 213 HOH C O 1 HETATM 6172 O O . HOH M 7 . ? 29.787 -20.671 -15.299 1.00 62.84 ? 214 HOH C O 1 HETATM 6173 O O . HOH N 7 . ? 21.594 -42.242 -32.728 1.00 73.33 ? 248 HOH D O 1 HETATM 6174 O O . HOH N 7 . ? 29.124 -43.400 -14.196 1.00 47.81 ? 249 HOH D O 1 HETATM 6175 O O . HOH N 7 . ? 18.014 -56.343 -4.803 1.00 71.34 ? 250 HOH D O 1 HETATM 6176 O O . HOH N 7 . ? 7.530 -37.767 -44.394 1.00 56.57 ? 251 HOH D O 1 HETATM 6177 O O . HOH N 7 . ? 25.744 -39.063 -38.574 1.00 59.94 ? 252 HOH D O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . ASN A 7 ? 0.7876 1.7435 1.4829 0.1594 -0.1231 -0.1100 7 ASN A N 2 C CA . ASN A 7 ? 0.7783 1.6481 1.4313 0.1253 -0.0986 -0.1101 7 ASN A CA 3 C C . ASN A 7 ? 0.7828 1.5095 1.3420 0.1388 -0.1017 -0.1336 7 ASN A C 4 O O . ASN A 7 ? 0.7943 1.4743 1.3298 0.1367 -0.1392 -0.1489 7 ASN A O 5 C CB . ASN A 7 ? 0.7768 1.6732 1.4822 0.0487 -0.1209 -0.0963 7 ASN A CB 6 C CG . ASN A 7 ? 0.7949 1.6712 1.5123 0.0140 -0.1822 -0.1089 7 ASN A CG 7 O OD1 . ASN A 7 ? 0.8050 1.6595 1.4955 0.0490 -0.2082 -0.1272 7 ASN A OD1 8 N ND2 . ASN A 7 ? 0.8073 1.6841 1.5585 -0.0543 -0.2065 -0.0988 7 ASN A ND2 9 N N . TYR A 8 ? 0.7789 1.4411 1.2846 0.1532 -0.0626 -0.1356 8 TYR A N 10 C CA . TYR A 8 ? 0.7833 1.3242 1.2065 0.1673 -0.0601 -0.1537 8 TYR A CA 11 C C . TYR A 8 ? 0.7723 1.2476 1.1611 0.1358 -0.0409 -0.1534 8 TYR A C 12 O O . TYR A 8 ? 0.7723 1.2668 1.1625 0.1374 -0.0073 -0.1439 8 TYR A O 13 C CB . TYR A 8 ? 0.8044 1.3173 1.1812 0.2294 -0.0370 -0.1597 8 TYR A CB 14 C CG . TYR A 8 ? 0.8235 1.3816 1.2174 0.2673 -0.0599 -0.1616 8 TYR A CG 15 C CD1 . TYR A 8 ? 0.8399 1.3421 1.1968 0.2760 -0.0895 -0.1739 8 TYR A CD1 16 C CD2 . TYR A 8 ? 0.8327 1.4953 1.2782 0.2984 -0.0518 -0.1497 8 TYR A CD2 17 C CE1 . TYR A 8 ? 0.8610 1.4031 1.2274 0.3132 -0.1128 -0.1754 8 TYR A CE1 18 C CE2 . TYR A 8 ? 0.8510 1.5603 1.3120 0.3365 -0.0759 -0.1509 8 TYR A CE2 19 C CZ . TYR A 8 ? 0.8647 1.5095 1.2836 0.3428 -0.1074 -0.1643 8 TYR A CZ 20 O OH . TYR A 8 ? 0.8859 1.5732 1.3130 0.3826 -0.1331 -0.1655 8 TYR A OH 21 N N . THR A 9 ? 0.7673 1.1674 1.1217 0.1120 -0.0628 -0.1640 9 THR A N 22 C CA . THR A 9 ? 0.7597 1.1002 1.0820 0.0834 -0.0509 -0.1638 9 THR A CA 23 C C . THR A 9 ? 0.7619 1.0312 1.0203 0.1108 -0.0265 -0.1732 9 THR A C 24 O O . THR A 9 ? 0.7696 0.9888 0.9909 0.1293 -0.0368 -0.1837 9 THR A O 25 C CB . THR A 9 ? 0.7662 1.0602 1.0791 0.0489 -0.0864 -0.1698 9 THR A CB 26 O OG1 . THR A 9 ? 0.7787 1.1275 1.1456 0.0231 -0.1181 -0.1643 9 THR A OG1 27 C CG2 . THR A 9 ? 0.7664 1.0194 1.0597 0.0172 -0.0753 -0.1638 9 THR A CG2 28 N N . PHE A 10 ? 0.7622 1.0285 1.0066 0.1114 0.0049 -0.1682 10 PHE A N 29 C CA . PHE A 10 ? 0.7720 0.9712 0.9571 0.1303 0.0257 -0.1770 10 PHE A CA 30 C C . PHE A 10 ? 0.7622 0.9090 0.9195 0.0991 0.0214 -0.1793 10 PHE A C 31 O O . PHE A 10 ? 0.7586 0.9200 0.9269 0.0734 0.0273 -0.1712 10 PHE A O 32 C CB . PHE A 10 ? 0.7944 1.0144 0.9705 0.1532 0.0586 -0.1735 10 PHE A CB 33 C CG . PHE A 10 ? 0.8240 0.9671 0.9345 0.1671 0.0762 -0.1841 10 PHE A CG 34 C CD1 . PHE A 10 ? 0.8572 0.9548 0.9304 0.2011 0.0801 -0.1921 10 PHE A CD1 35 C CD2 . PHE A 10 ? 0.8359 0.9492 0.9192 0.1449 0.0869 -0.1852 10 PHE A CD2 36 C CE1 . PHE A 10 ? 0.8968 0.9164 0.9085 0.2069 0.0926 -0.2013 10 PHE A CE1 37 C CE2 . PHE A 10 ? 0.8712 0.9133 0.8941 0.1529 0.0976 -0.1965 10 PHE A CE2 38 C CZ . PHE A 10 ? 0.9035 0.8972 0.8917 0.1811 0.0998 -0.2046 10 PHE A CZ 39 N N . ARG A 11 ? 0.7616 0.8522 0.8831 0.1035 0.0122 -0.1878 11 ARG A N 40 C CA . ARG A 11 ? 0.7537 0.8048 0.8531 0.0795 0.0044 -0.1892 11 ARG A CA 41 C C . ARG A 11 ? 0.7662 0.7693 0.8218 0.0837 0.0192 -0.1940 11 ARG A C 42 O O . ARG A 11 ? 0.7798 0.7569 0.8140 0.1026 0.0232 -0.1974 11 ARG A O 43 C CB . ARG A 11 ? 0.7478 0.7851 0.8479 0.0774 -0.0235 -0.1927 11 ARG A CB 44 C CG . ARG A 11 ? 0.7488 0.8243 0.8871 0.0731 -0.0467 -0.1916 11 ARG A CG 45 C CD . ARG A 11 ? 0.7488 0.7953 0.8761 0.0630 -0.0776 -0.1969 11 ARG A CD 46 N NE . ARG A 11 ? 0.7518 0.7797 0.8759 0.0335 -0.0819 -0.1918 11 ARG A NE 47 N N . CYS A 12 ? 0.7682 0.7592 0.8095 0.0638 0.0259 -0.1927 12 CYS A N 48 C CA . CYS A 12 ? 0.7803 0.7303 0.7842 0.0582 0.0319 -0.1972 12 CYS A CA 49 C C . CYS A 12 ? 0.7622 0.7043 0.7640 0.0430 0.0154 -0.1947 12 CYS A C 50 O O . CYS A 12 ? 0.7582 0.7096 0.7669 0.0283 0.0080 -0.1904 12 CYS A O 51 C CB . CYS A 12 ? 0.8037 0.7467 0.7861 0.0511 0.0479 -0.1991 12 CYS A CB 52 S SG . CYS A 12 ? 0.8589 0.7637 0.8012 0.0736 0.0670 -0.2092 12 CYS A SG 53 N N . LEU A 13 ? 0.7589 0.6844 0.7491 0.0492 0.0109 -0.1952 13 LEU A N 54 C CA . LEU A 13 ? 0.7446 0.6712 0.7323 0.0444 -0.0026 -0.1916 13 LEU A CA 55 C C . LEU A 13 ? 0.7505 0.6681 0.7213 0.0322 0.0018 -0.1893 13 LEU A C 56 O O . LEU A 13 ? 0.7656 0.6688 0.7265 0.0325 0.0100 -0.1880 13 LEU A O 57 C CB . LEU A 13 ? 0.7402 0.6698 0.7317 0.0648 -0.0126 -0.1907 13 LEU A CB 58 C CG . LEU A 13 ? 0.7416 0.6821 0.7508 0.0753 -0.0238 -0.1944 13 LEU A CG 59 C CD1 . LEU A 13 ? 0.7509 0.6875 0.7511 0.0977 -0.0376 -0.1958 13 LEU A CD1 60 C CD2 . LEU A 13 ? 0.7481 0.6959 0.7715 0.0577 -0.0356 -0.1941 13 LEU A CD2 61 N N . GLN A 14 ? 0.7435 0.6692 0.7108 0.0198 -0.0053 -0.1874 14 GLN A N 62 C CA . GLN A 14 ? 0.7494 0.6793 0.7070 0.0054 -0.0063 -0.1844 14 GLN A CA 63 C C . GLN A 14 ? 0.7374 0.6930 0.7009 0.0124 -0.0186 -0.1770 14 GLN A C 64 O O . GLN A 14 ? 0.7324 0.6875 0.6935 0.0195 -0.0284 -0.1768 14 GLN A O 65 C CB . GLN A 14 ? 0.7697 0.6878 0.7098 -0.0119 -0.0037 -0.1901 14 GLN A CB 66 C CG . GLN A 14 ? 0.7873 0.7128 0.7175 -0.0308 -0.0111 -0.1888 14 GLN A CG 67 C CD . GLN A 14 ? 0.8180 0.7312 0.7229 -0.0430 -0.0132 -0.1956 14 GLN A CD 68 O OE1 . GLN A 14 ? 0.8527 0.7350 0.7325 -0.0504 -0.0066 -0.2055 14 GLN A OE1 69 N NE2 . GLN A 14 ? 0.8162 0.7476 0.7194 -0.0412 -0.0226 -0.1904 14 GLN A NE2 70 N N . MET A 15 ? 0.7371 0.7143 0.7066 0.0112 -0.0175 -0.1690 15 MET A N 71 C CA . MET A 15 ? 0.7303 0.7441 0.7061 0.0237 -0.0260 -0.1599 15 MET A CA 72 C C . MET A 15 ? 0.7348 0.7814 0.7193 0.0012 -0.0283 -0.1526 15 MET A C 73 O O . MET A 15 ? 0.7457 0.7945 0.7372 -0.0197 -0.0216 -0.1482 15 MET A O 74 C CB . MET A 15 ? 0.7279 0.7559 0.7075 0.0504 -0.0220 -0.1528 15 MET A CB 75 C CG . MET A 15 ? 0.7349 0.7659 0.7214 0.0417 -0.0076 -0.1443 15 MET A CG 76 S SD . MET A 15 ? 0.7335 0.7412 0.7086 0.0721 -0.0022 -0.1461 15 MET A SD 77 C CE . MET A 15 ? 0.7342 0.6960 0.7045 0.0604 -0.0015 -0.1612 15 MET A CE 78 N N . SER A 16 ? 0.7335 0.8023 0.7154 0.0041 -0.0403 -0.1508 16 SER A N 79 C CA . SER A 16 ? 0.7395 0.8482 0.7317 -0.0169 -0.0484 -0.1447 16 SER A CA 80 C C . SER A 16 ? 0.7326 0.9008 0.7385 0.0080 -0.0560 -0.1316 16 SER A C 81 O O . SER A 16 ? 0.7367 0.8949 0.7253 0.0359 -0.0637 -0.1333 16 SER A O 82 C CB . SER A 16 ? 0.7583 0.8405 0.7277 -0.0345 -0.0573 -0.1555 16 SER A CB 83 O OG . SER A 16 ? 0.7666 0.7961 0.7182 -0.0482 -0.0477 -0.1678 16 SER A OG 84 N N . SER A 17 ? 0.7282 0.9579 0.7640 -0.0010 -0.0535 -0.1166 17 SER A N 85 C CA . SER A 17 ? 0.7240 1.0273 0.7778 0.0270 -0.0576 -0.1011 17 SER A CA 86 C C . SER A 17 ? 0.7313 1.0984 0.8092 0.0019 -0.0726 -0.0929 17 SER A C 87 O O . SER A 17 ? 0.7374 1.1261 0.8392 -0.0411 -0.0737 -0.0876 17 SER A O 88 C CB . SER A 17 ? 0.7169 1.0622 0.7916 0.0442 -0.0403 -0.0846 17 SER A CB 89 N N . PHE A 18 ? 0.7391 1.1307 0.8068 0.0284 -0.0868 -0.0920 18 PHE A N 90 C CA . PHE A 18 ? 0.7480 1.2142 0.8395 0.0143 -0.1048 -0.0828 18 PHE A CA 91 C C . PHE A 18 ? 0.7446 1.3040 0.8635 0.0569 -0.1021 -0.0620 18 PHE A C 92 O O . PHE A 18 ? 0.7539 1.2958 0.8435 0.1098 -0.1016 -0.0633 18 PHE A O 93 C CB . PHE A 18 ? 0.7687 1.1959 0.8221 0.0183 -0.1238 -0.0953 18 PHE A CB 94 C CG . PHE A 18 ? 0.7757 1.1108 0.7936 -0.0100 -0.1217 -0.1148 18 PHE A CG 95 C CD1 . PHE A 18 ? 0.7780 1.0372 0.7605 0.0108 -0.1122 -0.1241 18 PHE A CD1 96 C CD2 . PHE A 18 ? 0.7878 1.1131 0.8059 -0.0566 -0.1302 -0.1235 18 PHE A CD2 97 C CE1 . PHE A 18 ? 0.7836 0.9733 0.7388 -0.0116 -0.1069 -0.1387 18 PHE A CE1 98 C CE2 . PHE A 18 ? 0.8052 1.0483 0.7850 -0.0739 -0.1255 -0.1414 18 PHE A CE2 99 C CZ . PHE A 18 ? 0.7965 0.9792 0.7483 -0.0498 -0.1118 -0.1475 18 PHE A CZ 100 N N . ALA A 19 ? 0.7395 1.3964 0.9125 0.0345 -0.1002 -0.0419 19 ALA A N 101 C CA . ALA A 19 ? 0.7394 1.5057 0.9461 0.0769 -0.0933 -0.0178 19 ALA A CA 102 C C . ALA A 19 ? 0.7544 1.5928 0.9712 0.0965 -0.1166 -0.0117 19 ALA A C 103 O O . ALA A 19 ? 0.7677 1.6301 0.9661 0.1602 -0.1163 -0.0064 19 ALA A O 104 C CB . ALA A 19 ? 0.7284 1.5809 0.9951 0.0437 -0.0778 0.0074 19 ALA A CB 105 N N . ASN A 20 ? 0.7622 1.6303 1.0026 0.0440 -0.1389 -0.0131 20 ASN A N 106 C CA . ASN A 20 ? 0.7823 1.7207 1.0321 0.0563 -0.1662 -0.0083 20 ASN A CA 107 C C . ASN A 20 ? 0.8014 1.6901 1.0309 0.0031 -0.1932 -0.0272 20 ASN A C 108 O O . ASN A 20 ? 0.8057 1.5807 0.9920 -0.0213 -0.1885 -0.0485 20 ASN A O 109 C CB . ASN A 20 ? 0.7779 1.8812 1.1048 0.0570 -0.1680 0.0228 20 ASN A CB 110 C CG . ASN A 20 ? 0.7747 1.9235 1.1604 -0.0103 -0.1582 0.0377 20 ASN A CG 111 O OD1 . ASN A 20 ? 0.7863 1.8536 1.1574 -0.0704 -0.1647 0.0217 20 ASN A OD1 112 N ND2 . ASN A 20 ? 0.7753 2.0540 1.2244 0.0017 -0.1416 0.0704 20 ASN A ND2 113 N N . ARG A 21 ? 0.8182 1.7966 1.0770 -0.0109 -0.2221 -0.0193 21 ARG A N 114 C CA . ARG A 21 ? 0.8477 1.7896 1.0837 -0.0590 -0.2528 -0.0374 21 ARG A CA 115 C C . ARG A 21 ? 0.8552 1.7525 1.1032 -0.1335 -0.2530 -0.0471 21 ARG A C 116 O O . ARG A 21 ? 0.8800 1.6695 1.0739 -0.1586 -0.2593 -0.0721 21 ARG A O 117 C CB . ARG A 21 ? 0.8674 1.9323 1.1400 -0.0583 -0.2872 -0.0245 21 ARG A CB 118 N N . SER A 22 ? 0.8409 1.8179 1.1556 -0.1655 -0.2444 -0.0255 22 SER A N 119 C CA . SER A 22 ? 0.8620 1.7979 1.1891 -0.2390 -0.2473 -0.0301 22 SER A CA 120 C C . SER A 22 ? 0.8479 1.6806 1.1470 -0.2372 -0.2123 -0.0364 22 SER A C 121 O O . SER A 22 ? 0.8761 1.5963 1.1287 -0.2683 -0.2146 -0.0593 22 SER A O 122 C CB . SER A 22 ? 0.8664 1.9383 1.2806 -0.2845 -0.2574 0.0006 22 SER A CB 123 N N . TRP A 23 ? 0.8110 1.6834 1.1339 -0.1958 -0.1810 -0.0166 23 TRP A N 124 C CA . TRP A 23 ? 0.7988 1.5988 1.1069 -0.1946 -0.1489 -0.0162 23 TRP A CA 125 C C . TRP A 23 ? 0.7888 1.4652 1.0279 -0.1566 -0.1364 -0.0428 23 TRP A C 126 O O . TRP A 23 ? 0.7748 1.4477 0.9894 -0.1036 -0.1358 -0.0483 23 TRP A O 127 C CB . TRP A 23 ? 0.7724 1.6682 1.1272 -0.1604 -0.1216 0.0155 23 TRP A CB 128 C CG . TRP A 23 ? 0.7739 1.6346 1.1342 -0.1789 -0.0934 0.0275 23 TRP A CG 129 C CD1 . TRP A 23 ? 0.7967 1.7010 1.2031 -0.2362 -0.0891 0.0521 23 TRP A CD1 130 C CD2 . TRP A 23 ? 0.7605 1.5366 1.0775 -0.1400 -0.0671 0.0181 23 TRP A CD2 131 N NE1 . TRP A 23 ? 0.7984 1.6454 1.1878 -0.2318 -0.0596 0.0593 23 TRP A NE1 132 C CE2 . TRP A 23 ? 0.7760 1.5472 1.1114 -0.1718 -0.0468 0.0375 23 TRP A CE2 133 C CE3 . TRP A 23 ? 0.7447 1.4472 1.0088 -0.0845 -0.0610 -0.0037 23 TRP A CE3 134 C CZ2 . TRP A 23 ? 0.7723 1.4717 1.0728 -0.1442 -0.0212 0.0343 23 TRP A CZ2 135 C CZ3 . TRP A 23 ? 0.7394 1.3745 0.9744 -0.0621 -0.0381 -0.0079 23 TRP A CZ3 136 C CH2 . TRP A 23 ? 0.7539 1.3897 1.0062 -0.0892 -0.0187 0.0103 23 TRP A CH2 137 N N . SER A 24 ? 0.8026 1.3789 1.0110 -0.1845 -0.1272 -0.0574 24 SER A N 138 C CA . SER A 24 ? 0.7942 1.2631 0.9465 -0.1553 -0.1142 -0.0799 24 SER A CA 139 C C . SER A 24 ? 0.8087 1.1976 0.9441 -0.1803 -0.0981 -0.0858 24 SER A C 140 O O . SER A 24 ? 0.8461 1.2180 0.9867 -0.2308 -0.1070 -0.0854 24 SER A O 141 C CB . SER A 24 ? 0.8135 1.2296 0.9207 -0.1568 -0.1341 -0.1034 24 SER A CB 142 N N . ARG A 25 ? 0.7881 1.1246 0.9005 -0.1449 -0.0771 -0.0915 25 ARG A N 143 C CA . ARG A 25 ? 0.8057 1.0619 0.8954 -0.1591 -0.0624 -0.0987 25 ARG A CA 144 C C . ARG A 25 ? 0.7924 0.9756 0.8438 -0.1242 -0.0511 -0.1171 25 ARG A C 145 O O . ARG A 25 ? 0.7651 0.9617 0.8128 -0.0854 -0.0493 -0.1186 25 ARG A O 146 C CB . ARG A 25 ? 0.8077 1.0977 0.9281 -0.1675 -0.0448 -0.0735 25 ARG A CB 147 C CG . ARG A 25 ? 0.7713 1.1108 0.9061 -0.1174 -0.0267 -0.0584 25 ARG A CG 148 C CD . ARG A 25 ? 0.7773 1.1303 0.9284 -0.1261 -0.0055 -0.0344 25 ARG A CD 149 N NE . ARG A 25 ? 0.7982 1.0531 0.9129 -0.1339 0.0031 -0.0461 25 ARG A NE 150 C CZ . ARG A 25 ? 0.8382 1.0633 0.9525 -0.1679 0.0119 -0.0317 25 ARG A CZ 151 N NH1 . ARG A 25 ? 0.8586 1.1471 1.0121 -0.2055 0.0134 -0.0032 25 ARG A NH1 152 N NH2 . ARG A 25 ? 0.8651 0.9973 0.9396 -0.1646 0.0189 -0.0441 25 ARG A NH2 153 N N . THR A 26 ? 0.8186 0.9246 0.8410 -0.1386 -0.0449 -0.1301 26 THR A N 154 C CA . THR A 26 ? 0.8116 0.8574 0.8031 -0.1116 -0.0356 -0.1468 26 THR A CA 155 C C . THR A 26 ? 0.8293 0.8219 0.8074 -0.1097 -0.0199 -0.1474 26 THR A C 156 O O . THR A 26 ? 0.8761 0.8253 0.8377 -0.1378 -0.0206 -0.1498 26 THR A O 157 C CB . THR A 26 ? 0.8348 0.8400 0.7925 -0.1208 -0.0458 -0.1667 26 THR A CB 158 O OG1 . THR A 26 ? 0.8235 0.8726 0.7870 -0.1127 -0.0593 -0.1650 26 THR A OG1 159 C CG2 . THR A 26 ? 0.8323 0.7847 0.7644 -0.0975 -0.0326 -0.1799 26 THR A CG2 160 N N . ASP A 27 ? 0.8023 0.7928 0.7826 -0.0753 -0.0084 -0.1458 27 ASP A N 161 C CA . ASP A 27 ? 0.8176 0.7611 0.7829 -0.0649 0.0051 -0.1465 27 ASP A CA 162 C C . ASP A 27 ? 0.7971 0.7170 0.7509 -0.0350 0.0084 -0.1607 27 ASP A C 163 O O . ASP A 27 ? 0.7641 0.7099 0.7273 -0.0185 0.0021 -0.1634 27 ASP A O 164 C CB . ASP A 27 ? 0.8157 0.7885 0.7977 -0.0544 0.0155 -0.1254 27 ASP A CB 165 C CG . ASP A 27 ? 0.8357 0.8505 0.8404 -0.0877 0.0142 -0.1050 27 ASP A CG 166 O OD1 . ASP A 27 ? 0.8777 0.8625 0.8758 -0.1125 0.0209 -0.0935 27 ASP A OD1 167 O OD2 . ASP A 27 ? 0.8203 0.8993 0.8501 -0.0894 0.0058 -0.0988 27 ASP A OD2 168 N N . SER A 28 ? 0.8214 0.6922 0.7545 -0.0285 0.0172 -0.1681 28 SER A N 169 C CA . SER A 28 ? 0.8094 0.6682 0.7380 -0.0042 0.0206 -0.1796 28 SER A CA 170 C C . SER A 28 ? 0.8263 0.6595 0.7465 0.0191 0.0304 -0.1784 28 SER A C 171 O O . SER A 28 ? 0.8681 0.6622 0.7677 0.0138 0.0374 -0.1739 28 SER A O 172 C CB . SER A 28 ? 0.8308 0.6646 0.7384 -0.0138 0.0213 -0.1936 28 SER A CB 173 N N . VAL A 29 ? 0.8011 0.6538 0.7354 0.0439 0.0284 -0.1816 29 VAL A N 174 C CA . VAL A 29 ? 0.8171 0.6551 0.7458 0.0709 0.0341 -0.1818 29 VAL A CA 175 C C . VAL A 29 ? 0.8084 0.6604 0.7488 0.0857 0.0343 -0.1915 29 VAL A C 176 O O . VAL A 29 ? 0.7825 0.6619 0.7412 0.0762 0.0279 -0.1950 29 VAL A O 177 C CB . VAL A 29 ? 0.8043 0.6609 0.7399 0.0905 0.0290 -0.1724 29 VAL A CB 178 C CG1 . VAL A 29 ? 0.8260 0.6726 0.7495 0.0800 0.0362 -0.1569 29 VAL A CG1 179 C CG2 . VAL A 29 ? 0.7742 0.6675 0.7296 0.0944 0.0139 -0.1757 29 VAL A CG2 180 N N . VAL A 30 ? 0.8352 0.6711 0.7653 0.1097 0.0422 -0.1932 30 VAL A N 181 C CA . VAL A 30 ? 0.8323 0.6944 0.7786 0.1264 0.0456 -0.1992 30 VAL A CA 182 C C . VAL A 30 ? 0.8308 0.7155 0.7921 0.1571 0.0400 -0.1966 30 VAL A C 183 O O . VAL A 30 ? 0.8644 0.7172 0.8005 0.1795 0.0458 -0.1935 30 VAL A O 184 C CB . VAL A 30 ? 0.8784 0.7054 0.7932 0.1333 0.0623 -0.2061 30 VAL A CB 185 C CG1 . VAL A 30 ? 0.8757 0.7438 0.8101 0.1572 0.0705 -0.2085 30 VAL A CG1 186 C CG2 . VAL A 30 ? 0.8881 0.6966 0.7858 0.1033 0.0633 -0.2110 30 VAL A CG2 187 N N . TRP A 31 ? 0.8000 0.7365 0.7998 0.1566 0.0264 -0.1973 31 TRP A N 188 C CA . TRP A 31 ? 0.8016 0.7696 0.8210 0.1816 0.0134 -0.1964 31 TRP A CA 189 C C . TRP A 31 ? 0.7982 0.8214 0.8541 0.1919 0.0154 -0.1964 31 TRP A C 190 O O . TRP A 31 ? 0.7782 0.8376 0.8650 0.1685 0.0134 -0.1951 31 TRP A O 191 C CB . TRP A 31 ? 0.7803 0.7645 0.8148 0.1712 -0.0117 -0.1975 31 TRP A CB 192 C CG . TRP A 31 ? 0.7891 0.7382 0.7943 0.1663 -0.0137 -0.1952 31 TRP A CG 193 C CD1 . TRP A 31 ? 0.7793 0.7182 0.7799 0.1421 -0.0134 -0.1946 31 TRP A CD1 194 C CD2 . TRP A 31 ? 0.8136 0.7419 0.7912 0.1891 -0.0150 -0.1902 31 TRP A CD2 195 N NE1 . TRP A 31 ? 0.7851 0.7062 0.7621 0.1490 -0.0134 -0.1892 31 TRP A NE1 196 C CE2 . TRP A 31 ? 0.8074 0.7208 0.7691 0.1766 -0.0130 -0.1855 31 TRP A CE2 197 C CE3 . TRP A 31 ? 0.8425 0.7667 0.8056 0.2215 -0.0168 -0.1872 31 TRP A CE3 198 C CZ2 . TRP A 31 ? 0.8294 0.7288 0.7638 0.1938 -0.0096 -0.1761 31 TRP A CZ2 199 C CZ3 . TRP A 31 ? 0.8710 0.7714 0.8007 0.2383 -0.0147 -0.1784 31 TRP A CZ3 200 C CH2 . TRP A 31 ? 0.8631 0.7537 0.7800 0.2235 -0.0096 -0.1721 31 TRP A CH2 201 N N . LEU A 32 ? 0.8242 0.8579 0.8771 0.2280 0.0200 -0.1952 32 LEU A N 202 C CA . LEU A 32 ? 0.8196 0.9274 0.9183 0.2430 0.0170 -0.1923 32 LEU A CA 203 C C . LEU A 32 ? 0.8146 0.9561 0.9368 0.2535 -0.0123 -0.1924 32 LEU A C 204 O O . LEU A 32 ? 0.8380 0.9463 0.9275 0.2812 -0.0175 -0.1930 32 LEU A O 205 C CB . LEU A 32 ? 0.8586 0.9647 0.9383 0.2841 0.0406 -0.1912 32 LEU A CB 206 C CG . LEU A 32 ? 0.8564 1.0556 0.9878 0.3078 0.0415 -0.1851 32 LEU A CG 207 C CD1 . LEU A 32 ? 0.8303 1.0953 1.0123 0.2730 0.0459 -0.1789 32 LEU A CD1 208 C CD2 . LEU A 32 ? 0.9081 1.0943 1.0067 0.3609 0.0655 -0.1850 32 LEU A CD2 209 N N . GLY A 33 ? 0.7927 0.9964 0.9676 0.2297 -0.0331 -0.1911 33 GLY A N 210 C CA . GLY A 33 ? 0.7947 1.0198 0.9862 0.2298 -0.0694 -0.1952 33 GLY A CA 211 C C . GLY A 33 ? 0.8003 0.9543 0.9436 0.2235 -0.0795 -0.2020 33 GLY A C 212 O O . GLY A 33 ? 0.7865 0.9153 0.9251 0.1915 -0.0819 -0.2040 33 GLY A O 213 N N . ASP A 34 ? 0.8253 0.9494 0.9304 0.2578 -0.0831 -0.2032 34 ASP A N 214 C CA . ASP A 34 ? 0.8346 0.8970 0.8892 0.2606 -0.0833 -0.2048 34 ASP A CA 215 C C . ASP A 34 ? 0.8589 0.8752 0.8682 0.2888 -0.0568 -0.1959 34 ASP A C 216 O O . ASP A 34 ? 0.8814 0.8638 0.8507 0.3075 -0.0585 -0.1919 34 ASP A O 217 C CB . ASP A 34 ? 0.8523 0.9168 0.8958 0.2708 -0.1190 -0.2130 34 ASP A CB 218 C CG . ASP A 34 ? 0.8814 0.9889 0.9397 0.3009 -0.1397 -0.2147 34 ASP A CG 219 O OD1 . ASP A 34 ? 0.9011 1.0228 0.9615 0.3276 -0.1210 -0.2067 34 ASP A OD1 220 O OD2 . ASP A 34 ? 0.8991 1.0236 0.9633 0.2999 -0.1771 -0.2248 34 ASP A OD2 221 N N . LEU A 35 ? 0.8617 0.8729 0.8731 0.2921 -0.0321 -0.1920 35 LEU A N 222 C CA . LEU A 35 ? 0.8996 0.8523 0.8634 0.3130 -0.0085 -0.1839 35 LEU A CA 223 C C . LEU A 35 ? 0.8962 0.8069 0.8443 0.2834 0.0132 -0.1834 35 LEU A C 224 O O . LEU A 35 ? 0.8830 0.8108 0.8500 0.2711 0.0224 -0.1884 35 LEU A O 225 C CB . LEU A 35 ? 0.9329 0.8984 0.8945 0.3538 -0.0013 -0.1817 35 LEU A CB 226 C CG . LEU A 35 ? 0.9577 0.9367 0.9074 0.3962 -0.0177 -0.1776 35 LEU A CG 227 C CD1 . LEU A 35 ? 0.9852 1.0010 0.9487 0.4363 -0.0131 -0.1765 35 LEU A CD1 228 C CD2 . LEU A 35 ? 0.9992 0.9028 0.8857 0.4121 -0.0080 -0.1661 35 LEU A CD2 229 N N . GLN A 36 ? 0.9120 0.7727 0.8254 0.2720 0.0208 -0.1759 36 GLN A N 230 C CA . GLN A 36 ? 0.9185 0.7389 0.8154 0.2411 0.0368 -0.1746 36 GLN A CA 231 C C . GLN A 36 ? 0.9732 0.7442 0.8379 0.2550 0.0541 -0.1755 36 GLN A C 232 O O . GLN A 36 ? 1.0239 0.7547 0.8543 0.2843 0.0597 -0.1681 36 GLN A O 233 C CB . GLN A 36 ? 0.9265 0.7182 0.8008 0.2257 0.0400 -0.1621 36 GLN A CB 234 C CG . GLN A 36 ? 0.9334 0.6916 0.7961 0.1886 0.0515 -0.1595 36 GLN A CG 235 C CD . GLN A 36 ? 0.9253 0.6862 0.7847 0.1692 0.0530 -0.1449 36 GLN A CD 236 O OE1 . GLN A 36 ? 0.9067 0.7044 0.7777 0.1804 0.0442 -0.1419 36 GLN A OE1 237 N NE2 . GLN A 36 ? 0.9523 0.6758 0.7947 0.1403 0.0632 -0.1356 36 GLN A NE2 238 N N . THR A 37 ? 0.9727 0.7410 0.8412 0.2374 0.0619 -0.1849 37 THR A N 239 C CA . THR A 37 ? 1.0387 0.7534 0.8673 0.2542 0.0771 -0.1902 37 THR A CA 240 C C . THR A 37 ? 1.0741 0.7252 0.8675 0.2191 0.0832 -0.1936 37 THR A C 241 O O . THR A 37 ? 1.1520 0.7263 0.8928 0.2286 0.0917 -0.1962 37 THR A O 242 C CB . THR A 37 ? 1.0282 0.7939 0.8805 0.2768 0.0831 -0.1993 37 THR A CB 243 O OG1 . THR A 37 ? 0.9723 0.7926 0.8658 0.2443 0.0784 -0.2031 37 THR A OG1 244 C CG2 . THR A 37 ? 1.0186 0.8406 0.8994 0.3171 0.0765 -0.1948 37 THR A CG2 245 N N . HIS A 38 ? 1.0288 0.7079 0.8474 0.1795 0.0761 -0.1942 38 HIS A N 246 C CA . HIS A 38 ? 1.0591 0.6907 0.8508 0.1430 0.0767 -0.1976 38 HIS A CA 247 C C . HIS A 38 ? 1.0225 0.6767 0.8365 0.1058 0.0677 -0.1869 38 HIS A C 248 O O . HIS A 38 ? 0.9577 0.6739 0.8113 0.1038 0.0601 -0.1838 38 HIS A O 249 C CB . HIS A 38 ? 1.0583 0.7002 0.8473 0.1367 0.0797 -0.2127 38 HIS A CB 250 C CG . HIS A 38 ? 1.1030 0.7304 0.8679 0.1771 0.0926 -0.2221 38 HIS A CG 251 N ND1 . HIS A 38 ? 1.0671 0.7643 0.8708 0.2068 0.0969 -0.2206 38 HIS A ND1 252 C CD2 . HIS A 38 ? 1.1908 0.7443 0.8955 0.1947 0.1014 -0.2331 38 HIS A CD2 253 C CE1 . HIS A 38 ? 1.1227 0.8015 0.8965 0.2441 0.1111 -0.2279 38 HIS A CE1 254 N NE2 . HIS A 38 ? 1.2033 0.7891 0.9115 0.2409 0.1143 -0.2370 38 HIS A NE2 255 N N . ARG A 39 ? 1.0694 0.6711 0.8553 0.0770 0.0676 -0.1812 39 ARG A N 256 C CA . ARG A 39 ? 1.0470 0.6745 0.8541 0.0409 0.0614 -0.1675 39 ARG A CA 257 C C . ARG A 39 ? 1.0758 0.6797 0.8695 0.0008 0.0535 -0.1756 39 ARG A C 258 O O . ARG A 39 ? 1.1477 0.6778 0.8959 -0.0057 0.0536 -0.1852 39 ARG A O 259 C CB . ARG A 39 ? 1.0854 0.6822 0.8773 0.0393 0.0679 -0.1457 39 ARG A CB 260 C CG . ARG A 39 ? 1.0862 0.6968 0.8917 -0.0043 0.0656 -0.1269 39 ARG A CG 261 C CD . ARG A 39 ? 1.1421 0.7037 0.9218 -0.0105 0.0756 -0.1025 39 ARG A CD 262 N NE . ARG A 39 ? 1.1110 0.7155 0.9042 0.0203 0.0846 -0.0847 39 ARG A NE 263 C CZ . ARG A 39 ? 1.1249 0.7042 0.8941 0.0638 0.0903 -0.0841 39 ARG A CZ 264 N NH1 . ARG A 39 ? 1.1691 0.6852 0.9031 0.0849 0.0903 -0.0988 39 ARG A NH1 265 N NH2 . ARG A 39 ? 1.0998 0.7194 0.8768 0.0907 0.0954 -0.0690 39 ARG A NH2 266 N N . TRP A 40 ? 1.0287 0.6911 0.8564 -0.0225 0.0445 -0.1731 40 TRP A N 267 C CA . TRP A 40 ? 1.0570 0.7076 0.8755 -0.0621 0.0326 -0.1790 40 TRP A CA 268 C C . TRP A 40 ? 1.0212 0.7365 0.8800 -0.0907 0.0244 -0.1623 40 TRP A C 269 O O . TRP A 40 ? 0.9589 0.7401 0.8504 -0.0790 0.0215 -0.1605 40 TRP A O 270 C CB . TRP A 40 ? 1.0505 0.7040 0.8573 -0.0548 0.0285 -0.2001 40 TRP A CB 271 C CG . TRP A 40 ? 1.1240 0.7256 0.8909 -0.0847 0.0166 -0.2135 40 TRP A CG 272 C CD1 . TRP A 40 ? 1.2084 0.7354 0.9368 -0.1102 0.0102 -0.2143 40 TRP A CD1 273 C CD2 . TRP A 40 ? 1.1284 0.7405 0.8824 -0.0922 0.0072 -0.2289 40 TRP A CD2 274 N NE1 . TRP A 40 ? 1.2634 0.7530 0.9551 -0.1338 -0.0057 -0.2322 40 TRP A NE1 275 C CE2 . TRP A 40 ? 1.2153 0.7590 0.9210 -0.1209 -0.0068 -0.2413 40 TRP A CE2 276 C CE3 . TRP A 40 ? 1.0759 0.7429 0.8495 -0.0783 0.0082 -0.2322 40 TRP A CE3 277 C CZ2 . TRP A 40 ? 1.2481 0.7815 0.9229 -0.1321 -0.0204 -0.2588 40 TRP A CZ2 278 C CZ3 . TRP A 40 ? 1.1080 0.7660 0.8526 -0.0894 -0.0018 -0.2459 40 TRP A CZ3 279 C CH2 . TRP A 40 ? 1.1914 0.7854 0.8861 -0.1140 -0.0162 -0.2600 40 TRP A CH2 280 N N . SER A 41 ? 1.0689 0.7633 0.9234 -0.1280 0.0201 -0.1489 41 SER A N 281 C CA . SER A 41 ? 1.0438 0.8092 0.9414 -0.1557 0.0154 -0.1268 41 SER A CA 282 C C . SER A 41 ? 1.0535 0.8397 0.9590 -0.1951 -0.0054 -0.1343 41 SER A C 283 O O . SER A 41 ? 1.1151 0.8337 0.9812 -0.2170 -0.0173 -0.1514 41 SER A O 284 C CB . SER A 41 ? 1.0932 0.8351 0.9888 -0.1774 0.0247 -0.1007 41 SER A CB 285 O OG . SER A 41 ? 1.0928 0.9040 1.0308 -0.2149 0.0199 -0.0769 41 SER A OG 286 N N . ASN A 42 ? 1.0000 0.8780 0.9512 -0.1997 -0.0112 -0.1222 42 ASN A N 287 C CA . ASN A 42 ? 1.0088 0.9240 0.9752 -0.2373 -0.0336 -0.1242 42 ASN A CA 288 C C . ASN A 42 ? 1.0791 0.9629 1.0419 -0.2945 -0.0455 -0.1138 42 ASN A C 289 O O . ASN A 42 ? 1.1177 0.9909 1.0706 -0.3313 -0.0700 -0.1252 42 ASN A O 290 C CB . ASN A 42 ? 0.9493 0.9761 0.9682 -0.2260 -0.0354 -0.1071 42 ASN A CB 291 C CG . ASN A 42 ? 0.9545 1.0251 0.9857 -0.2516 -0.0608 -0.1135 42 ASN A CG 292 O OD1 . ASN A 42 ? 0.9446 1.0051 0.9546 -0.2326 -0.0696 -0.1329 42 ASN A OD1 293 N ND2 . ASN A 42 ? 0.9764 1.0998 1.0430 -0.2959 -0.0734 -0.0947 42 ASN A ND2 294 N N . ASP A 43 ? 1.1011 0.9676 1.0691 -0.3028 -0.0296 -0.0911 43 ASP A N 295 C CA . ASP A 43 ? 1.1836 1.0028 1.1427 -0.3598 -0.0387 -0.0772 43 ASP A CA 296 C C . ASP A 43 ? 1.2702 0.9503 1.1541 -0.3664 -0.0472 -0.1036 43 ASP A C 297 O O . ASP A 43 ? 1.3570 0.9767 1.2168 -0.4188 -0.0679 -0.1058 43 ASP A O 298 C CB . ASP A 43 ? 1.1876 1.0308 1.1712 -0.3620 -0.0150 -0.0398 43 ASP A CB 299 N N . SER A 44 ? 1.2531 0.8833 1.0988 -0.3124 -0.0325 -0.1236 44 SER A N 300 C CA . SER A 44 ? 1.3374 0.8387 1.1080 -0.3028 -0.0340 -0.1464 44 SER A CA 301 C C . SER A 44 ? 1.3608 0.8234 1.0886 -0.2970 -0.0513 -0.1821 44 SER A C 302 O O . SER A 44 ? 1.2887 0.8204 1.0405 -0.2763 -0.0524 -0.1917 44 SER A O 303 C CB . SER A 44 ? 1.3191 0.7913 1.0711 -0.2454 -0.0079 -0.1455 44 SER A CB 304 O OG . SER A 44 ? 1.4106 0.7604 1.0892 -0.2322 -0.0078 -0.1633 44 SER A OG 305 N N . ALA A 45 ? 1.4695 0.8137 1.1263 -0.3127 -0.0641 -0.2008 45 ALA A N 306 C CA . ALA A 45 ? 1.5167 0.8089 1.1170 -0.3081 -0.0818 -0.2355 45 ALA A CA 307 C C . ALA A 45 ? 1.5208 0.7643 1.0708 -0.2430 -0.0614 -0.2576 45 ALA A C 308 O O . ALA A 45 ? 1.5157 0.7660 1.0410 -0.2220 -0.0647 -0.2800 45 ALA A O 309 C CB . ALA A 45 ? 1.6498 0.8360 1.1923 -0.3609 -0.1117 -0.2468 45 ALA A CB 310 N N . THR A 46 ? 1.5327 0.7330 1.0679 -0.2102 -0.0398 -0.2489 46 THR A N 311 C CA . THR A 46 ? 1.5363 0.7034 1.0322 -0.1457 -0.0191 -0.2655 46 THR A CA 312 C C . THR A 46 ? 1.4345 0.6824 0.9881 -0.1063 0.0055 -0.2466 46 THR A C 313 O O . THR A 46 ? 1.4006 0.6807 0.9948 -0.1209 0.0097 -0.2213 46 THR A O 314 C CB . THR A 46 ? 1.6724 0.6958 1.0787 -0.1298 -0.0191 -0.2784 46 THR A CB 315 O OG1 . THR A 46 ? 1.7082 0.6891 1.1189 -0.1582 -0.0201 -0.2536 46 THR A OG1 316 C CG2 . THR A 46 ? 1.7836 0.7133 1.1134 -0.1536 -0.0446 -0.3071 46 THR A CG2 317 N N . ILE A 47 ? 1.3920 0.6739 0.9474 -0.0573 0.0209 -0.2581 47 ILE A N 318 C CA . ILE A 47 ? 1.3067 0.6609 0.9125 -0.0197 0.0394 -0.2440 47 ILE A CA 319 C C . ILE A 47 ? 1.3575 0.6530 0.9368 0.0084 0.0507 -0.2348 47 ILE A C 320 O O . ILE A 47 ? 1.4440 0.6570 0.9606 0.0380 0.0561 -0.2483 47 ILE A O 321 C CB . ILE A 47 ? 1.2568 0.6663 0.8754 0.0190 0.0514 -0.2558 47 ILE A CB 322 C CG1 . ILE A 47 ? 1.2076 0.6739 0.8502 -0.0069 0.0409 -0.2604 47 ILE A CG1 323 C CG2 . ILE A 47 ? 1.1751 0.6550 0.8460 0.0510 0.0641 -0.2422 47 ILE A CG2 324 N N . SER A 48 ? 1.3107 0.6474 0.9320 0.0035 0.0545 -0.2113 48 SER A N 325 C CA . SER A 48 ? 1.3585 0.6439 0.9552 0.0279 0.0642 -0.1974 48 SER A CA 326 C C . SER A 48 ? 1.3192 0.6446 0.9293 0.0877 0.0774 -0.1999 48 SER A C 327 O O . SER A 48 ? 1.2278 0.6474 0.8937 0.0977 0.0784 -0.1987 48 SER A O 328 C CB . SER A 48 ? 1.3341 0.6491 0.9651 -0.0020 0.0638 -0.1683 48 SER A CB 329 O OG . SER A 48 ? 1.3390 0.6638 0.9856 -0.0602 0.0505 -0.1627 48 SER A OG 330 N N . PHE A 49 ? 1.3965 0.6477 0.9536 0.1268 0.0854 -0.2031 49 PHE A N 331 C CA . PHE A 49 ? 1.3705 0.6602 0.9404 0.1846 0.0958 -0.2010 49 PHE A CA 332 C C . PHE A 49 ? 1.3480 0.6558 0.9377 0.1879 0.0965 -0.1764 49 PHE A C 333 O O . PHE A 49 ? 1.4000 0.6477 0.9633 0.1600 0.0953 -0.1601 49 PHE A O 334 C CB . PHE A 49 ? 1.4764 0.6791 0.9757 0.2325 0.1042 -0.2130 49 PHE A CB 335 N N . THR A 50 ? 1.2755 0.6673 0.9107 0.2195 0.0972 -0.1727 50 THR A N 336 C CA . THR A 50 ? 1.2565 0.6695 0.9043 0.2303 0.0964 -0.1517 50 THR A CA 337 C C . THR A 50 ? 1.2844 0.6964 0.9159 0.2913 0.0994 -0.1498 50 THR A C 338 O O . THR A 50 ? 1.2959 0.7069 0.9196 0.3095 0.0989 -0.1325 50 THR A O 339 C CB . THR A 50 ? 1.1547 0.6655 0.8655 0.2108 0.0880 -0.1473 50 THR A CB 340 O OG1 . THR A 50 ? 1.0940 0.6789 0.8440 0.2401 0.0817 -0.1589 50 THR A OG1 341 C CG2 . THR A 50 ? 1.1177 0.6464 0.8506 0.1600 0.0838 -0.1520 50 THR A CG2 342 N N . LYS A 51 ? 1.2973 0.7162 0.9234 0.3254 0.1030 -0.1663 51 LYS A N 343 C CA . LYS A 51 ? 1.3343 0.7550 0.9435 0.3884 0.1060 -0.1651 51 LYS A CA 344 C C . LYS A 51 ? 1.4399 0.7650 0.9787 0.4196 0.1171 -0.1746 51 LYS A C 345 O O . LYS A 51 ? 1.4610 0.7498 0.9800 0.3965 0.1208 -0.1893 51 LYS A O 346 C CB . LYS A 51 ? 1.2507 0.7923 0.9281 0.4098 0.0996 -0.1733 51 LYS A CB 347 N N . PRO A 52 ? 1.5170 0.7947 1.0099 0.4760 0.1212 -0.1671 52 PRO A N 348 C CA . PRO A 52 ? 1.6319 0.8101 1.0476 0.5161 0.1312 -0.1777 52 PRO A CA 349 C C . PRO A 52 ? 1.6111 0.8608 1.0494 0.5597 0.1397 -0.1959 52 PRO A C 350 O O . PRO A 52 ? 1.7040 0.9017 1.0856 0.6199 0.1494 -0.2023 52 PRO A O 351 C CB . PRO A 52 ? 1.7156 0.8313 1.0790 0.5674 0.1320 -0.1602 52 PRO A CB 352 C CG . PRO A 52 ? 1.6241 0.8562 1.0564 0.5772 0.1228 -0.1477 52 PRO A CG 353 C CD . PRO A 52 ? 1.5172 0.8172 1.0146 0.5078 0.1155 -0.1484 52 PRO A CD 354 N N . TRP A 53 ? 1.4973 0.8645 1.0151 0.5313 0.1374 -0.2019 53 TRP A N 355 C CA . TRP A 53 ? 1.4710 0.9206 1.0199 0.5625 0.1482 -0.2139 53 TRP A CA 356 C C . TRP A 53 ? 1.3839 0.9031 0.9883 0.5077 0.1471 -0.2212 53 TRP A C 357 O O . TRP A 53 ? 1.3478 0.9547 0.9925 0.5229 0.1566 -0.2258 53 TRP A O 358 C CB . TRP A 53 ? 1.4295 0.9920 1.0348 0.6129 0.1462 -0.2045 53 TRP A CB 359 C CG . TRP A 53 ? 1.3335 0.9726 1.0058 0.5831 0.1266 -0.1922 53 TRP A CG 360 C CD1 . TRP A 53 ? 1.3510 0.9563 1.0048 0.5920 0.1148 -0.1792 53 TRP A CD1 361 C CD2 . TRP A 53 ? 1.2179 0.9718 0.9769 0.5426 0.1156 -0.1921 53 TRP A CD2 362 N NE1 . TRP A 53 ? 1.2556 0.9480 0.9761 0.5628 0.0967 -0.1738 53 TRP A NE1 363 C CE2 . TRP A 53 ? 1.1762 0.9559 0.9613 0.5310 0.0954 -0.1821 53 TRP A CE2 364 C CE3 . TRP A 53 ? 1.1571 0.9879 0.9680 0.5158 0.1208 -0.1983 53 TRP A CE3 365 C CZ2 . TRP A 53 ? 1.0812 0.9520 0.9381 0.4943 0.0774 -0.1816 53 TRP A CZ2 366 C CZ3 . TRP A 53 ? 1.0601 0.9818 0.9464 0.4756 0.1040 -0.1943 53 TRP A CZ3 367 C CH2 . TRP A 53 ? 1.0248 0.9616 0.9314 0.4655 0.0811 -0.1876 53 TRP A CH2 368 N N . SER A 54 ? 1.3585 0.8398 0.9634 0.4456 0.1366 -0.2198 54 SER A N 369 C CA . SER A 54 ? 1.2752 0.8185 0.9310 0.3926 0.1320 -0.2240 54 SER A CA 370 C C . SER A 54 ? 1.3085 0.8338 0.9350 0.3907 0.1437 -0.2402 54 SER A C 371 O O . SER A 54 ? 1.2416 0.8332 0.9114 0.3604 0.1434 -0.2422 54 SER A O 372 C CB . SER A 54 ? 1.2493 0.7571 0.9077 0.3349 0.1186 -0.2171 54 SER A CB 373 N N . GLN A 55 ? 1.4218 0.8506 0.9671 0.4259 0.1532 -0.2516 55 GLN A N 374 C CA . GLN A 55 ? 1.4774 0.8784 0.9772 0.4376 0.1651 -0.2697 55 GLN A CA 375 C C . GLN A 55 ? 1.4417 0.9583 0.9867 0.4804 0.1842 -0.2675 55 GLN A C 376 O O . GLN A 55 ? 1.4466 0.9865 0.9832 0.4786 0.1956 -0.2763 55 GLN A O 377 C CB . GLN A 55 ? 1.6244 0.8776 1.0134 0.4702 0.1677 -0.2843 55 GLN A CB 378 C CG . GLN A 55 ? 1.7001 0.8931 1.0205 0.4730 0.1733 -0.3077 55 GLN A CG 379 C CD . GLN A 55 ? 1.8580 0.8891 1.0581 0.5077 0.1717 -0.3250 55 GLN A CD 380 N N . GLY A 56 ? 1.4105 1.0042 1.0045 0.5176 0.1870 -0.2540 56 GLY A N 381 C CA . GLY A 56 ? 1.3777 1.0982 1.0280 0.5560 0.2038 -0.2468 56 GLY A CA 382 C C . GLY A 56 ? 1.4852 1.1726 1.0678 0.6272 0.2280 -0.2573 56 GLY A C 383 O O . GLY A 56 ? 1.5947 1.1570 1.0868 0.6612 0.2281 -0.2689 56 GLY A O 384 N N . LYS A 57 ? 1.4637 1.2603 1.0861 0.6511 0.2494 -0.2520 57 LYS A N 385 C CA . LYS A 57 ? 1.5659 1.3457 1.1234 0.7254 0.2771 -0.2614 57 LYS A CA 386 C C . LYS A 57 ? 1.6286 1.3268 1.1086 0.7107 0.2862 -0.2809 57 LYS A C 387 O O . LYS A 57 ? 1.6746 1.4115 1.1298 0.7550 0.3133 -0.2841 57 LYS A O 388 C CB . LYS A 57 ? 1.5205 1.4725 1.1608 0.7669 0.2992 -0.2417 57 LYS A CB 389 C CG . LYS A 57 ? 1.5092 1.5246 1.1944 0.8124 0.2925 -0.2280 57 LYS A CG 390 N N . LEU A 58 ? 1.6348 1.2251 1.0763 0.6504 0.2631 -0.2931 58 LEU A N 391 C CA . LEU A 58 ? 1.6999 1.2017 1.0634 0.6298 0.2629 -0.3139 58 LEU A CA 392 C C . LEU A 58 ? 1.8476 1.1685 1.0857 0.6528 0.2523 -0.3383 58 LEU A C 393 O O . LEU A 58 ? 1.8681 1.1104 1.0916 0.6373 0.2332 -0.3364 58 LEU A O 394 C CB . LEU A 58 ? 1.6090 1.1236 1.0182 0.5422 0.2415 -0.3103 58 LEU A CB 395 C CG . LEU A 58 ? 1.4761 1.1370 0.9926 0.5033 0.2454 -0.2890 58 LEU A CG 396 C CD1 . LEU A 58 ? 1.4379 1.0686 0.9513 0.4349 0.2274 -0.2942 58 LEU A CD1 397 C CD2 . LEU A 58 ? 1.4745 1.2434 1.0148 0.5468 0.2777 -0.2790 58 LEU A CD2 398 N N . SER A 59 ? 1.9593 1.2103 1.1027 0.6887 0.2641 -0.3605 59 SER A N 399 C CA . SER A 59 ? 2.1210 1.1836 1.1311 0.7067 0.2501 -0.3880 59 SER A CA 400 C C . SER A 59 ? 2.1239 1.0961 1.1114 0.6199 0.2169 -0.3993 59 SER A C 401 O O . SER A 59 ? 2.0205 1.0749 1.0745 0.5624 0.2111 -0.3915 59 SER A O 402 C CB . SER A 59 ? 2.2477 1.2684 1.1577 0.7798 0.2729 -0.4103 59 SER A CB 403 O OG . SER A 59 ? 2.2126 1.2845 1.1294 0.7492 0.2780 -0.4157 59 SER A OG 404 N N . ASN A 60 ? 2.2508 1.0544 1.1440 0.6111 0.1945 -0.4159 60 ASN A N 405 C CA . ASN A 60 ? 2.2737 0.9863 1.1423 0.5276 0.1601 -0.4257 60 ASN A CA 406 C C . ASN A 60 ? 2.2612 1.0011 1.1196 0.4949 0.1542 -0.4410 60 ASN A C 407 O O . ASN A 60 ? 2.1799 0.9554 1.0929 0.4198 0.1336 -0.4340 60 ASN A O 408 C CB . ASN A 60 ? 2.4541 0.9640 1.1968 0.5337 0.1388 -0.4460 60 ASN A CB 409 C CG . ASN A 60 ? 2.4888 0.9543 1.2274 0.5683 0.1439 -0.4292 60 ASN A CG 410 O OD1 . ASN A 60 ? 2.3697 0.9573 1.2075 0.5747 0.1572 -0.4020 60 ASN A OD1 411 N ND2 . ASN A 60 ? 2.6639 0.9462 1.2806 0.5914 0.1308 -0.4457 60 ASN A ND2 412 N N . GLN A 61 ? 2.3489 1.0738 1.1335 0.5570 0.1733 -0.4607 61 GLN A N 413 C CA . GLN A 61 ? 2.3525 1.1055 1.1144 0.5413 0.1727 -0.4747 61 GLN A CA 414 C C . GLN A 61 ? 2.1768 1.1122 1.0680 0.5087 0.1874 -0.4464 61 GLN A C 415 O O . GLN A 61 ? 2.1296 1.0895 1.0433 0.4503 0.1698 -0.4469 61 GLN A O 416 C CB . GLN A 61 ? 2.4836 1.1928 1.1375 0.6287 0.1974 -0.4978 61 GLN A CB 417 N N . GLN A 62 ? 2.0890 1.1484 1.0627 0.5461 0.2168 -0.4213 62 GLN A N 418 C CA . GLN A 62 ? 1.9323 1.1554 1.0273 0.5145 0.2288 -0.3930 62 GLN A CA 419 C C . GLN A 62 ? 1.8295 1.0698 1.0012 0.4346 0.1997 -0.3795 62 GLN A C 420 O O . GLN A 62 ? 1.7330 1.0591 0.9717 0.3898 0.1960 -0.3658 62 GLN A O 421 C CB . GLN A 62 ? 1.8720 1.2174 1.0398 0.5667 0.2600 -0.3695 62 GLN A CB 422 C CG . GLN A 62 ? 1.9385 1.3305 1.0654 0.6418 0.2973 -0.3719 62 GLN A CG 423 C CD . GLN A 62 ? 1.8587 1.4079 1.0848 0.6786 0.3262 -0.3420 62 GLN A CD 424 O OE1 . GLN A 62 ? 1.9260 1.4828 1.1245 0.7541 0.3476 -0.3429 62 GLN A OE1 425 N NE2 . GLN A 62 ? 1.7222 1.3970 1.0631 0.6257 0.3247 -0.3153 62 GLN A NE2 426 N N . TRP A 63 ? 1.8597 1.0165 1.0171 0.4202 0.1805 -0.3817 63 TRP A N 427 C CA . TRP A 63 ? 1.7701 0.9450 0.9966 0.3518 0.1565 -0.3666 63 TRP A CA 428 C C . TRP A 63 ? 1.8023 0.9087 0.9939 0.2886 0.1264 -0.3800 63 TRP A C 429 O O . TRP A 63 ? 1.7050 0.8820 0.9641 0.2370 0.1146 -0.3674 63 TRP A O 430 C CB . TRP A 63 ? 1.7854 0.9123 1.0164 0.3615 0.1513 -0.3572 63 TRP A CB 431 C CG . TRP A 63 ? 1.7053 0.8425 0.9938 0.2955 0.1291 -0.3416 63 TRP A CG 432 C CD1 . TRP A 63 ? 1.7643 0.7986 1.0138 0.2544 0.1064 -0.3444 63 TRP A CD1 433 C CD2 . TRP A 63 ? 1.5627 0.8209 0.9556 0.2636 0.1279 -0.3198 63 TRP A CD2 434 N NE1 . TRP A 63 ? 1.6642 0.7594 0.9910 0.2028 0.0948 -0.3237 63 TRP A NE1 435 C CE2 . TRP A 63 ? 1.5429 0.7696 0.9533 0.2105 0.1069 -0.3105 63 TRP A CE2 436 C CE3 . TRP A 63 ? 1.4613 0.8482 0.9319 0.2741 0.1418 -0.3064 63 TRP A CE3 437 C CZ2 . TRP A 63 ? 1.4289 0.7462 0.9247 0.1764 0.1007 -0.2908 63 TRP A CZ2 438 C CZ3 . TRP A 63 ? 1.3508 0.8151 0.9031 0.2349 0.1315 -0.2885 63 TRP A CZ3 439 C CH2 . TRP A 63 ? 1.3389 0.7671 0.8998 0.1909 0.1118 -0.2822 63 TRP A CH2 440 N N . GLU A 64 ? 1.9457 0.9141 1.0302 0.2941 0.1119 -0.4056 64 GLU A N 441 C CA . GLU A 64 ? 1.9947 0.8923 1.0412 0.2320 0.0778 -0.4202 64 GLU A CA 442 C C . GLU A 64 ? 1.9455 0.9188 1.0106 0.2126 0.0758 -0.4235 64 GLU A C 443 O O . GLU A 64 ? 1.9030 0.8967 1.0010 0.1517 0.0505 -0.4197 64 GLU A O 444 C CB . GLU A 64 ? 2.1758 0.9026 1.0918 0.2464 0.0606 -0.4507 64 GLU A CB 445 N N . LYS A 65 ? 1.9558 0.9759 1.0007 0.2669 0.1039 -0.4276 65 LYS A N 446 C CA . LYS A 65 ? 1.9119 1.0096 0.9723 0.2569 0.1086 -0.4253 65 LYS A CA 447 C C . LYS A 65 ? 1.7542 0.9822 0.9360 0.2172 0.1107 -0.3945 65 LYS A C 448 O O . LYS A 65 ? 1.7156 0.9775 0.9161 0.1771 0.0946 -0.3915 65 LYS A O 449 C CB . LYS A 65 ? 1.9582 1.0856 0.9739 0.3277 0.1449 -0.4299 65 LYS A CB 450 N N . LEU A 66 ? 1.6740 0.9695 0.9319 0.2314 0.1279 -0.3728 66 LEU A N 451 C CA . LEU A 66 ? 1.5407 0.9459 0.9053 0.1979 0.1274 -0.3460 66 LEU A CA 452 C C . LEU A 66 ? 1.5008 0.8881 0.8985 0.1394 0.0967 -0.3414 66 LEU A C 453 O O . LEU A 66 ? 1.4229 0.8740 0.8739 0.1042 0.0866 -0.3287 66 LEU A O 454 C CB . LEU A 66 ? 1.4785 0.9570 0.9095 0.2295 0.1497 -0.3266 66 LEU A CB 455 C CG . LEU A 66 ? 1.4193 1.0127 0.9059 0.2478 0.1749 -0.3077 66 LEU A CG 456 C CD1 . LEU A 66 ? 1.3649 1.0277 0.9215 0.2707 0.1875 -0.2900 66 LEU A CD1 457 C CD2 . LEU A 66 ? 1.3445 0.9961 0.8793 0.2001 0.1635 -0.2941 66 LEU A CD2 458 N N . GLN A 67 ? 1.5604 0.8616 0.9249 0.1315 0.0833 -0.3495 67 GLN A N 459 C CA . GLN A 67 ? 1.5352 0.8207 0.9288 0.0761 0.0569 -0.3422 67 GLN A CA 460 C C . GLN A 67 ? 1.5593 0.8317 0.9285 0.0340 0.0315 -0.3533 67 GLN A C 461 O O . GLN A 67 ? 1.4874 0.8178 0.9136 -0.0067 0.0163 -0.3397 67 GLN A O 462 C CB . GLN A 67 ? 1.6199 0.8022 0.9689 0.0748 0.0488 -0.3472 67 GLN A CB 463 C CG . GLN A 67 ? 1.5672 0.7680 0.9738 0.0309 0.0357 -0.3261 67 GLN A CG 464 C CD . GLN A 67 ? 1.6579 0.7504 1.0159 0.0261 0.0292 -0.3264 67 GLN A CD 465 O OE1 . GLN A 67 ? 1.7744 0.7594 1.0555 0.0109 0.0122 -0.3448 67 GLN A OE1 466 N NE2 . GLN A 67 ? 1.6149 0.7290 1.0123 0.0383 0.0406 -0.3055 67 GLN A NE2 467 N N . HIS A 68 ? 1.6664 0.8639 0.9469 0.0492 0.0265 -0.3786 68 HIS A N 468 C CA . HIS A 68 ? 1.7054 0.8877 0.9495 0.0168 0.0005 -0.3929 68 HIS A CA 469 C C . HIS A 68 ? 1.6102 0.9018 0.9078 0.0144 0.0081 -0.3781 68 HIS A C 470 O O . HIS A 68 ? 1.5897 0.9087 0.9035 -0.0247 -0.0165 -0.3762 68 HIS A O 471 C CB . HIS A 68 ? 1.8477 0.9256 0.9743 0.0466 -0.0031 -0.4251 68 HIS A CB 472 C CG . HIS A 68 ? 1.9053 0.9564 0.9826 0.0143 -0.0352 -0.4435 68 HIS A CG 473 N ND1 . HIS A 68 ? 1.8871 0.9947 0.9529 0.0307 -0.0279 -0.4445 68 HIS A ND1 474 C CD2 . HIS A 68 ? 1.9867 0.9628 1.0232 -0.0349 -0.0770 -0.4601 68 HIS A CD2 475 C CE1 . HIS A 68 ? 1.9545 1.0227 0.9710 -0.0026 -0.0644 -0.4628 68 HIS A CE1 476 N NE2 . HIS A 68 ? 2.0148 1.0058 1.0156 -0.0447 -0.0962 -0.4733 68 HIS A NE2 477 N N . MET A 69 ? 1.5591 0.9128 0.8838 0.0558 0.0411 -0.3659 69 MET A N 478 C CA . MET A 69 ? 1.4797 0.9281 0.8515 0.0546 0.0513 -0.3482 69 MET A CA 479 C C . MET A 69 ? 1.3770 0.8894 0.8334 0.0147 0.0359 -0.3274 69 MET A C 480 O O . MET A 69 ? 1.3454 0.8979 0.8172 -0.0069 0.0223 -0.3207 69 MET A O 481 C CB . MET A 69 ? 1.4494 0.9540 0.8443 0.1001 0.0892 -0.3349 69 MET A CB 482 C CG . MET A 69 ? 1.4168 0.9954 0.8296 0.1043 0.1039 -0.3188 69 MET A CG 483 S SD . MET A 69 ? 1.2962 0.9652 0.8110 0.0678 0.0958 -0.2887 69 MET A SD 484 N N . PHE A 70 ? 1.3329 0.8517 0.8371 0.0104 0.0381 -0.3173 70 PHE A N 485 C CA . PHE A 70 ? 1.2468 0.8213 0.8237 -0.0194 0.0259 -0.2985 70 PHE A CA 486 C C . PHE A 70 ? 1.2714 0.8188 0.8408 -0.0626 -0.0043 -0.3031 70 PHE A C 487 O O . PHE A 70 ? 1.2170 0.8207 0.8316 -0.0868 -0.0183 -0.2902 70 PHE A O 488 C CB . PHE A 70 ? 1.2009 0.7932 0.8248 -0.0046 0.0394 -0.2857 70 PHE A CB 489 C CG . PHE A 70 ? 1.1638 0.8090 0.8182 0.0290 0.0636 -0.2759 70 PHE A CG 490 C CD1 . PHE A 70 ? 1.0921 0.8091 0.7994 0.0218 0.0644 -0.2595 70 PHE A CD1 491 C CD2 . PHE A 70 ? 1.2046 0.8279 0.8350 0.0675 0.0841 -0.2819 70 PHE A CD2 492 C CE1 . PHE A 70 ? 1.0588 0.8260 0.7990 0.0441 0.0833 -0.2484 70 PHE A CE1 493 C CE2 . PHE A 70 ? 1.1652 0.8527 0.8337 0.0948 0.1050 -0.2700 70 PHE A CE2 494 C CZ . PHE A 70 ? 1.0869 0.8469 0.8128 0.0787 0.1036 -0.2528 70 PHE A CZ 495 N N . GLN A 71 ? 1.3596 0.8215 0.8716 -0.0719 -0.0153 -0.3204 71 GLN A N 496 C CA . GLN A 71 ? 1.3967 0.8314 0.9023 -0.1206 -0.0468 -0.3238 71 GLN A CA 497 C C . GLN A 71 ? 1.3926 0.8665 0.8949 -0.1425 -0.0694 -0.3278 71 GLN A C 498 O O . GLN A 71 ? 1.3592 0.8818 0.9065 -0.1787 -0.0903 -0.3158 71 GLN A O 499 C CB . GLN A 71 ? 1.5197 0.8374 0.9482 -0.1277 -0.0580 -0.3450 71 GLN A CB 500 C CG . GLN A 71 ? 1.5341 0.8104 0.9760 -0.1327 -0.0510 -0.3338 71 GLN A CG 501 C CD . GLN A 71 ? 1.6753 0.8172 1.0261 -0.1266 -0.0577 -0.3556 71 GLN A CD 502 O OE1 . GLN A 71 ? 1.7739 0.8463 1.0540 -0.1399 -0.0800 -0.3800 71 GLN A OE1 503 N NE2 . GLN A 71 ? 1.6947 0.7930 1.0397 -0.1036 -0.0403 -0.3477 71 GLN A NE2 504 N N . VAL A 72 ? 1.4296 0.8876 0.8779 -0.1168 -0.0639 -0.3426 72 VAL A N 505 C CA . VAL A 72 ? 1.4305 0.9243 0.8663 -0.1286 -0.0832 -0.3455 72 VAL A CA 506 C C . VAL A 72 ? 1.3212 0.9138 0.8300 -0.1248 -0.0749 -0.3196 72 VAL A C 507 O O . VAL A 72 ? 1.3007 0.9396 0.8312 -0.1468 -0.0978 -0.3128 72 VAL A O 508 C CB . VAL A 72 ? 1.5057 0.9563 0.8573 -0.0955 -0.0745 -0.3651 72 VAL A CB 509 N N . TYR A 73 ? 1.2592 0.8813 0.8033 -0.0959 -0.0445 -0.3056 73 TYR A N 510 C CA . TYR A 73 ? 1.1715 0.8699 0.7761 -0.0905 -0.0373 -0.2826 73 TYR A CA 511 C C . TYR A 73 ? 1.1186 0.8623 0.7823 -0.1160 -0.0551 -0.2687 73 TYR A C 512 O O . TYR A 73 ? 1.0833 0.8786 0.7714 -0.1200 -0.0666 -0.2569 73 TYR A O 513 C CB . TYR A 73 ? 1.1266 0.8426 0.7598 -0.0612 -0.0064 -0.2716 73 TYR A CB 514 C CG . TYR A 73 ? 1.0442 0.8221 0.7409 -0.0610 -0.0045 -0.2498 73 TYR A CG 515 C CD1 . TYR A 73 ? 1.0302 0.8406 0.7289 -0.0578 -0.0059 -0.2381 73 TYR A CD1 516 C CD2 . TYR A 73 ? 0.9963 0.7913 0.7419 -0.0620 -0.0027 -0.2410 73 TYR A CD2 517 C CE1 . TYR A 73 ? 0.9728 0.8233 0.7184 -0.0562 -0.0075 -0.2202 73 TYR A CE1 518 C CE2 . TYR A 73 ? 0.9400 0.7807 0.7321 -0.0582 -0.0040 -0.2246 73 TYR A CE2 519 C CZ . TYR A 73 ? 0.9293 0.7934 0.7198 -0.0556 -0.0074 -0.2152 73 TYR A CZ 520 O OH . TYR A 73 ? 0.8822 0.7752 0.7077 -0.0502 -0.0116 -0.2009 73 TYR A OH 521 N N . ARG A 74 ? 1.1178 0.8427 0.8009 -0.1293 -0.0557 -0.2681 74 ARG A N 522 C CA . ARG A 74 ? 1.0679 0.8433 0.8088 -0.1488 -0.0659 -0.2509 74 ARG A CA 523 C C . ARG A 74 ? 1.0743 0.8917 0.8236 -0.1751 -0.0944 -0.2482 74 ARG A C 524 O O . ARG A 74 ? 1.0220 0.9066 0.8130 -0.1693 -0.0987 -0.2322 74 ARG A O 525 C CB . ARG A 74 ? 1.0891 0.8293 0.8376 -0.1643 -0.0630 -0.2491 74 ARG A CB 526 C CG . ARG A 74 ? 1.0403 0.8418 0.8500 -0.1784 -0.0662 -0.2266 74 ARG A CG 527 C CD . ARG A 74 ? 1.0576 0.8268 0.8754 -0.1817 -0.0535 -0.2186 74 ARG A CD 528 N NE . ARG A 74 ? 1.1468 0.8547 0.9331 -0.2188 -0.0674 -0.2253 74 ARG A NE 529 C CZ . ARG A 74 ? 1.1844 0.8518 0.9692 -0.2316 -0.0608 -0.2158 74 ARG A CZ 530 N NH1 . ARG A 74 ? 1.1441 0.8323 0.9571 -0.2065 -0.0396 -0.1997 74 ARG A NH1 531 N NH2 . ARG A 74 ? 1.2733 0.8731 1.0232 -0.2703 -0.0773 -0.2222 74 ARG A NH2 532 N N . VAL A 75 ? 1.1452 0.9211 0.8510 -0.2011 -0.1158 -0.2649 75 VAL A N 533 C CA . VAL A 75 ? 1.1605 0.9790 0.8725 -0.2286 -0.1481 -0.2643 75 VAL A CA 534 C C . VAL A 75 ? 1.1393 0.9949 0.8392 -0.2029 -0.1501 -0.2619 75 VAL A C 535 O O . VAL A 75 ? 1.0966 1.0249 0.8370 -0.2012 -0.1609 -0.2458 75 VAL A O 536 C CB . VAL A 75 ? 1.2585 1.0119 0.9147 -0.2627 -0.1755 -0.2869 75 VAL A CB 537 C CG1 . VAL A 75 ? 1.2739 1.0869 0.9492 -0.2960 -0.2136 -0.2839 75 VAL A CG1 538 C CG2 . VAL A 75 ? 1.2994 0.9944 0.9552 -0.2879 -0.1727 -0.2885 75 VAL A CG2 539 N N . SER A 76 ? 1.1755 0.9806 0.8170 -0.1796 -0.1375 -0.2757 76 SER A N 540 C CA . SER A 76 ? 1.1715 0.9987 0.7896 -0.1558 -0.1361 -0.2712 76 SER A CA 541 C C . SER A 76 ? 1.0924 0.9793 0.7638 -0.1361 -0.1244 -0.2467 76 SER A C 542 O O . SER A 76 ? 1.0865 1.0109 0.7568 -0.1281 -0.1377 -0.2370 76 SER A O 543 C CB . SER A 76 ? 1.2153 0.9855 0.7713 -0.1299 -0.1131 -0.2833 76 SER A CB 544 O OG . SER A 76 ? 1.3040 1.0063 0.7976 -0.1411 -0.1249 -0.3092 76 SER A OG 545 N N . PHE A 77 ? 1.0416 0.9308 0.7527 -0.1264 -0.1022 -0.2377 77 PHE A N 546 C CA . PHE A 77 ? 0.9799 0.9104 0.7336 -0.1069 -0.0931 -0.2180 77 PHE A CA 547 C C . PHE A 77 ? 0.9515 0.9435 0.7457 -0.1131 -0.1134 -0.2057 77 PHE A C 548 O O . PHE A 77 ? 0.9398 0.9635 0.7378 -0.0955 -0.1210 -0.1938 77 PHE A O 549 C CB . PHE A 77 ? 0.9426 0.8592 0.7248 -0.0963 -0.0695 -0.2145 77 PHE A CB 550 C CG . PHE A 77 ? 0.8943 0.8441 0.7153 -0.0786 -0.0657 -0.1980 77 PHE A CG 551 C CD1 . PHE A 77 ? 0.8643 0.8468 0.7259 -0.0790 -0.0697 -0.1903 77 PHE A CD1 552 C CD2 . PHE A 77 ? 0.8916 0.8358 0.7035 -0.0614 -0.0587 -0.1893 77 PHE A CD2 553 C CE1 . PHE A 77 ? 0.8325 0.8367 0.7180 -0.0568 -0.0679 -0.1783 77 PHE A CE1 554 C CE2 . PHE A 77 ? 0.8614 0.8203 0.6989 -0.0455 -0.0598 -0.1770 77 PHE A CE2 555 C CZ . PHE A 77 ? 0.8328 0.8193 0.7035 -0.0402 -0.0651 -0.1735 77 PHE A CZ 556 N N . THR A 78 ? 0.9459 0.9552 0.7693 -0.1363 -0.1208 -0.2063 78 THR A N 557 C CA . THR A 78 ? 0.9234 1.0057 0.7917 -0.1448 -0.1380 -0.1921 78 THR A CA 558 C C . THR A 78 ? 0.9479 1.0664 0.7997 -0.1450 -0.1643 -0.1916 78 THR A C 559 O O . THR A 78 ? 0.9227 1.0937 0.7936 -0.1211 -0.1704 -0.1770 78 THR A O 560 C CB . THR A 78 ? 0.9401 1.0297 0.8336 -0.1828 -0.1448 -0.1924 78 THR A CB 561 O OG1 . THR A 78 ? 0.9360 0.9718 0.8258 -0.1814 -0.1216 -0.1962 78 THR A OG1 562 C CG2 . THR A 78 ? 0.9076 1.0885 0.8617 -0.1873 -0.1524 -0.1704 78 THR A CG2 563 N N . ARG A 79 ? 1.0047 1.0883 0.8129 -0.1673 -0.1806 -0.2089 79 ARG A N 564 C CA . ARG A 79 ? 1.0403 1.1559 0.8264 -0.1715 -0.2109 -0.2113 79 ARG A CA 565 C C . ARG A 79 ? 1.0400 1.1501 0.7915 -0.1335 -0.2060 -0.2045 79 ARG A C 566 O O . ARG A 79 ? 1.0562 1.2109 0.8018 -0.1243 -0.2292 -0.1979 79 ARG A O 567 C CB . ARG A 79 ? 1.1150 1.1798 0.8503 -0.2037 -0.2316 -0.2353 79 ARG A CB 568 C CG . ARG A 79 ? 1.1531 1.2739 0.8936 -0.2284 -0.2740 -0.2370 79 ARG A CG 569 C CD . ARG A 79 ? 1.2457 1.3036 0.9071 -0.2421 -0.2970 -0.2635 79 ARG A CD 570 N NE . ARG A 79 ? 1.2652 1.3076 0.8702 -0.2035 -0.2924 -0.2639 79 ARG A NE 571 C CZ . ARG A 79 ? 1.3425 1.3439 0.8713 -0.2032 -0.3128 -0.2831 79 ARG A CZ 572 N NH1 . ARG A 79 ? 1.4164 1.3814 0.9128 -0.2402 -0.3433 -0.3075 79 ARG A NH1 573 N NH2 . ARG A 79 ? 1.3561 1.3471 0.8353 -0.1661 -0.3037 -0.2774 79 ARG A NH2 574 N N . ASP A 80 ? 1.0267 1.0840 0.7563 -0.1127 -0.1770 -0.2041 80 ASP A N 575 C CA . ASP A 80 ? 1.0332 1.0777 0.7318 -0.0817 -0.1690 -0.1927 80 ASP A CA 576 C C . ASP A 80 ? 0.9923 1.0785 0.7286 -0.0563 -0.1696 -0.1723 80 ASP A C 577 O O . ASP A 80 ? 1.0119 1.1176 0.7298 -0.0351 -0.1838 -0.1611 80 ASP A O 578 C CB . ASP A 80 ? 1.0382 1.0218 0.7089 -0.0732 -0.1379 -0.1954 80 ASP A CB 579 C CG . ASP A 80 ? 1.1030 1.0431 0.7089 -0.0786 -0.1365 -0.2110 80 ASP A CG 580 O OD1 . ASP A 80 ? 1.1481 1.0868 0.7330 -0.0977 -0.1595 -0.2279 80 ASP A OD1 581 O OD2 . ASP A 80 ? 1.1156 1.0231 0.6897 -0.0638 -0.1128 -0.2060 80 ASP A OD2 582 N N . ILE A 81 ? 0.9443 1.0388 0.7256 -0.0542 -0.1549 -0.1680 81 ILE A N 583 C CA . ILE A 81 ? 0.9162 1.0385 0.7238 -0.0247 -0.1540 -0.1520 81 ILE A CA 584 C C . ILE A 81 ? 0.9255 1.1211 0.7502 -0.0134 -0.1791 -0.1424 81 ILE A C 585 O O . ILE A 81 ? 0.9463 1.1482 0.7517 0.0190 -0.1876 -0.1306 81 ILE A O 586 C CB . ILE A 81 ? 0.8708 0.9957 0.7205 -0.0242 -0.1369 -0.1512 81 ILE A CB 587 C CG1 . ILE A 81 ? 0.8627 0.9238 0.6990 -0.0299 -0.1141 -0.1588 81 ILE A CG1 588 C CG2 . ILE A 81 ? 0.8557 1.0104 0.7240 0.0117 -0.1392 -0.1371 81 ILE A CG2 589 C CD1 . ILE A 81 ? 0.8650 0.8847 0.6787 -0.0088 -0.1065 -0.1502 81 ILE A CD1 590 N N . GLN A 82 ? 0.9190 1.1695 0.7784 -0.0407 -0.1920 -0.1461 82 GLN A N 591 C CA . GLN A 82 ? 0.9230 1.2647 0.8129 -0.0338 -0.2164 -0.1346 82 GLN A CA 592 C C . GLN A 82 ? 0.9698 1.3200 0.8178 -0.0208 -0.2413 -0.1340 82 GLN A C 593 O O . GLN A 82 ? 0.9770 1.4028 0.8441 -0.0001 -0.2613 -0.1213 82 GLN A O 594 C CB . GLN A 82 ? 0.9135 1.3133 0.8533 -0.0768 -0.2265 -0.1361 82 GLN A CB 595 C CG . GLN A 82 ? 0.9544 1.2998 0.8661 -0.1235 -0.2344 -0.1569 82 GLN A CG 596 C CD . GLN A 82 ? 0.9517 1.3091 0.9053 -0.1657 -0.2307 -0.1577 82 GLN A CD 597 O OE1 . GLN A 82 ? 0.9104 1.2864 0.9029 -0.1572 -0.2092 -0.1452 82 GLN A OE1 598 N NE2 . GLN A 82 ? 1.0003 1.3392 0.9392 -0.2114 -0.2529 -0.1722 82 GLN A NE2 599 N N . GLU A 83 ? 1.0058 1.2827 0.7950 -0.0288 -0.2388 -0.1460 83 GLU A N 600 C CA . GLU A 83 ? 1.0578 1.3278 0.7935 -0.0102 -0.2577 -0.1431 83 GLU A CA 601 C C . GLU A 83 ? 1.0656 1.2951 0.7701 0.0337 -0.2442 -0.1266 83 GLU A C 602 O O . GLU A 83 ? 1.0974 1.3487 0.7784 0.0653 -0.2618 -0.1139 83 GLU A O 603 C CB . GLU A 83 ? 1.1073 1.3171 0.7848 -0.0345 -0.2596 -0.1616 83 GLU A CB 604 C CG . GLU A 83 ? 1.1285 1.3589 0.8166 -0.0786 -0.2818 -0.1812 83 GLU A CG 605 C CD . GLU A 83 ? 1.1516 1.4693 0.8616 -0.0852 -0.3227 -0.1774 83 GLU A CD 606 O OE1 . GLU A 83 ? 1.1970 1.5193 0.8593 -0.0663 -0.3439 -0.1761 83 GLU A OE1 607 O OE2 . GLU A 83 ? 1.1262 1.5124 0.9023 -0.1100 -0.3339 -0.1738 83 GLU A OE2 608 N N . LEU A 84 ? 1.0434 1.2112 0.7460 0.0347 -0.2155 -0.1262 84 LEU A N 609 C CA . LEU A 84 ? 1.0597 1.1777 0.7353 0.0679 -0.2042 -0.1107 84 LEU A CA 610 C C . LEU A 84 ? 1.0556 1.2172 0.7539 0.1071 -0.2157 -0.0977 84 LEU A C 611 O O . LEU A 84 ? 1.0985 1.2301 0.7579 0.1432 -0.2220 -0.0835 84 LEU A O 612 C CB . LEU A 84 ? 1.0312 1.0895 0.7144 0.0547 -0.1758 -0.1142 84 LEU A CB 613 C CG . LEU A 84 ? 1.0487 1.0559 0.6978 0.0308 -0.1587 -0.1206 84 LEU A CG 614 C CD1 . LEU A 84 ? 1.0080 1.0047 0.6914 0.0067 -0.1382 -0.1340 84 LEU A CD1 615 C CD2 . LEU A 84 ? 1.0841 1.0311 0.6890 0.0440 -0.1476 -0.1029 84 LEU A CD2 616 N N . VAL A 85 ? 1.0126 1.2424 0.7696 0.1018 -0.2171 -0.1011 85 VAL A N 617 C CA . VAL A 85 ? 1.0090 1.3034 0.7933 0.1421 -0.2265 -0.0885 85 VAL A CA 618 C C . VAL A 85 ? 1.0495 1.4070 0.8222 0.1646 -0.2546 -0.0789 85 VAL A C 619 O O . VAL A 85 ? 1.0823 1.4479 0.8348 0.2159 -0.2629 -0.0652 85 VAL A O 620 C CB . VAL A 85 ? 0.9547 1.3234 0.8080 0.1254 -0.2194 -0.0905 85 VAL A CB 621 C CG1 . VAL A 85 ? 0.9516 1.3938 0.8310 0.1744 -0.2238 -0.0751 85 VAL A CG1 622 C CG2 . VAL A 85 ? 0.9229 1.2323 0.7853 0.1045 -0.1939 -0.1003 85 VAL A CG2 623 N N . LYS A 86 ? 1.0571 1.4552 0.8378 0.1283 -0.2716 -0.0871 86 LYS A N 624 C CA . LYS A 86 ? 1.0994 1.5628 0.8695 0.1441 -0.3034 -0.0800 86 LYS A CA 625 C C . LYS A 86 ? 1.1662 1.5615 0.8586 0.1823 -0.3091 -0.0707 86 LYS A C 626 O O . LYS A 86 ? 1.2037 1.6458 0.8817 0.2222 -0.3315 -0.0576 86 LYS A O 627 C CB . LYS A 86 ? 1.1066 1.6031 0.8867 0.0915 -0.3236 -0.0953 86 LYS A CB 628 C CG . LYS A 86 ? 1.0664 1.6576 0.9263 0.0549 -0.3314 -0.0972 86 LYS A CG 629 C CD . LYS A 86 ? 1.0922 1.6927 0.9479 -0.0004 -0.3569 -0.1149 86 LYS A CD 630 C CE . LYS A 86 ? 1.0632 1.7572 0.9993 -0.0442 -0.3687 -0.1127 86 LYS A CE 631 N NZ . LYS A 86 ? 1.1112 1.8164 1.0379 -0.0971 -0.4046 -0.1298 86 LYS A NZ 632 N N . MET A 87 ? 1.1875 1.4762 0.8308 0.1704 -0.2884 -0.0746 87 MET A N 633 C CA . MET A 87 ? 1.2598 1.4720 0.8274 0.2010 -0.2886 -0.0608 87 MET A CA 634 C C . MET A 87 ? 1.2874 1.4802 0.8429 0.2557 -0.2886 -0.0437 87 MET A C 635 O O . MET A 87 ? 1.3497 1.5377 0.8597 0.2988 -0.3061 -0.0285 87 MET A O 636 C CB . MET A 87 ? 1.2675 1.3804 0.7986 0.1731 -0.2614 -0.0642 87 MET A CB 637 C CG . MET A 87 ? 1.2651 1.3773 0.7897 0.1287 -0.2577 -0.0818 87 MET A CG 638 S SD . MET A 87 ? 1.3208 1.3329 0.7720 0.1190 -0.2325 -0.0740 87 MET A SD 639 C CE . MET A 87 ? 1.2839 1.2377 0.7652 0.1121 -0.2006 -0.0675 87 MET A CE 640 N N . MET A 88 ? 1.2507 1.4279 0.8408 0.2568 -0.2703 -0.0473 88 MET A N 641 C CA . MET A 88 ? 1.2868 1.4189 0.8539 0.3070 -0.2680 -0.0361 88 MET A CA 642 C C . MET A 88 ? 1.2888 1.5160 0.8828 0.3583 -0.2849 -0.0285 88 MET A C 643 O O . MET A 88 ? 1.2316 1.5617 0.8943 0.3454 -0.2851 -0.0340 88 MET A O 644 C CB . MET A 88 ? 1.2515 1.3311 0.8406 0.2890 -0.2448 -0.0455 88 MET A CB 645 C CG . MET A 88 ? 1.2553 1.2554 0.8277 0.2402 -0.2263 -0.0510 88 MET A CG 646 S SD . MET A 88 ? 1.3717 1.2554 0.8573 0.2509 -0.2273 -0.0312 88 MET A SD 647 C CE . MET A 88 ? 1.3597 1.2489 0.8350 0.2014 -0.2165 -0.0344 88 MET A CE 648 N N . PRO A 90 ? 1.3948 1.7878 0.9940 0.4958 -0.3236 0.0002 90 PRO A N 649 C CA . PRO A 90 ? 1.3792 1.8059 1.0072 0.5370 -0.3111 0.0012 90 PRO A CA 650 C C . PRO A 90 ? 1.3856 1.6849 0.9810 0.5305 -0.2896 -0.0091 90 PRO A C 651 O O . PRO A 90 ? 1.3564 1.6818 0.9824 0.5468 -0.2755 -0.0138 90 PRO A O 652 C CB . PRO A 90 ? 1.4581 1.9023 1.0410 0.6245 -0.3288 0.0180 90 PRO A CB 653 C CG . PRO A 90 ? 1.4754 1.9866 1.0584 0.6176 -0.3547 0.0267 90 PRO A CG 654 C CD . PRO A 90 ? 1.4503 1.9013 1.0250 0.5384 -0.3518 0.0147 90 PRO A CD 655 N N . LYS A 91 ? 1.4258 1.5948 0.9607 0.5057 -0.2879 -0.0111 91 LYS A N 656 C CA . LYS A 91 ? 1.4491 1.4876 0.9450 0.4986 -0.2744 -0.0183 91 LYS A CA 657 C C . LYS A 91 ? 1.3794 1.4433 0.9295 0.4785 -0.2556 -0.0331 91 LYS A C 658 O O . LYS A 91 ? 1.4071 1.4480 0.9402 0.5253 -0.2536 -0.0358 91 LYS A O 659 C CB . LYS A 91 ? 1.4703 1.4081 0.9282 0.4465 -0.2697 -0.0170 91 LYS A CB 660 N N . GLU A 92 ? 1.2987 1.4044 0.9058 0.4138 -0.2427 -0.0429 92 GLU A N 661 C CA . GLU A 92 ? 1.2322 1.3689 0.8921 0.3925 -0.2247 -0.0548 92 GLU A CA 662 C C . GLU A 92 ? 1.1731 1.4562 0.9057 0.3917 -0.2227 -0.0510 92 GLU A C 663 O O . GLU A 92 ? 1.1643 1.5235 0.9202 0.3777 -0.2354 -0.0447 92 GLU A O 664 C CB . GLU A 92 ? 1.1899 1.2744 0.8640 0.3254 -0.2106 -0.0665 92 GLU A CB 665 N N . ASP A 93 ? 1.1388 1.4612 0.9057 0.4050 -0.2081 -0.0535 93 ASP A N 666 C CA . ASP A 93 ? 1.0886 1.5535 0.9273 0.4053 -0.2026 -0.0441 93 ASP A CA 667 C C . ASP A 93 ? 1.0265 1.5111 0.9141 0.3637 -0.1809 -0.0506 93 ASP A C 668 O O . ASP A 93 ? 1.0260 1.4188 0.8882 0.3540 -0.1700 -0.0632 93 ASP A O 669 C CB . ASP A 93 ? 1.1272 1.6521 0.9567 0.4858 -0.2046 -0.0308 93 ASP A CB 670 N N . TYR A 94 ? 0.9795 1.5845 0.9370 0.3380 -0.1765 -0.0402 94 TYR A N 671 C CA . TYR A 94 ? 0.9275 1.5597 0.9318 0.3005 -0.1556 -0.0409 94 TYR A CA 672 C C . TYR A 94 ? 0.9337 1.5908 0.9374 0.3545 -0.1368 -0.0334 94 TYR A C 673 O O . TYR A 94 ? 0.9719 1.6685 0.9582 0.4202 -0.1404 -0.0234 94 TYR A O 674 C CB . TYR A 94 ? 0.8922 1.6393 0.9681 0.2497 -0.1601 -0.0291 94 TYR A CB 675 C CG . TYR A 94 ? 0.8830 1.5887 0.9542 0.1870 -0.1757 -0.0423 94 TYR A CG 676 C CD1 . TYR A 94 ? 0.8993 1.6519 0.9724 0.1799 -0.2020 -0.0392 94 TYR A CD1 677 C CD2 . TYR A 94 ? 0.8612 1.4813 0.9209 0.1399 -0.1648 -0.0585 94 TYR A CD2 678 C CE1 . TYR A 94 ? 0.9041 1.6133 0.9620 0.1273 -0.2170 -0.0534 94 TYR A CE1 679 C CE2 . TYR A 94 ? 0.8633 1.4421 0.9096 0.0905 -0.1773 -0.0719 94 TYR A CE2 680 C CZ . TYR A 94 ? 0.8880 1.5088 0.9307 0.0843 -0.2033 -0.0700 94 TYR A CZ 681 O OH . TYR A 94 ? 0.9089 1.4839 0.9281 0.0399 -0.2163 -0.0852 94 TYR A OH 682 N N . PRO A 95 ? 0.9040 1.5377 0.9210 0.3325 -0.1166 -0.0378 95 PRO A N 683 C CA . PRO A 95 ? 0.8675 1.4537 0.9015 0.2646 -0.1097 -0.0487 95 PRO A CA 684 C C . PRO A 95 ? 0.8817 1.3314 0.8606 0.2593 -0.1115 -0.0705 95 PRO A C 685 O O . PRO A 95 ? 0.9196 1.3085 0.8513 0.3060 -0.1132 -0.0769 95 PRO A O 686 C CB . PRO A 95 ? 0.8429 1.4876 0.9162 0.2612 -0.0858 -0.0361 95 PRO A CB 687 C CG . PRO A 95 ? 0.8683 1.5780 0.9350 0.3347 -0.0776 -0.0216 95 PRO A CG 688 C CD . PRO A 95 ? 0.9147 1.5788 0.9281 0.3846 -0.0975 -0.0297 95 PRO A CD 689 N N . ILE A 96 ? 0.8594 1.2629 0.8437 0.2029 -0.1119 -0.0814 96 ILE A N 690 C CA . ILE A 96 ? 0.8707 1.1623 0.8119 0.1920 -0.1144 -0.0983 96 ILE A CA 691 C C . ILE A 96 ? 0.8426 1.0969 0.7970 0.1576 -0.0991 -0.1077 96 ILE A C 692 O O . ILE A 96 ? 0.8175 1.1139 0.8086 0.1231 -0.0905 -0.1039 96 ILE A O 693 C CB . ILE A 96 ? 0.8845 1.1487 0.8069 0.1672 -0.1286 -0.1021 96 ILE A CB 694 C CG1 . ILE A 96 ? 0.9214 1.2122 0.8214 0.2088 -0.1454 -0.0920 96 ILE A CG1 695 C CG2 . ILE A 96 ? 0.8957 1.0589 0.7818 0.1515 -0.1268 -0.1141 96 ILE A CG2 696 C CD1 . ILE A 96 ? 0.9267 1.2538 0.8309 0.1854 -0.1607 -0.0886 96 ILE A CD1 697 N N . GLU A 97 ? 0.8532 1.0271 0.7763 0.1668 -0.0981 -0.1191 97 GLU A N 698 C CA . GLU A 97 ? 0.8290 0.9692 0.7619 0.1432 -0.0857 -0.1279 97 GLU A CA 699 C C . GLU A 97 ? 0.8287 0.8981 0.7439 0.1167 -0.0881 -0.1393 97 GLU A C 700 O O . GLU A 97 ? 0.8542 0.8665 0.7406 0.1309 -0.0967 -0.1442 97 GLU A O 701 C CB . GLU A 97 ? 0.8424 0.9699 0.7626 0.1802 -0.0812 -0.1296 97 GLU A CB 702 C CG . GLU A 97 ? 0.8522 1.0592 0.7924 0.2084 -0.0711 -0.1149 97 GLU A CG 703 C CD . GLU A 97 ? 0.8363 1.1009 0.8225 0.1704 -0.0553 -0.1040 97 GLU A CD 704 O OE1 . GLU A 97 ? 0.8273 1.0526 0.8190 0.1352 -0.0495 -0.1119 97 GLU A OE1 705 O OE2 . GLU A 97 ? 0.8336 1.1831 0.8499 0.1764 -0.0490 -0.0860 97 GLU A OE2 706 N N . ILE A 98 ? 0.8051 0.8785 0.7363 0.0780 -0.0808 -0.1425 98 ILE A N 707 C CA . ILE A 98 ? 0.8049 0.8266 0.7233 0.0550 -0.0778 -0.1508 98 ILE A CA 708 C C . ILE A 98 ? 0.7841 0.7831 0.7146 0.0476 -0.0661 -0.1581 98 ILE A C 709 O O . ILE A 98 ? 0.7651 0.7854 0.7139 0.0407 -0.0563 -0.1582 98 ILE A O 710 C CB . ILE A 98 ? 0.8072 0.8379 0.7230 0.0254 -0.0767 -0.1526 98 ILE A CB 711 N N . GLN A 99 ? 0.7913 0.7481 0.7115 0.0481 -0.0686 -0.1623 99 GLN A N 712 C CA . GLN A 99 ? 0.7771 0.7186 0.7104 0.0439 -0.0612 -0.1688 99 GLN A CA 713 C C . GLN A 99 ? 0.7831 0.7033 0.7180 0.0229 -0.0557 -0.1704 99 GLN A C 714 O O . GLN A 99 ? 0.8024 0.6980 0.7276 0.0195 -0.0645 -0.1664 99 GLN A O 715 C CB . GLN A 99 ? 0.7892 0.7120 0.7146 0.0692 -0.0730 -0.1716 99 GLN A CB 716 C CG . GLN A 99 ? 0.7780 0.7279 0.7061 0.0933 -0.0695 -0.1701 99 GLN A CG 717 C CD . GLN A 99 ? 0.8053 0.7280 0.7121 0.1238 -0.0835 -0.1758 99 GLN A CD 718 O OE1 . GLN A 99 ? 0.8451 0.7478 0.7248 0.1459 -0.0975 -0.1758 99 GLN A OE1 719 N NE2 . GLN A 99 ? 0.7996 0.7151 0.7115 0.1284 -0.0820 -0.1818 99 GLN A NE2 720 N N . LEU A 100 ? 0.7717 0.7005 0.7169 0.0098 -0.0405 -0.1745 100 LEU A N 721 C CA . LEU A 100 ? 0.7777 0.6993 0.7263 -0.0037 -0.0303 -0.1745 100 LEU A CA 722 C C . LEU A 100 ? 0.7655 0.6907 0.7363 0.0018 -0.0258 -0.1784 100 LEU A C 723 O O . LEU A 100 ? 0.7532 0.6827 0.7293 0.0121 -0.0215 -0.1835 100 LEU A O 724 C CB . LEU A 100 ? 0.7891 0.7133 0.7226 -0.0152 -0.0170 -0.1777 100 LEU A CB 725 C CG . LEU A 100 ? 0.8069 0.7293 0.7152 -0.0225 -0.0233 -0.1731 100 LEU A CG 726 N N . SER A 101 ? 0.7731 0.6989 0.7575 -0.0062 -0.0281 -0.1737 101 SER A N 727 C CA . SER A 101 ? 0.7653 0.7056 0.7768 -0.0026 -0.0279 -0.1758 101 SER A CA 728 C C . SER A 101 ? 0.7726 0.7370 0.8006 -0.0154 -0.0117 -0.1684 101 SER A C 729 O O . SER A 101 ? 0.7867 0.7556 0.8260 -0.0333 -0.0165 -0.1571 101 SER A O 730 C CB . SER A 101 ? 0.7763 0.7017 0.7940 -0.0022 -0.0525 -0.1757 101 SER A CB 731 O OG . SER A 101 ? 0.7783 0.7253 0.8277 -0.0081 -0.0568 -0.1750 101 SER A OG 732 N N . ALA A 102 ? 0.7719 0.7497 0.7979 -0.0050 0.0082 -0.1732 102 ALA A N 733 C CA . ALA A 102 ? 0.7846 0.7921 0.8215 -0.0069 0.0288 -0.1665 102 ALA A CA 734 C C . ALA A 102 ? 0.7761 0.8203 0.8493 0.0057 0.0315 -0.1664 102 ALA A C 735 O O . ALA A 102 ? 0.7646 0.8061 0.8521 0.0126 0.0140 -0.1716 102 ALA A O 736 C CB . ALA A 102 ? 0.8057 0.7971 0.8053 0.0028 0.0480 -0.1740 102 ALA A CB 737 N N . GLY A 103 ? 0.7880 0.8706 0.8740 0.0128 0.0535 -0.1600 103 GLY A N 738 C CA . GLY A 103 ? 0.7832 0.9117 0.9042 0.0318 0.0586 -0.1589 103 GLY A CA 739 C C . GLY A 103 ? 0.7837 0.9819 0.9556 0.0167 0.0641 -0.1400 103 GLY A C 740 O O . GLY A 103 ? 0.7941 0.9999 0.9698 -0.0099 0.0679 -0.1254 103 GLY A O 741 N N . CYS A 104 ? 0.7773 1.0295 0.9892 0.0337 0.0640 -0.1379 104 CYS A N 742 C CA . CYS A 104 ? 0.7770 1.1154 1.0501 0.0196 0.0691 -0.1174 104 CYS A CA 743 C C . CYS A 104 ? 0.7653 1.1532 1.0842 0.0340 0.0513 -0.1198 104 CYS A C 744 O O . CYS A 104 ? 0.7667 1.1376 1.0643 0.0726 0.0533 -0.1342 104 CYS A O 745 C CB . CYS A 104 ? 0.7978 1.1826 1.0663 0.0408 0.1088 -0.1066 104 CYS A CB 746 S SG . CYS A 104 ? 0.8251 1.1713 1.0343 0.1008 0.1324 -0.1281 104 CYS A SG 747 N N . GLU A 105 ? 0.7622 1.2081 1.1416 0.0011 0.0317 -0.1047 105 GLU A N 748 C CA . GLU A 105 ? 0.7565 1.2662 1.1881 0.0104 0.0107 -0.1047 105 GLU A CA 749 C C . GLU A 105 ? 0.7595 1.3805 1.2435 0.0295 0.0387 -0.0859 105 GLU A C 750 O O . GLU A 105 ? 0.7682 1.4411 1.2805 0.0058 0.0599 -0.0631 105 GLU A O 751 C CB . GLU A 105 ? 0.7623 1.2753 1.2315 -0.0384 -0.0315 -0.0997 105 GLU A CB 752 N N . MET A 106 ? 0.7592 1.4182 1.2527 0.0762 0.0408 -0.0935 106 MET A N 753 C CA . MET A 106 ? 0.7665 1.5436 1.3140 0.1036 0.0648 -0.0755 106 MET A CA 754 C C . MET A 106 ? 0.7578 1.6341 1.3923 0.0782 0.0313 -0.0627 106 MET A C 755 O O . MET A 106 ? 0.7541 1.6039 1.3870 0.0803 -0.0066 -0.0784 106 MET A O 756 C CB . MET A 106 ? 0.7839 1.5442 1.2864 0.1757 0.0873 -0.0898 106 MET A CB 757 N N . TYR A 107 ? 0.7604 1.7529 1.4694 0.0530 0.0448 -0.0331 107 TYR A N 758 C CA . TYR A 107 ? 0.7580 1.8579 1.5612 0.0159 0.0110 -0.0162 107 TYR A CA 759 C C . TYR A 107 ? 0.7577 1.9962 1.6212 0.0653 0.0269 -0.0032 107 TYR A C 760 O O . TYR A 107 ? 0.7644 2.0821 1.6467 0.0919 0.0727 0.0171 107 TYR A O 761 C CB . TYR A 107 ? 0.7675 1.9105 1.6236 -0.0578 0.0107 0.0142 107 TYR A CB 762 C CG . TYR A 107 ? 0.7806 1.7965 1.5889 -0.1120 -0.0167 0.0043 107 TYR A CG 763 C CD1 . TYR A 107 ? 0.8025 1.8248 1.6578 -0.1819 -0.0607 0.0153 107 TYR A CD1 764 C CD2 . TYR A 107 ? 0.7792 1.6684 1.4942 -0.0927 -0.0007 -0.0153 107 TYR A CD2 765 C CE1 . TYR A 107 ? 0.8277 1.7255 1.6305 -0.2242 -0.0861 0.0058 107 TYR A CE1 766 C CE2 . TYR A 107 ? 0.7942 1.5748 1.4656 -0.1346 -0.0250 -0.0231 107 TYR A CE2 767 C CZ . TYR A 107 ? 0.8222 1.6040 1.5340 -0.1967 -0.0665 -0.0128 107 TYR A CZ 768 O OH . TYR A 107 ? 0.8500 1.5159 1.5097 -0.2306 -0.0905 -0.0211 107 TYR A OH 769 N N . ASN A 110 ? 0.8285 2.3503 1.7296 0.1930 0.2047 0.0674 110 ASN A N 770 C CA . ASN A 110 ? 0.8568 2.2910 1.6661 0.2193 0.2480 0.0600 110 ASN A CA 771 C C . ASN A 110 ? 0.8497 2.2097 1.6386 0.1455 0.2434 0.0680 110 ASN A C 772 O O . ASN A 110 ? 0.8763 2.1934 1.6058 0.1558 0.2798 0.0713 110 ASN A O 773 C CB . ASN A 110 ? 0.8919 2.4467 1.7173 0.2777 0.3045 0.0842 110 ASN A CB 774 C CG . ASN A 110 ? 0.9415 2.3877 1.6454 0.3437 0.3432 0.0606 110 ASN A CG 775 O OD1 . ASN A 110 ? 0.9461 2.2324 1.5608 0.3356 0.3284 0.0297 110 ASN A OD1 776 N ND2 . ASN A 110 ? 0.9861 2.5218 1.6854 0.4101 0.3918 0.0754 110 ASN A ND2 777 N N . ALA A 111 ? 0.8224 2.1620 1.6537 0.0748 0.1967 0.0701 111 ALA A N 778 C CA . ALA A 111 ? 0.8226 2.0832 1.6320 0.0065 0.1863 0.0776 111 ALA A CA 779 C C . ALA A 111 ? 0.8124 1.9048 1.5340 0.0055 0.1571 0.0390 111 ALA A C 780 O O . ALA A 111 ? 0.7981 1.8520 1.5108 0.0239 0.1249 0.0137 111 ALA A O 781 C CB . ALA A 111 ? 0.8181 2.1530 1.7224 -0.0725 0.1531 0.1063 111 ALA A CB 782 N N . SER A 112 ? 0.8220 1.8209 1.4789 -0.0133 0.1692 0.0366 112 SER A N 783 C CA . SER A 112 ? 0.8107 1.6628 1.3897 -0.0162 0.1438 0.0043 112 SER A CA 784 C C . SER A 112 ? 0.8194 1.5993 1.3717 -0.0712 0.1339 0.0135 112 SER A C 785 O O . SER A 112 ? 0.8409 1.6555 1.4001 -0.0924 0.1610 0.0413 112 SER A O 786 C CB . SER A 112 ? 0.8218 1.6038 1.3168 0.0465 0.1686 -0.0224 112 SER A CB 787 O OG . SER A 112 ? 0.8505 1.6197 1.2993 0.0562 0.2068 -0.0135 112 SER A OG 788 N N . GLU A 113 ? 0.8065 1.4866 1.3249 -0.0897 0.0957 -0.0083 113 GLU A N 789 C CA . GLU A 113 ? 0.8211 1.4143 1.2986 -0.1291 0.0832 -0.0053 113 GLU A CA 790 C C . GLU A 113 ? 0.8096 1.2955 1.2044 -0.0979 0.0804 -0.0365 113 GLU A C 791 O O . GLU A 113 ? 0.7945 1.2305 1.1740 -0.0873 0.0517 -0.0601 113 GLU A O 792 C CB . GLU A 113 ? 0.8327 1.4052 1.3451 -0.1813 0.0361 -0.0011 113 GLU A CB 793 C CG . GLU A 113 ? 0.8710 1.4887 1.4319 -0.2415 0.0365 0.0371 113 GLU A CG 794 C CD . GLU A 113 ? 0.9106 1.4316 1.4134 -0.2704 0.0345 0.0453 113 GLU A CD 795 O OE1 . GLU A 113 ? 0.9125 1.3276 1.3576 -0.2636 0.0075 0.0199 113 GLU A OE1 796 O OE2 . GLU A 113 ? 0.9401 1.4947 1.4540 -0.2972 0.0609 0.0794 113 GLU A OE2 797 N N . SER A 114 ? 0.8211 1.2769 1.1630 -0.0830 0.1100 -0.0354 114 SER A N 798 C CA . SER A 114 ? 0.8140 1.1757 1.0818 -0.0609 0.1062 -0.0616 114 SER A CA 799 C C . SER A 114 ? 0.8215 1.1102 1.0613 -0.0948 0.0814 -0.0603 114 SER A C 800 O O . SER A 114 ? 0.8438 1.1426 1.1020 -0.1322 0.0784 -0.0360 114 SER A O 801 C CB . SER A 114 ? 0.8370 1.1944 1.0544 -0.0293 0.1432 -0.0642 114 SER A CB 802 O OG . SER A 114 ? 0.8367 1.2517 1.0690 0.0107 0.1667 -0.0671 114 SER A OG 803 N N . PHE A 115 ? 0.8075 1.0236 1.0022 -0.0804 0.0642 -0.0842 115 PHE A N 804 C CA . PHE A 115 ? 0.8188 0.9659 0.9818 -0.1010 0.0399 -0.0856 115 PHE A CA 805 C C . PHE A 115 ? 0.8098 0.9009 0.9160 -0.0772 0.0402 -0.1059 115 PHE A C 806 O O . PHE A 115 ? 0.7917 0.8821 0.8883 -0.0502 0.0464 -0.1235 115 PHE A O 807 C CB . PHE A 115 ? 0.8169 0.9447 1.0043 -0.1161 0.0026 -0.0915 115 PHE A CB 808 C CG . PHE A 115 ? 0.7927 0.9211 0.9843 -0.0866 -0.0079 -0.1142 115 PHE A CG 809 C CD1 . PHE A 115 ? 0.7789 0.9699 1.0172 -0.0774 -0.0056 -0.1136 115 PHE A CD1 810 C CD2 . PHE A 115 ? 0.7866 0.8588 0.9358 -0.0661 -0.0189 -0.1332 115 PHE A CD2 811 C CE1 . PHE A 115 ? 0.7650 0.9517 1.0001 -0.0472 -0.0148 -0.1323 115 PHE A CE1 812 C CE2 . PHE A 115 ? 0.7683 0.8401 0.9176 -0.0394 -0.0255 -0.1497 115 PHE A CE2 813 C CZ . PHE A 115 ? 0.7601 0.8837 0.9485 -0.0292 -0.0238 -0.1496 115 PHE A CZ 814 N N . LEU A 116 ? 0.8269 0.8718 0.8959 -0.0883 0.0322 -0.1016 116 LEU A N 815 C CA . LEU A 116 ? 0.8201 0.8211 0.8445 -0.0710 0.0256 -0.1186 116 LEU A CA 816 C C . LEU A 116 ? 0.8348 0.7880 0.8382 -0.0805 -0.0001 -0.1156 116 LEU A C 817 O O . LEU A 116 ? 0.8675 0.8008 0.8462 -0.0925 0.0006 -0.1011 116 LEU A O 818 C CB . LEU A 116 ? 0.8381 0.8392 0.8240 -0.0615 0.0484 -0.1195 116 LEU A CB 819 C CG . LEU A 116 ? 0.8350 0.8093 0.7877 -0.0436 0.0447 -0.1407 116 LEU A CG 820 C CD1 . LEU A 116 ? 0.8634 0.8431 0.7870 -0.0295 0.0681 -0.1483 116 LEU A CD1 821 C CD2 . LEU A 116 ? 0.8464 0.7876 0.7682 -0.0481 0.0263 -0.1411 116 LEU A CD2 822 N N . HIS A 117 ? 0.8165 0.7495 0.8242 -0.0704 -0.0222 -0.1286 117 HIS A N 823 C CA . HIS A 117 ? 0.8364 0.7213 0.8188 -0.0692 -0.0475 -0.1286 117 HIS A CA 824 C C . HIS A 117 ? 0.8210 0.6936 0.7734 -0.0456 -0.0505 -0.1402 117 HIS A C 825 O O . HIS A 117 ? 0.7908 0.6833 0.7510 -0.0315 -0.0435 -0.1524 117 HIS A O 826 C CB . HIS A 117 ? 0.8437 0.7132 0.8435 -0.0697 -0.0720 -0.1353 117 HIS A CB 827 C CG . HIS A 117 ? 0.8637 0.7503 0.9000 -0.0993 -0.0762 -0.1227 117 HIS A CG 828 N ND1 . HIS A 117 ? 0.9133 0.7717 0.9434 -0.1288 -0.0848 -0.1035 117 HIS A ND1 829 C CD2 . HIS A 117 ? 0.8479 0.7808 0.9295 -0.1054 -0.0745 -0.1242 117 HIS A CD2 830 C CE1 . HIS A 117 ? 0.9218 0.8134 0.9974 -0.1570 -0.0879 -0.0927 117 HIS A CE1 831 N NE2 . HIS A 117 ? 0.8816 0.8234 0.9908 -0.1415 -0.0823 -0.1056 117 HIS A NE2 832 N N . VAL A 118 ? 0.8469 0.6886 0.7660 -0.0419 -0.0615 -0.1338 118 VAL A N 833 C CA . VAL A 118 ? 0.8360 0.6785 0.7326 -0.0199 -0.0669 -0.1410 118 VAL A CA 834 C C . VAL A 118 ? 0.8624 0.6677 0.7364 -0.0003 -0.0906 -0.1415 118 VAL A C 835 O O . VAL A 118 ? 0.9084 0.6689 0.7610 -0.0066 -0.1035 -0.1317 118 VAL A O 836 C CB . VAL A 118 ? 0.8504 0.7000 0.7214 -0.0238 -0.0583 -0.1340 118 VAL A CB 837 C CG1 . VAL A 118 ? 0.8496 0.7080 0.7027 -0.0032 -0.0700 -0.1379 118 VAL A CG1 838 C CG2 . VAL A 118 ? 0.8325 0.7116 0.7134 -0.0344 -0.0363 -0.1390 118 VAL A CG2 839 N N . ALA A 119 ? 0.8403 0.6615 0.7153 0.0247 -0.0953 -0.1515 119 ALA A N 840 C CA . ALA A 119 ? 0.8693 0.6610 0.7180 0.0546 -0.1149 -0.1544 119 ALA A CA 841 C C . ALA A 119 ? 0.8667 0.6884 0.7019 0.0800 -0.1148 -0.1517 119 ALA A C 842 O O . ALA A 119 ? 0.8271 0.7014 0.6854 0.0769 -0.1019 -0.1532 119 ALA A O 843 C CB . ALA A 119 ? 0.8571 0.6487 0.7171 0.0686 -0.1202 -0.1663 119 ALA A CB 844 N N . PHE A 120 ? 0.9154 0.7028 0.7128 0.1049 -0.1308 -0.1466 120 PHE A N 845 C CA . PHE A 120 ? 0.9201 0.7435 0.7053 0.1347 -0.1335 -0.1414 120 PHE A CA 846 C C . PHE A 120 ? 0.9495 0.7646 0.7123 0.1823 -0.1445 -0.1459 120 PHE A C 847 O O . PHE A 120 ? 1.0149 0.7600 0.7334 0.2036 -0.1620 -0.1478 120 PHE A O 848 C CB . PHE A 120 ? 0.9621 0.7579 0.7142 0.1339 -0.1415 -0.1293 120 PHE A CB 849 C CG . PHE A 120 ? 0.9627 0.8091 0.7082 0.1617 -0.1457 -0.1226 120 PHE A CG 850 C CD1 . PHE A 120 ? 0.9170 0.8296 0.6909 0.1415 -0.1369 -0.1209 120 PHE A CD1 851 C CD2 . PHE A 120 ? 1.0133 0.8404 0.7214 0.2096 -0.1608 -0.1184 120 PHE A CD2 852 C CE1 . PHE A 120 ? 0.9174 0.8870 0.6917 0.1631 -0.1449 -0.1139 120 PHE A CE1 853 C CE2 . PHE A 120 ? 1.0149 0.9033 0.7231 0.2384 -0.1653 -0.1102 120 PHE A CE2 854 C CZ . PHE A 120 ? 0.9642 0.9293 0.7100 0.2123 -0.1582 -0.1073 120 PHE A CZ 855 N N . GLN A 121 ? 0.9118 0.7954 0.7012 0.1990 -0.1337 -0.1466 121 GLN A N 856 C CA . GLN A 121 ? 0.9367 0.8304 0.7074 0.2494 -0.1375 -0.1490 121 GLN A CA 857 C C . GLN A 121 ? 0.9633 0.7948 0.7101 0.2601 -0.1461 -0.1629 121 GLN A C 858 O O . GLN A 121 ? 1.0166 0.8191 0.7219 0.3073 -0.1569 -0.1684 121 GLN A O 859 C CB . GLN A 121 ? 0.9947 0.8780 0.7236 0.2961 -0.1510 -0.1421 121 GLN A CB 860 C CG . GLN A 121 ? 0.9800 0.9323 0.7300 0.2921 -0.1478 -0.1283 121 GLN A CG 861 C CD . GLN A 121 ? 0.9418 1.0061 0.7407 0.2990 -0.1331 -0.1198 121 GLN A CD 862 O OE1 . GLN A 121 ? 0.8908 0.9923 0.7323 0.2638 -0.1185 -0.1210 121 GLN A OE1 863 N NE2 . GLN A 121 ? 0.9660 1.0864 0.7594 0.3442 -0.1371 -0.1088 121 GLN A NE2 864 N N . GLY A 122 ? 0.9347 0.7473 0.7047 0.2195 -0.1430 -0.1691 122 GLY A N 865 C CA . GLY A 122 ? 0.9608 0.7222 0.7139 0.2241 -0.1551 -0.1827 122 GLY A CA 866 C C . GLY A 122 ? 1.0077 0.6880 0.7391 0.1985 -0.1761 -0.1870 122 GLY A C 867 O O . GLY A 122 ? 1.0147 0.6668 0.7522 0.1809 -0.1861 -0.1965 122 GLY A O 868 N N . LYS A 123 ? 1.0451 0.6901 0.7517 0.1952 -0.1841 -0.1778 123 LYS A N 869 C CA . LYS A 123 ? 1.0951 0.6646 0.7835 0.1632 -0.2016 -0.1752 123 LYS A CA 870 C C . LYS A 123 ? 1.0451 0.6510 0.7792 0.1119 -0.1835 -0.1628 123 LYS A C 871 O O . LYS A 123 ? 1.0068 0.6626 0.7563 0.1087 -0.1657 -0.1537 123 LYS A O 872 C CB . LYS A 123 ? 1.1810 0.6773 0.8066 0.1895 -0.2205 -0.1693 123 LYS A CB 873 C CG . LYS A 123 ? 1.2640 0.6574 0.8555 0.1617 -0.2463 -0.1680 123 LYS A CG 874 N N . TYR A 124 ? 1.0494 0.6336 0.8039 0.0737 -0.1891 -0.1629 124 TYR A N 875 C CA . TYR A 124 ? 1.0134 0.6308 0.8071 0.0293 -0.1708 -0.1496 124 TYR A CA 876 C C . TYR A 124 ? 1.0709 0.6408 0.8342 0.0128 -0.1751 -0.1308 124 TYR A C 877 O O . TYR A 124 ? 1.1459 0.6397 0.8775 0.0034 -0.1983 -0.1264 124 TYR A O 878 C CB . TYR A 124 ? 0.9994 0.6257 0.8317 -0.0013 -0.1749 -0.1537 124 TYR A CB 879 C CG . TYR A 124 ? 0.9967 0.6353 0.8590 -0.0477 -0.1647 -0.1356 124 TYR A CG 880 C CD1 . TYR A 124 ? 0.9388 0.6430 0.8346 -0.0603 -0.1337 -0.1276 124 TYR A CD1 881 C CD2 . TYR A 124 ? 1.0576 0.6417 0.9128 -0.0791 -0.1863 -0.1257 124 TYR A CD2 882 C CE1 . TYR A 124 ? 0.9460 0.6701 0.8676 -0.0970 -0.1202 -0.1087 124 TYR A CE1 883 C CE2 . TYR A 124 ? 1.0608 0.6683 0.9495 -0.1236 -0.1739 -0.1038 124 TYR A CE2 884 C CZ . TYR A 124 ? 1.0017 0.6841 0.9241 -0.1295 -0.1387 -0.0948 124 TYR A CZ 885 O OH . TYR A 124 ? 1.0038 0.7171 0.9573 -0.1680 -0.1225 -0.0709 124 TYR A OH 886 N N . VAL A 125 ? 1.0448 0.6537 0.8122 0.0090 -0.1546 -0.1194 125 VAL A N 887 C CA . VAL A 125 ? 1.1018 0.6698 0.8314 0.0022 -0.1565 -0.0997 125 VAL A CA 888 C C . VAL A 125 ? 1.0849 0.6873 0.8355 -0.0331 -0.1324 -0.0824 125 VAL A C 889 O O . VAL A 125 ? 1.1421 0.7030 0.8691 -0.0536 -0.1331 -0.0610 125 VAL A O 890 C CB . VAL A 125 ? 1.1132 0.6861 0.8059 0.0440 -0.1601 -0.1000 125 VAL A CB 891 C CG1 . VAL A 125 ? 1.1775 0.6882 0.8244 0.0843 -0.1860 -0.1079 125 VAL A CG1 892 C CG2 . VAL A 125 ? 1.0342 0.6938 0.7620 0.0559 -0.1432 -0.1112 125 VAL A CG2 893 N N . VAL A 126 ? 1.0172 0.6908 0.8057 -0.0375 -0.1103 -0.0905 126 VAL A N 894 C CA . VAL A 126 ? 1.0053 0.7140 0.8037 -0.0599 -0.0853 -0.0776 126 VAL A CA 895 C C . VAL A 126 ? 0.9590 0.7163 0.8086 -0.0794 -0.0677 -0.0827 126 VAL A C 896 O O . VAL A 126 ? 0.9166 0.6970 0.7925 -0.0684 -0.0703 -0.1008 126 VAL A O 897 C CB . VAL A 126 ? 0.9874 0.7281 0.7649 -0.0407 -0.0762 -0.0823 126 VAL A CB 898 C CG1 . VAL A 126 ? 0.9820 0.7557 0.7612 -0.0578 -0.0504 -0.0745 126 VAL A CG1 899 C CG2 . VAL A 126 ? 1.0404 0.7412 0.7676 -0.0199 -0.0932 -0.0725 126 VAL A CG2 900 N N . ARG A 127 ? 0.9742 0.7484 0.8354 -0.1054 -0.0490 -0.0640 127 ARG A N 901 C CA . ARG A 127 ? 0.9376 0.7690 0.8451 -0.1179 -0.0278 -0.0653 127 ARG A CA 902 C C . ARG A 127 ? 0.9501 0.8129 0.8443 -0.1224 0.0021 -0.0511 127 ARG A C 903 O O . ARG A 127 ? 0.9915 0.8278 0.8430 -0.1225 0.0039 -0.0369 127 ARG A O 904 C CB . ARG A 127 ? 0.9544 0.7865 0.9015 -0.1474 -0.0371 -0.0533 127 ARG A CB 905 C CG . ARG A 127 ? 1.0175 0.8232 0.9543 -0.1806 -0.0359 -0.0212 127 ARG A CG 906 C CD . ARG A 127 ? 1.0231 0.8669 1.0176 -0.2178 -0.0340 -0.0049 127 ARG A CD 907 N NE . ARG A 127 ? 1.0959 0.9092 1.0824 -0.2571 -0.0352 0.0296 127 ARG A NE 908 C CZ . ARG A 127 ? 1.1174 0.9593 1.1539 -0.3009 -0.0371 0.0522 127 ARG A CZ 909 N NH1 . ARG A 127 ? 1.0729 0.9806 1.1723 -0.3071 -0.0391 0.0421 127 ARG A NH1 910 N NH2 . ARG A 127 ? 1.1871 0.9936 1.2112 -0.3399 -0.0378 0.0872 127 ARG A NH2 911 N N . PHE A 128 ? 0.9217 0.8387 0.8461 -0.1209 0.0254 -0.0550 128 PHE A N 912 C CA . PHE A 128 ? 0.9443 0.8944 0.8561 -0.1226 0.0567 -0.0396 128 PHE A CA 913 C C . PHE A 128 ? 0.9640 0.9493 0.9191 -0.1521 0.0689 -0.0113 128 PHE A C 914 O O . PHE A 128 ? 0.9384 0.9517 0.9461 -0.1624 0.0612 -0.0143 128 PHE A O 915 C CB . PHE A 128 ? 0.9169 0.9016 0.8273 -0.0977 0.0764 -0.0604 128 PHE A CB 916 C CG . PHE A 128 ? 0.9507 0.9558 0.8256 -0.0880 0.1065 -0.0509 128 PHE A CG 917 C CD1 . PHE A 128 ? 0.9741 0.9479 0.7874 -0.0727 0.1043 -0.0619 128 PHE A CD1 918 C CD2 . PHE A 128 ? 0.9632 1.0233 0.8646 -0.0927 0.1363 -0.0302 128 PHE A CD2 919 C CE1 . PHE A 128 ? 1.0183 1.0043 0.7876 -0.0600 0.1300 -0.0554 128 PHE A CE1 920 C CE2 . PHE A 128 ? 1.0096 1.0891 0.8702 -0.0773 0.1669 -0.0209 128 PHE A CE2 921 C CZ . PHE A 128 ? 1.0413 1.0779 0.8306 -0.0598 0.1631 -0.0350 128 PHE A CZ 922 N N . TRP A 129 ? 1.0161 1.0035 0.9498 -0.1671 0.0868 0.0181 129 TRP A N 923 C CA . TRP A 129 ? 1.0439 1.0746 1.0220 -0.2010 0.1022 0.0523 129 TRP A CA 924 C C . TRP A 129 ? 1.0877 1.1535 1.0393 -0.1990 0.1408 0.0799 129 TRP A C 925 O O . TRP A 129 ? 1.1271 1.1498 1.0139 -0.1876 0.1436 0.0844 129 TRP A O 926 C CB . TRP A 129 ? 1.0842 1.0582 1.0682 -0.2387 0.0722 0.0706 129 TRP A CB 927 C CG . TRP A 129 ? 1.1028 1.1245 1.1526 -0.2826 0.0757 0.0993 129 TRP A CG 928 C CD1 . TRP A 129 ? 1.1730 1.1788 1.2265 -0.3270 0.0770 0.1398 129 TRP A CD1 929 C CD2 . TRP A 129 ? 1.0589 1.1559 1.1823 -0.2888 0.0766 0.0924 129 TRP A CD2 930 N NE1 . TRP A 129 ? 1.1675 1.2395 1.2986 -0.3656 0.0776 0.1587 129 TRP A NE1 931 C CE2 . TRP A 129 ? 1.0971 1.2295 1.2728 -0.3406 0.0767 0.1294 129 TRP A CE2 932 C CE3 . TRP A 129 ? 0.9963 1.1336 1.1455 -0.2562 0.0762 0.0604 129 TRP A CE3 933 C CZ2 . TRP A 129 ? 1.0684 1.2858 1.3264 -0.3596 0.0746 0.1341 129 TRP A CZ2 934 C CZ3 . TRP A 129 ? 0.9724 1.1862 1.1960 -0.2698 0.0755 0.0648 129 TRP A CZ3 935 C CH2 . TRP A 129 ? 1.0033 1.2617 1.2831 -0.3206 0.0738 0.1007 129 TRP A CH2 936 N N . GLY A 130 ? 1.0860 1.2355 1.0867 -0.2066 0.1708 0.0991 130 GLY A N 937 C CA . GLY A 130 ? 1.1303 1.3287 1.1082 -0.1978 0.2142 0.1264 130 GLY A CA 938 C C . GLY A 130 ? 1.1343 1.3206 1.0451 -0.1476 0.2300 0.0982 130 GLY A C 939 O O . GLY A 130 ? 1.1013 1.3204 1.0227 -0.1164 0.2396 0.0722 130 GLY A O 940 N N . THR A 131 ? 1.1827 1.3153 1.0196 -0.1399 0.2292 0.1029 131 THR A N 941 C CA . THR A 131 ? 1.2039 1.3179 0.9676 -0.0974 0.2393 0.0774 131 THR A CA 942 C C . THR A 131 ? 1.2062 1.2411 0.9166 -0.0903 0.2027 0.0531 131 THR A C 943 O O . THR A 131 ? 1.2426 1.2534 0.8835 -0.0643 0.2045 0.0387 131 THR A O 944 C CB . THR A 131 ? 1.2759 1.4180 0.9887 -0.0849 0.2792 0.1073 131 THR A CB 945 O OG1 . THR A 131 ? 1.3188 1.4393 1.0245 -0.1190 0.2782 0.1489 131 THR A OG1 946 C CG2 . THR A 131 ? 1.2783 1.5136 1.0333 -0.0729 0.3218 0.1230 131 THR A CG2 947 N N . SER A 132 ? 1.1742 1.1722 0.9153 -0.1112 0.1684 0.0483 132 SER A N 948 C CA . SER A 132 ? 1.1772 1.1125 0.8754 -0.1025 0.1346 0.0305 132 SER A CA 949 C C . SER A 132 ? 1.1276 1.0381 0.8681 -0.1118 0.1009 0.0133 132 SER A C 950 O O . SER A 132 ? 1.0949 1.0294 0.8947 -0.1278 0.1005 0.0149 132 SER A O 951 C CB . SER A 132 ? 1.2448 1.1401 0.8925 -0.1116 0.1323 0.0617 132 SER A CB 952 O OG . SER A 132 ? 1.2641 1.1506 0.9480 -0.1467 0.1319 0.0948 132 SER A OG 953 N N . TRP A 133 ? 1.1276 0.9954 0.8355 -0.0986 0.0726 -0.0027 133 TRP A N 954 C CA . TRP A 133 ? 1.0972 0.9361 0.8304 -0.1007 0.0414 -0.0149 133 TRP A CA 955 C C . TRP A 133 ? 1.1476 0.9387 0.8725 -0.1198 0.0278 0.0124 133 TRP A C 956 O O . TRP A 133 ? 1.2080 0.9776 0.8925 -0.1259 0.0367 0.0391 133 TRP A O 957 C CB . TRP A 133 ? 1.0826 0.9065 0.7861 -0.0764 0.0190 -0.0389 133 TRP A CB 958 C CG . TRP A 133 ? 1.0444 0.9000 0.7516 -0.0637 0.0260 -0.0664 133 TRP A CG 959 C CD1 . TRP A 133 ? 1.0676 0.9275 0.7298 -0.0515 0.0298 -0.0768 133 TRP A CD1 960 C CD2 . TRP A 133 ? 0.9890 0.8663 0.7405 -0.0625 0.0273 -0.0869 133 TRP A CD2 961 N NE1 . TRP A 133 ? 1.0352 0.9112 0.7098 -0.0456 0.0324 -0.1029 133 TRP A NE1 962 C CE2 . TRP A 133 ? 0.9879 0.8752 0.7172 -0.0512 0.0325 -0.1079 133 TRP A CE2 963 C CE3 . TRP A 133 ? 0.9491 0.8331 0.7512 -0.0694 0.0223 -0.0895 133 TRP A CE3 964 C CZ2 . TRP A 133 ? 0.9549 0.8540 0.7104 -0.0468 0.0352 -0.1288 133 TRP A CZ2 965 C CZ3 . TRP A 133 ? 0.9108 0.8147 0.7400 -0.0619 0.0257 -0.1101 133 TRP A CZ3 966 C CH2 . TRP A 133 ? 0.9160 0.8251 0.7216 -0.0509 0.0331 -0.1282 133 TRP A CH2 967 N N . GLN A 134 ? 1.1340 0.9010 0.8900 -0.1279 0.0052 0.0058 134 GLN A N 968 C CA . GLN A 134 ? 1.1945 0.9009 0.9394 -0.1482 -0.0126 0.0282 134 GLN A CA 969 C C . GLN A 134 ? 1.1971 0.8513 0.9310 -0.1302 -0.0477 0.0096 134 GLN A C 970 O O . GLN A 134 ? 1.1437 0.8214 0.9093 -0.1177 -0.0560 -0.0162 134 GLN A O 971 C CB . GLN A 134 ? 1.1989 0.9277 0.9969 -0.1879 -0.0032 0.0464 134 GLN A CB 972 C CG . GLN A 134 ? 1.2339 1.0020 1.0349 -0.2106 0.0313 0.0801 134 GLN A CG 973 C CD . GLN A 134 ? 1.2846 1.0387 1.1157 -0.2593 0.0290 0.1145 134 GLN A CD 974 O OE1 . GLN A 134 ? 1.3119 0.9997 1.1403 -0.2762 -0.0038 0.1143 134 GLN A OE1 975 N NE2 . GLN A 134 ? 1.2976 1.1139 1.1550 -0.2824 0.0635 0.1450 134 GLN A NE2 976 N N . THR A 135 ? 1.2697 0.8505 0.9529 -0.1246 -0.0669 0.0242 135 THR A N 977 C CA . THR A 135 ? 1.2964 0.8151 0.9633 -0.1081 -0.1001 0.0109 135 THR A CA 978 C C . THR A 135 ? 1.3313 0.8140 1.0251 -0.1467 -0.1120 0.0198 135 THR A C 979 O O . THR A 135 ? 1.3572 0.8496 1.0703 -0.1876 -0.0968 0.0464 135 THR A O 980 C CB . THR A 135 ? 1.3757 0.8190 0.9701 -0.0813 -0.1189 0.0226 135 THR A CB 981 O OG1 . THR A 135 ? 1.4596 0.8513 1.0228 -0.1110 -0.1131 0.0583 135 THR A OG1 982 C CG2 . THR A 135 ? 1.3455 0.8324 0.9173 -0.0431 -0.1136 0.0131 135 THR A CG2 983 N N . VAL A 136 ? 1.3379 0.7838 1.0331 -0.1341 -0.1397 -0.0017 136 VAL A N 984 C CA . VAL A 136 ? 1.3768 0.7866 1.0960 -0.1701 -0.1594 0.0002 136 VAL A CA 985 C C . VAL A 136 ? 1.5002 0.7869 1.1564 -0.1773 -0.1907 0.0136 136 VAL A C 986 O O . VAL A 136 ? 1.5521 0.7856 1.1455 -0.1461 -0.1955 0.0202 136 VAL A O 987 C CB . VAL A 136 ? 1.3203 0.7565 1.0717 -0.1520 -0.1739 -0.0332 136 VAL A CB 988 C CG1 . VAL A 136 ? 1.2203 0.7647 1.0294 -0.1479 -0.1441 -0.0438 136 VAL A CG1 989 C CG2 . VAL A 136 ? 1.3366 0.7241 1.0361 -0.0984 -0.1952 -0.0557 136 VAL A CG2 990 N N . PRO A 137 ? 1.5577 0.7963 1.2281 -0.2196 -0.2140 0.0188 137 PRO A N 991 C CA . PRO A 137 ? 1.6804 0.7840 1.2816 -0.2170 -0.2539 0.0183 137 PRO A CA 992 C C . PRO A 137 ? 1.6800 0.7484 1.2389 -0.1531 -0.2764 -0.0189 137 PRO A C 993 O O . PRO A 137 ? 1.5993 0.7352 1.1996 -0.1359 -0.2736 -0.0452 137 PRO A O 994 C CB . PRO A 137 ? 1.7230 0.8052 1.3642 -0.2794 -0.2764 0.0244 137 PRO A CB 995 C CG . PRO A 137 ? 1.6037 0.8258 1.3402 -0.3002 -0.2484 0.0215 137 PRO A CG 996 C CD . PRO A 137 ? 1.5320 0.8331 1.2769 -0.2770 -0.2044 0.0329 137 PRO A CD 997 N N . GLY A 138 ? 1.7757 0.7415 1.2501 -0.1149 -0.2966 -0.0186 138 GLY A N 998 C CA . GLY A 138 ? 1.7921 0.7234 1.2186 -0.0474 -0.3163 -0.0502 138 GLY A CA 999 C C . GLY A 138 ? 1.7126 0.7301 1.1439 0.0087 -0.2913 -0.0577 138 GLY A C 1000 O O . GLY A 138 ? 1.7345 0.7302 1.1217 0.0699 -0.3033 -0.0758 138 GLY A O 1001 N N . ALA A 139 ? 1.6281 0.7452 1.1121 -0.0119 -0.2573 -0.0436 139 ALA A N 1002 C CA . ALA A 139 ? 1.5557 0.7582 1.0492 0.0288 -0.2357 -0.0484 139 ALA A CA 1003 C C . ALA A 139 ? 1.6312 0.7805 1.0529 0.0719 -0.2445 -0.0357 139 ALA A C 1004 O O . ALA A 139 ? 1.7337 0.7870 1.1023 0.0584 -0.2570 -0.0143 139 ALA A O 1005 C CB . ALA A 139 ? 1.4699 0.7695 1.0225 -0.0070 -0.2019 -0.0368 139 ALA A CB 1006 N N . PRO A 140 ? 1.5871 0.7999 1.0071 0.1235 -0.2390 -0.0468 140 PRO A N 1007 C CA . PRO A 140 ? 1.6520 0.8340 1.0103 0.1696 -0.2473 -0.0342 140 PRO A CA 1008 C C . PRO A 140 ? 1.6404 0.8611 1.0007 0.1489 -0.2289 -0.0106 140 PRO A C 1009 O O . PRO A 140 ? 1.5564 0.8597 0.9731 0.1140 -0.2056 -0.0112 140 PRO A O 1010 C CB . PRO A 140 ? 1.5982 0.8584 0.9709 0.2270 -0.2474 -0.0540 140 PRO A CB 1011 C CG . PRO A 140 ? 1.5236 0.8304 0.9528 0.2112 -0.2411 -0.0765 140 PRO A CG 1012 C CD . PRO A 140 ? 1.4867 0.7987 0.9593 0.1437 -0.2280 -0.0699 140 PRO A CD 1013 N N . SER A 141 ? 1.7343 0.8898 1.0251 0.1757 -0.2402 0.0092 141 SER A N 1014 C CA . SER A 141 ? 1.7518 0.9208 1.0248 0.1590 -0.2261 0.0353 141 SER A CA 1015 C C . SER A 141 ? 1.6815 0.9623 0.9765 0.1851 -0.2163 0.0291 141 SER A C 1016 O O . SER A 141 ? 1.6794 0.9881 0.9678 0.1669 -0.2025 0.0450 141 SER A O 1017 C CB . SER A 141 ? 1.8920 0.9375 1.0741 0.1774 -0.2435 0.0621 141 SER A CB 1018 O OG . SER A 141 ? 1.9388 0.9645 1.0705 0.2497 -0.2645 0.0548 141 SER A OG 1019 N N . TRP A 142 ? 1.6308 0.9765 0.9504 0.2263 -0.2242 0.0072 142 TRP A N 1020 C CA . TRP A 142 ? 1.5671 1.0254 0.9165 0.2436 -0.2193 0.0008 142 TRP A CA 1021 C C . TRP A 142 ? 1.4659 1.0057 0.8834 0.1949 -0.1970 -0.0114 142 TRP A C 1022 O O . TRP A 142 ? 1.4189 1.0409 0.8584 0.1948 -0.1933 -0.0168 142 TRP A O 1023 C CB . TRP A 142 ? 1.5515 1.0629 0.9109 0.3006 -0.2333 -0.0133 142 TRP A CB 1024 C CG . TRP A 142 ? 1.4935 1.0378 0.9052 0.2954 -0.2273 -0.0352 142 TRP A CG 1025 C CD1 . TRP A 142 ? 1.5405 1.0138 0.9314 0.3129 -0.2364 -0.0440 142 TRP A CD1 1026 C CD2 . TRP A 142 ? 1.3942 1.0432 0.8802 0.2721 -0.2125 -0.0508 142 TRP A CD2 1027 N NE1 . TRP A 142 ? 1.4676 1.0013 0.9157 0.3042 -0.2266 -0.0633 142 TRP A NE1 1028 C CE2 . TRP A 142 ? 1.3755 1.0156 0.8832 0.2785 -0.2110 -0.0662 142 TRP A CE2 1029 C CE3 . TRP A 142 ? 1.3300 1.0706 0.8592 0.2463 -0.2025 -0.0537 142 TRP A CE3 1030 C CZ2 . TRP A 142 ? 1.2862 1.0080 0.8588 0.2607 -0.1970 -0.0806 142 TRP A CZ2 1031 C CZ3 . TRP A 142 ? 1.2449 1.0590 0.8378 0.2258 -0.1905 -0.0694 142 TRP A CZ3 1032 C CH2 . TRP A 142 ? 1.2221 1.0275 0.8368 0.2334 -0.1865 -0.0809 142 TRP A CH2 1033 N N . LEU A 143 ? 1.4410 0.9540 0.8881 0.1546 -0.1847 -0.0161 143 LEU A N 1034 C CA . LEU A 143 ? 1.3616 0.9369 0.8643 0.1121 -0.1623 -0.0257 143 LEU A CA 1035 C C . LEU A 143 ? 1.3893 0.9506 0.8726 0.0788 -0.1449 -0.0062 143 LEU A C 1036 O O . LEU A 143 ? 1.3390 0.9446 0.8578 0.0481 -0.1243 -0.0121 143 LEU A O 1037 C CB . LEU A 143 ? 1.3210 0.8868 0.8672 0.0901 -0.1574 -0.0393 143 LEU A CB 1038 N N . ASP A 144 ? 1.4782 0.9769 0.8998 0.0893 -0.1521 0.0182 144 ASP A N 1039 C CA . ASP A 144 ? 1.5205 1.0012 0.9144 0.0613 -0.1335 0.0429 144 ASP A CA 1040 C C . ASP A 144 ? 1.4966 1.0457 0.8821 0.0679 -0.1247 0.0380 144 ASP A C 1041 O O . ASP A 144 ? 1.4663 1.0516 0.8713 0.0401 -0.1013 0.0362 144 ASP A O 1042 C CB . ASP A 144 ? 1.6341 1.0164 0.9572 0.0704 -0.1444 0.0741 144 ASP A CB 1043 N N . LEU A 145 ? 1.5163 1.0833 0.8703 0.1070 -0.1453 0.0349 145 LEU A N 1044 C CA . LEU A 145 ? 1.5044 1.1333 0.8448 0.1141 -0.1460 0.0277 145 LEU A CA 1045 C C . LEU A 145 ? 1.4159 1.1186 0.8142 0.0916 -0.1357 -0.0009 145 LEU A C 1046 O O . LEU A 145 ? 1.4185 1.1461 0.8021 0.0780 -0.1244 -0.0051 145 LEU A O 1047 C CB . LEU A 145 ? 1.5363 1.1856 0.8457 0.1604 -0.1755 0.0279 145 LEU A CB 1048 N N . PRO A 146 ? 1.3481 1.0791 0.8044 0.0903 -0.1399 -0.0204 146 PRO A N 1049 C CA . PRO A 146 ? 1.2747 1.0588 0.7821 0.0661 -0.1280 -0.0441 146 PRO A CA 1050 C C . PRO A 146 ? 1.2687 1.0361 0.7823 0.0341 -0.0989 -0.0410 146 PRO A C 1051 O O . PRO A 146 ? 1.2478 1.0477 0.7684 0.0208 -0.0878 -0.0558 146 PRO A O 1052 C CB . PRO A 146 ? 1.2238 1.0200 0.7813 0.0731 -0.1342 -0.0561 146 PRO A CB 1053 C CG . PRO A 146 ? 1.2628 1.0474 0.7953 0.1120 -0.1568 -0.0469 146 PRO A CG 1054 C CD . PRO A 146 ? 1.3465 1.0655 0.8148 0.1190 -0.1580 -0.0222 146 PRO A CD 1055 N N . ILE A 147 ? 1.2948 1.0122 0.8047 0.0225 -0.0878 -0.0214 147 ILE A N 1056 C CA . ILE A 147 ? 1.2927 1.0066 0.8147 -0.0070 -0.0589 -0.0121 147 ILE A CA 1057 C C . ILE A 147 ? 1.3463 1.0604 0.8152 -0.0074 -0.0436 0.0030 147 ILE A C 1058 O O . ILE A 147 ? 1.3337 1.0780 0.8072 -0.0179 -0.0213 -0.0042 147 ILE A O 1059 C CB . ILE A 147 ? 1.3158 0.9806 0.8527 -0.0260 -0.0554 0.0080 147 ILE A CB 1060 C CG1 . ILE A 147 ? 1.2556 0.9292 0.8483 -0.0295 -0.0645 -0.0120 147 ILE A CG1 1061 C CG2 . ILE A 147 ? 1.3399 1.0068 0.8796 -0.0562 -0.0251 0.0310 147 ILE A CG2 1062 C CD1 . ILE A 147 ? 1.1808 0.9156 0.8189 -0.0336 -0.0529 -0.0379 147 ILE A CD1 1063 N N . LYS A 148 ? 1.4144 1.0921 0.8263 0.0093 -0.0557 0.0236 148 LYS A N 1064 C CA . LYS A 148 ? 1.4782 1.1518 0.8275 0.0146 -0.0434 0.0403 148 LYS A CA 1065 C C . LYS A 148 ? 1.4594 1.1815 0.7942 0.0258 -0.0483 0.0124 148 LYS A C 1066 O O . LYS A 148 ? 1.4964 1.2260 0.7920 0.0248 -0.0290 0.0158 148 LYS A O 1067 C CB . LYS A 148 ? 1.5596 1.1814 0.8460 0.0365 -0.0608 0.0668 148 LYS A CB 1068 N N . VAL A 149 ? 1.4101 1.1636 0.7743 0.0359 -0.0744 -0.0142 149 VAL A N 1069 C CA . VAL A 149 ? 1.3946 1.1898 0.7522 0.0382 -0.0856 -0.0428 149 VAL A CA 1070 C C . VAL A 149 ? 1.3525 1.1637 0.7426 0.0178 -0.0624 -0.0627 149 VAL A C 1071 O O . VAL A 149 ? 1.3800 1.1979 0.7349 0.0178 -0.0569 -0.0777 149 VAL A O 1072 C CB . VAL A 149 ? 1.3596 1.1924 0.7471 0.0501 -0.1205 -0.0599 149 VAL A CB 1073 C CG1 . VAL A 149 ? 1.3349 1.2092 0.7349 0.0379 -0.1323 -0.0910 149 VAL A CG1 1074 C CG2 . VAL A 149 ? 1.4154 1.2431 0.7565 0.0793 -0.1456 -0.0433 149 VAL A CG2 1075 N N . LEU A 150 ? 1.2959 1.1083 0.7461 0.0043 -0.0507 -0.0636 150 LEU A N 1076 C CA . LEU A 150 ? 1.2547 1.0832 0.7393 -0.0098 -0.0305 -0.0816 150 LEU A CA 1077 C C . LEU A 150 ? 1.2857 1.1075 0.7513 -0.0150 0.0052 -0.0660 150 LEU A C 1078 O O . LEU A 150 ? 1.2831 1.1173 0.7463 -0.0149 0.0228 -0.0819 150 LEU A O 1079 C CB . LEU A 150 ? 1.1863 1.0235 0.7399 -0.0186 -0.0330 -0.0878 150 LEU A CB 1080 N N . ASN A 151 ? 1.3233 1.1250 0.7734 -0.0183 0.0163 -0.0332 151 ASN A N 1081 C CA . ASN A 151 ? 1.3581 1.1654 0.7960 -0.0258 0.0531 -0.0102 151 ASN A CA 1082 C C . ASN A 151 ? 1.4286 1.2354 0.7895 -0.0078 0.0655 -0.0087 151 ASN A C 1083 O O . ASN A 151 ? 1.4620 1.2840 0.8060 -0.0068 0.1004 0.0070 151 ASN A O 1084 C CB . ASN A 151 ? 1.3832 1.1661 0.8334 -0.0433 0.0599 0.0283 151 ASN A CB 1085 C CG . ASN A 151 ? 1.3212 1.1053 0.8447 -0.0632 0.0533 0.0260 151 ASN A CG 1086 N N . ALA A 152 ? 1.4557 1.2502 0.7698 0.0080 0.0362 -0.0248 152 ALA A N 1087 C CA . ALA A 152 ? 1.5287 1.3178 0.7609 0.0277 0.0388 -0.0309 152 ALA A CA 1088 C C . ALA A 152 ? 1.5288 1.3301 0.7504 0.0339 0.0512 -0.0630 152 ALA A C 1089 O O . ALA A 152 ? 1.5976 1.3941 0.7537 0.0516 0.0712 -0.0628 152 ALA A O 1090 C CB . ALA A 152 ? 1.5540 1.3332 0.7468 0.0408 -0.0028 -0.0416 152 ALA A CB 1091 N N . ASP A 153 ? 1.4638 1.2751 0.7429 0.0227 0.0398 -0.0897 153 ASP A N 1092 C CA . ASP A 153 ? 1.4696 1.2795 0.7394 0.0289 0.0498 -0.1203 153 ASP A CA 1093 C C . ASP A 153 ? 1.4566 1.2872 0.7559 0.0321 0.0937 -0.1065 153 ASP A C 1094 O O . ASP A 153 ? 1.3903 1.2396 0.7638 0.0179 0.0995 -0.1032 153 ASP A O 1095 C CB . ASP A 153 ? 1.4136 1.2231 0.7310 0.0145 0.0204 -0.1501 153 ASP A CB 1096 C CG . ASP A 153 ? 1.4324 1.2235 0.7317 0.0202 0.0268 -0.1823 153 ASP A CG 1097 O OD1 . ASP A 153 ? 1.4722 1.2576 0.7357 0.0394 0.0588 -0.1818 153 ASP A OD1 1098 O OD2 . ASP A 153 ? 1.4106 1.1921 0.7304 0.0065 0.0003 -0.2067 153 ASP A OD2 1099 N N . GLN A 154 ? 1.5254 1.3581 0.7651 0.0535 0.1241 -0.0982 154 GLN A N 1100 C CA . GLN A 154 ? 1.5218 1.3887 0.7867 0.0625 0.1685 -0.0840 154 GLN A CA 1101 C C . GLN A 154 ? 1.5113 1.3710 0.7815 0.0774 0.1718 -0.1197 154 GLN A C 1102 O O . GLN A 154 ? 1.4730 1.3669 0.7996 0.0785 0.1961 -0.1129 154 GLN A O 1103 C CB . GLN A 154 ? 1.6058 1.4849 0.8020 0.0856 0.2041 -0.0593 154 GLN A CB 1104 C CG . GLN A 154 ? 1.6207 1.5110 0.8230 0.0680 0.2128 -0.0125 154 GLN A CG 1105 N N . GLY A 155 ? 1.5530 1.3656 0.7626 0.0878 0.1448 -0.1568 155 GLY A N 1106 C CA . GLY A 155 ? 1.5625 1.3466 0.7606 0.1013 0.1426 -0.1926 155 GLY A CA 1107 C C . GLY A 155 ? 1.4733 1.2705 0.7609 0.0813 0.1349 -0.1974 155 GLY A C 1108 O O . GLY A 155 ? 1.4715 1.2697 0.7723 0.0980 0.1540 -0.2080 155 GLY A O 1109 N N . THR A 156 ? 1.4065 1.2130 0.7497 0.0508 0.1072 -0.1897 156 THR A N 1110 C CA . THR A 156 ? 1.3219 1.1443 0.7481 0.0331 0.1002 -0.1902 156 THR A CA 1111 C C . THR A 156 ? 1.2787 1.1503 0.7656 0.0322 0.1305 -0.1602 156 THR A C 1112 O O . THR A 156 ? 1.2453 1.1344 0.7764 0.0374 0.1437 -0.1636 156 THR A O 1113 C CB . THR A 156 ? 1.2729 1.0949 0.7344 0.0071 0.0634 -0.1894 156 THR A CB 1114 O OG1 . THR A 156 ? 1.3094 1.0981 0.7303 0.0015 0.0326 -0.2167 156 THR A OG1 1115 C CG2 . THR A 156 ? 1.1916 1.0324 0.7327 -0.0059 0.0603 -0.1862 156 THR A CG2 1116 N N . SER A 157 ? 1.2874 1.1797 0.7741 0.0244 0.1394 -0.1296 157 SER A N 1117 C CA . SER A 157 ? 1.2588 1.1970 0.8021 0.0141 0.1644 -0.0965 157 SER A CA 1118 C C . SER A 157 ? 1.2746 1.2514 0.8247 0.0369 0.2025 -0.0941 157 SER A C 1119 O O . SER A 157 ? 1.2338 1.2576 0.8521 0.0283 0.2173 -0.0773 157 SER A O 1120 C CB . SER A 157 ? 1.2962 1.2372 0.8152 0.0038 0.1708 -0.0627 157 SER A CB 1121 O OG . SER A 157 ? 1.2573 1.2127 0.8392 -0.0243 0.1659 -0.0363 157 SER A OG 1122 N N . ALA A 158 ? 1.3394 1.2966 0.8160 0.0686 0.2160 -0.1122 158 ALA A N 1123 C CA . ALA A 158 ? 1.3688 1.3570 0.8370 0.1026 0.2523 -0.1145 158 ALA A CA 1124 C C . ALA A 158 ? 1.3290 1.3079 0.8348 0.1107 0.2436 -0.1399 158 ALA A C 1125 O O . ALA A 158 ? 1.2930 1.3269 0.8618 0.1155 0.2631 -0.1262 158 ALA A O 1126 C CB . ALA A 158 ? 1.4671 1.4204 0.8296 0.1398 0.2651 -0.1313 158 ALA A CB 1127 N N . THR A 159 ? 1.3400 1.2515 0.8082 0.1103 0.2128 -0.1744 159 THR A N 1128 C CA . THR A 159 ? 1.3204 1.2064 0.8073 0.1192 0.2036 -0.1988 159 THR A CA 1129 C C . THR A 159 ? 1.2284 1.1539 0.8115 0.0961 0.1957 -0.1852 159 THR A C 1130 O O . THR A 159 ? 1.2128 1.1423 0.8223 0.1115 0.2010 -0.1943 159 THR A O 1131 C CB . THR A 159 ? 1.3574 1.1614 0.7878 0.1121 0.1686 -0.2338 159 THR A CB 1132 O OG1 . THR A 159 ? 1.3544 1.1481 0.7711 0.0841 0.1423 -0.2299 159 THR A OG1 1133 C CG2 . THR A 159 ? 1.4640 1.2120 0.7974 0.1501 0.1786 -0.2603 159 THR A CG2 1134 N N . VAL A 160 ? 1.1782 1.1266 0.8055 0.0629 0.1817 -0.1643 160 VAL A N 1135 C CA . VAL A 160 ? 1.1025 1.0848 0.8127 0.0418 0.1724 -0.1509 160 VAL A CA 1136 C C . VAL A 160 ? 1.0912 1.1438 0.8515 0.0502 0.2022 -0.1277 160 VAL A C 1137 O O . VAL A 160 ? 1.0568 1.1344 0.8652 0.0571 0.2029 -0.1309 160 VAL A O 1138 C CB . VAL A 160 ? 1.0712 1.0473 0.8026 0.0088 0.1479 -0.1360 160 VAL A CB 1139 C CG1 . VAL A 160 ? 1.0108 1.0229 0.8178 -0.0109 0.1429 -0.1176 160 VAL A CG1 1140 C CG2 . VAL A 160 ? 1.0611 0.9890 0.7700 0.0008 0.1156 -0.1582 160 VAL A CG2 1141 N N . GLN A 161 ? 1.1242 1.2132 0.8732 0.0499 0.2267 -0.1023 161 GLN A N 1142 C CA . GLN A 161 ? 1.1199 1.2917 0.9215 0.0535 0.2578 -0.0736 161 GLN A CA 1143 C C . GLN A 161 ? 1.1324 1.3331 0.9351 0.0966 0.2802 -0.0876 161 GLN A C 1144 O O . GLN A 161 ? 1.0995 1.3683 0.9713 0.0980 0.2902 -0.0735 161 GLN A O 1145 C CB . GLN A 161 ? 1.1712 1.3732 0.9443 0.0510 0.2858 -0.0431 161 GLN A CB 1146 C CG . GLN A 161 ? 1.1637 1.3505 0.9500 0.0071 0.2684 -0.0177 161 GLN A CG 1147 C CD . GLN A 161 ? 1.2309 1.4234 0.9629 0.0096 0.2930 0.0083 161 GLN A CD 1148 O OE1 . GLN A 161 ? 1.2618 1.5201 1.0015 0.0217 0.3322 0.0344 161 GLN A OE1 1149 N NE2 . GLN A 161 ? 1.2536 1.3823 0.9297 0.0007 0.2710 0.0036 161 GLN A NE2 1150 N N . MET A 162 ? 1.1872 1.3322 0.9097 0.1326 0.2850 -0.1158 162 MET A N 1151 C CA . MET A 162 ? 1.2183 1.3645 0.9212 0.1808 0.3025 -0.1344 162 MET A CA 1152 C C . MET A 162 ? 1.1607 1.3093 0.9231 0.1766 0.2831 -0.1441 162 MET A C 1153 O O . MET A 162 ? 1.1508 1.3625 0.9581 0.2010 0.3011 -0.1350 162 MET A O 1154 C CB . MET A 162 ? 1.2968 1.3501 0.8928 0.2106 0.2972 -0.1692 162 MET A CB 1155 N N . LEU A 163 ? 1.1257 1.2125 0.8887 0.1477 0.2471 -0.1604 163 LEU A N 1156 C CA . LEU A 163 ? 1.0767 1.1567 0.8861 0.1433 0.2271 -0.1693 163 LEU A CA 1157 C C . LEU A 163 ? 1.0136 1.1737 0.9154 0.1210 0.2244 -0.1438 163 LEU A C 1158 O O . LEU A 163 ? 0.9921 1.1865 0.9357 0.1377 0.2250 -0.1441 163 LEU A O 1159 C CB . LEU A 163 ? 1.0585 1.0625 0.8456 0.1170 0.1925 -0.1882 163 LEU A CB 1160 N N . LEU A 164 ? 0.9939 1.1787 0.9224 0.0836 0.2191 -0.1220 164 LEU A N 1161 C CA . LEU A 164 ? 0.9480 1.1933 0.9571 0.0530 0.2095 -0.0986 164 LEU A CA 1162 C C . LEU A 164 ? 0.9560 1.3019 1.0165 0.0646 0.2390 -0.0734 164 LEU A C 1163 O O . LEU A 164 ? 0.9261 1.3243 1.0468 0.0680 0.2331 -0.0697 164 LEU A O 1164 C CB . LEU A 164 ? 0.9404 1.1637 0.9511 0.0098 0.1924 -0.0830 164 LEU A CB 1165 N N . ASN A 165 ? 1.0004 1.3791 1.0370 0.0722 0.2708 -0.0549 165 ASN A N 1166 C CA . ASN A 165 ? 1.0141 1.5045 1.1042 0.0805 0.3038 -0.0237 165 ASN A CA 1167 C C . ASN A 165 ? 1.0269 1.5677 1.1263 0.1359 0.3250 -0.0336 165 ASN A C 1168 O O . ASN A 165 ? 1.0106 1.6561 1.1861 0.1372 0.3368 -0.0108 165 ASN A O 1169 C CB . ASN A 165 ? 1.0676 1.5804 1.1191 0.0819 0.3378 0.0004 165 ASN A CB 1170 C CG . ASN A 165 ? 1.0695 1.5541 1.1237 0.0268 0.3222 0.0225 165 ASN A CG 1171 O OD1 . ASN A 165 ? 1.0520 1.4561 1.0870 0.0033 0.2865 0.0053 165 ASN A OD1 1172 N ND2 . ASN A 165 ? 1.1065 1.6584 1.1817 0.0088 0.3510 0.0634 165 ASN A ND2 1173 N N . ASP A 166 ? 1.0647 1.5311 1.0863 0.1815 0.3283 -0.0665 166 ASP A N 1174 C CA . ASP A 166 ? 1.1025 1.6024 1.1095 0.2453 0.3541 -0.0755 166 ASP A CA 1175 C C . ASP A 166 ? 1.1123 1.5282 1.0779 0.2778 0.3344 -0.1115 166 ASP A C 1176 O O . ASP A 166 ? 1.1206 1.5780 1.1081 0.3199 0.3436 -0.1134 166 ASP A O 1177 C CB . ASP A 166 ? 1.1808 1.6879 1.1170 0.2879 0.3949 -0.0723 166 ASP A CB 1178 N N . THR A 167 ? 1.1161 1.4188 1.0234 0.2590 0.3078 -0.1370 167 THR A N 1179 C CA . THR A 167 ? 1.1404 1.3533 0.9986 0.2857 0.2914 -0.1681 167 THR A CA 1180 C C . THR A 167 ? 1.0803 1.3037 1.0000 0.2712 0.2650 -0.1681 167 THR A C 1181 O O . THR A 167 ? 1.1025 1.3142 1.0133 0.3116 0.2669 -0.1784 167 THR A O 1182 C CB . THR A 167 ? 1.1780 1.2721 0.9521 0.2698 0.2728 -0.1938 167 THR A CB 1183 O OG1 . THR A 167 ? 1.2447 1.3263 0.9527 0.2882 0.2951 -0.1960 167 THR A OG1 1184 C CG2 . THR A 167 ? 1.2199 1.2187 0.9390 0.2957 0.2592 -0.2221 167 THR A CG2 1185 N N . CYS A 168 ? 1.0141 1.2545 0.9882 0.2185 0.2404 -0.1569 168 CYS A N 1186 C CA . CYS A 168 ? 0.9636 1.2088 0.9872 0.2052 0.2129 -0.1584 168 CYS A CA 1187 C C . CYS A 168 ? 0.9514 1.2818 1.0307 0.2379 0.2215 -0.1478 168 CYS A C 1188 O O . CYS A 168 ? 0.9532 1.2564 1.0265 0.2627 0.2098 -0.1596 168 CYS A O 1189 C CB . CYS A 168 ? 0.9102 1.1614 0.9774 0.1491 0.1858 -0.1479 168 CYS A CB 1190 S SG . CYS A 168 ? 0.8815 1.2477 1.0496 0.1189 0.1800 -0.1177 168 CYS A SG 1191 N N . PRO A 169 ? 0.9429 1.3810 1.0773 0.2381 0.2419 -0.1230 169 PRO A N 1192 C CA . PRO A 169 ? 0.9328 1.4669 1.1290 0.2685 0.2470 -0.1113 169 PRO A CA 1193 C C . PRO A 169 ? 0.9917 1.5156 1.1378 0.3427 0.2728 -0.1235 169 PRO A C 1194 O O . PRO A 169 ? 0.9919 1.5483 1.1631 0.3774 0.2666 -0.1250 169 PRO A O 1195 C CB . PRO A 169 ? 0.9175 1.5727 1.1866 0.2418 0.2637 -0.0778 169 PRO A CB 1196 C CG . PRO A 169 ? 0.9495 1.5657 1.1640 0.2300 0.2856 -0.0746 169 PRO A CG 1197 C CD . PRO A 169 ? 0.9459 1.4306 1.0941 0.2093 0.2601 -0.1009 169 PRO A CD 1198 N N . LEU A 170 ? 1.0482 1.5216 1.1176 0.3697 0.2993 -0.1331 170 LEU A N 1199 C CA . LEU A 170 ? 1.1230 1.5575 1.1220 0.4436 0.3219 -0.1496 170 LEU A CA 1200 C C . LEU A 170 ? 1.1417 1.4542 1.0841 0.4560 0.2967 -0.1763 170 LEU A C 1201 O O . LEU A 170 ? 1.2076 1.4804 1.1002 0.5165 0.3063 -0.1889 170 LEU A O 1202 C CB . LEU A 170 ? 1.1934 1.5840 1.1099 0.4649 0.3503 -0.1574 170 LEU A CB 1203 N N . PHE A 171 ? 1.0875 1.3416 1.0367 0.3996 0.2655 -0.1825 171 PHE A N 1204 C CA . PHE A 171 ? 1.0959 1.2446 1.0022 0.3990 0.2415 -0.2013 171 PHE A CA 1205 C C . PHE A 171 ? 1.0383 1.2361 1.0117 0.3938 0.2197 -0.1918 171 PHE A C 1206 O O . PHE A 171 ? 1.0729 1.2390 1.0234 0.4348 0.2165 -0.1982 171 PHE A O 1207 C CB . PHE A 171 ? 1.0820 1.1461 0.9536 0.3452 0.2226 -0.2122 171 PHE A CB 1208 C CG . PHE A 171 ? 1.0947 1.0596 0.9283 0.3364 0.1999 -0.2264 171 PHE A CG 1209 C CD1 . PHE A 171 ? 1.1751 1.0535 0.9371 0.3790 0.2051 -0.2414 171 PHE A CD1 1210 C CD2 . PHE A 171 ? 1.0351 0.9895 0.8997 0.2865 0.1743 -0.2232 171 PHE A CD2 1211 C CE1 . PHE A 171 ? 1.1960 0.9824 0.9237 0.3653 0.1857 -0.2494 171 PHE A CE1 1212 C CE2 . PHE A 171 ? 1.0523 0.9257 0.8850 0.2776 0.1571 -0.2315 171 PHE A CE2 1213 C CZ . PHE A 171 ? 1.1348 0.9253 0.9015 0.3136 0.1631 -0.2430 171 PHE A CZ 1214 N N . VAL A 172 ? 0.9605 1.2287 1.0093 0.3452 0.2031 -0.1769 172 VAL A N 1215 C CA . VAL A 172 ? 0.9078 1.2204 1.0173 0.3341 0.1763 -0.1700 172 VAL A CA 1216 C C . VAL A 172 ? 0.9181 1.3181 1.0676 0.3846 0.1840 -0.1606 172 VAL A C 1217 O O . VAL A 172 ? 0.9250 1.3068 1.0702 0.4100 0.1680 -0.1655 172 VAL A O 1218 C CB . VAL A 172 ? 0.8431 1.2090 1.0187 0.2727 0.1556 -0.1569 172 VAL A CB 1219 C CG1 . VAL A 172 ? 0.8071 1.2223 1.0411 0.2657 0.1255 -0.1519 172 VAL A CG1 1220 C CG2 . VAL A 172 ? 0.8295 1.1076 0.9647 0.2307 0.1431 -0.1666 172 VAL A CG2 1221 N N . ARG A 173 ? 0.9206 1.4202 1.1082 0.4013 0.2091 -0.1450 173 ARG A N 1222 C CA . ARG A 173 ? 0.9345 1.5348 1.1640 0.4556 0.2203 -0.1336 173 ARG A CA 1223 C C . ARG A 173 ? 1.0055 1.5237 1.1545 0.5264 0.2308 -0.1507 173 ARG A C 1224 O O . ARG A 173 ? 1.0212 1.5896 1.1909 0.5754 0.2280 -0.1462 173 ARG A O 1225 C CB . ARG A 173 ? 0.9409 1.6595 1.2145 0.4662 0.2537 -0.1120 173 ARG A CB 1226 N N . GLY A 174 ? 1.0535 1.4416 1.1086 0.5300 0.2401 -0.1699 174 GLY A N 1227 C CA . GLY A 174 ? 1.1357 1.4098 1.0992 0.5843 0.2444 -0.1879 174 GLY A CA 1228 C C . GLY A 174 ? 1.1219 1.3326 1.0775 0.5745 0.2141 -0.1927 174 GLY A C 1229 O O . GLY A 174 ? 1.1743 1.3603 1.1007 0.6295 0.2136 -0.1944 174 GLY A O 1230 N N . LEU A 175 ? 1.0585 1.2431 1.0356 0.5093 0.1902 -0.1933 175 LEU A N 1231 C CA . LEU A 175 ? 1.0460 1.1745 1.0136 0.4979 0.1636 -0.1957 175 LEU A CA 1232 C C . LEU A 175 ? 1.0196 1.2394 1.0486 0.5226 0.1470 -0.1841 175 LEU A C 1233 O O . LEU A 175 ? 1.0607 1.2365 1.0555 0.5617 0.1395 -0.1853 175 LEU A O 1234 C CB . LEU A 175 ? 0.9880 1.0822 0.9668 0.4286 0.1441 -0.1978 175 LEU A CB 1235 C CG . LEU A 175 ? 1.0165 0.9990 0.9261 0.4017 0.1494 -0.2102 175 LEU A CG 1236 C CD1 . LEU A 175 ? 0.9445 0.9359 0.8856 0.3379 0.1334 -0.2084 175 LEU A CD1 1237 C CD2 . LEU A 175 ? 1.0731 0.9421 0.9122 0.4200 0.1451 -0.2167 175 LEU A CD2 1238 N N . LEU A 176 ? 0.9584 1.3026 1.0756 0.4978 0.1393 -0.1719 176 LEU A N 1239 C CA . LEU A 176 ? 0.9349 1.3831 1.1203 0.5155 0.1190 -0.1610 176 LEU A CA 1240 C C . LEU A 176 ? 0.9985 1.4683 1.1623 0.5958 0.1334 -0.1585 176 LEU A C 1241 O O . LEU A 176 ? 1.0139 1.4850 1.1756 0.6269 0.1141 -0.1573 176 LEU A O 1242 C CB . LEU A 176 ? 0.8774 1.4610 1.1602 0.4769 0.1140 -0.1456 176 LEU A CB 1243 C CG . LEU A 176 ? 0.8201 1.3996 1.1378 0.4006 0.0886 -0.1451 176 LEU A CG 1244 N N . GLU A 177 ? 1.0443 1.5278 1.1855 0.6338 0.1676 -0.1576 177 GLU A N 1245 C CA . GLU A 177 ? 1.1218 1.6180 1.2306 0.7200 0.1858 -0.1563 177 GLU A CA 1246 C C . GLU A 177 ? 1.2049 1.5412 1.2052 0.7581 0.1843 -0.1705 177 GLU A C 1247 O O . GLU A 177 ? 1.2653 1.5984 1.2396 0.8260 0.1843 -0.1679 177 GLU A O 1248 C CB . GLU A 177 ? 1.1587 1.7022 1.2593 0.7545 0.2252 -0.1530 177 GLU A CB 1249 N N . ALA A 178 ? 1.2134 1.4202 1.1520 0.7134 0.1822 -0.1833 178 ALA A N 1250 C CA . ALA A 178 ? 1.2963 1.3448 1.1331 0.7354 0.1805 -0.1937 178 ALA A CA 1251 C C . ALA A 178 ? 1.2798 1.3130 1.1252 0.7312 0.1528 -0.1863 178 ALA A C 1252 O O . ALA A 178 ? 1.3444 1.3507 1.1531 0.7916 0.1510 -0.1821 178 ALA A O 1253 C CB . ALA A 178 ? 1.3102 1.2421 1.0895 0.6826 0.1844 -0.2069 178 ALA A CB 1254 N N . GLY A 179 ? 1.2000 1.2497 1.0886 0.6648 0.1316 -0.1844 179 GLY A N 1255 C CA . GLY A 179 ? 1.1872 1.2190 1.0769 0.6584 0.1059 -0.1783 179 GLY A CA 1256 C C . GLY A 179 ? 1.1353 1.2998 1.1062 0.6700 0.0825 -0.1697 179 GLY A C 1257 O O . GLY A 179 ? 1.0838 1.2713 1.0876 0.6317 0.0564 -0.1684 179 GLY A O 1258 N N . LYS A 180 ? 1.1562 1.4095 1.1577 0.7245 0.0904 -0.1641 180 LYS A N 1259 C CA . LYS A 180 ? 1.1163 1.5052 1.1986 0.7379 0.0650 -0.1549 180 LYS A CA 1260 C C . LYS A 180 ? 1.1490 1.4937 1.1953 0.7654 0.0396 -0.1523 180 LYS A C 1261 O O . LYS A 180 ? 1.1048 1.5108 1.1994 0.7408 0.0064 -0.1509 180 LYS A O 1262 C CB . LYS A 180 ? 1.1417 1.6403 1.2619 0.7982 0.0823 -0.1465 180 LYS A CB 1263 N N . SER A 181 ? 1.2370 1.4660 1.1910 0.8155 0.0543 -0.1517 181 SER A N 1264 C CA . SER A 181 ? 1.2861 1.4599 1.1907 0.8501 0.0358 -0.1451 181 SER A CA 1265 C C . SER A 181 ? 1.2537 1.3621 1.1391 0.7932 0.0188 -0.1463 181 SER A C 1266 O O . SER A 181 ? 1.2528 1.3800 1.1396 0.8035 -0.0078 -0.1415 181 SER A O 1267 C CB . SER A 181 ? 1.4024 1.4545 1.2054 0.9156 0.0584 -0.1414 181 SER A CB 1268 N N . ASP A 182 ? 1.2330 1.2687 1.0980 0.7376 0.0340 -0.1525 182 ASP A N 1269 C CA . ASP A 182 ? 1.2000 1.1865 1.0528 0.6838 0.0217 -0.1525 182 ASP A CA 1270 C C . ASP A 182 ? 1.1123 1.1991 1.0436 0.6392 -0.0059 -0.1585 182 ASP A C 1271 O O . ASP A 182 ? 1.1005 1.1792 1.0244 0.6263 -0.0279 -0.1575 182 ASP A O 1272 C CB . ASP A 182 ? 1.2090 1.0945 1.0187 0.6396 0.0446 -0.1559 182 ASP A CB 1273 C CG . ASP A 182 ? 1.2785 1.0388 1.0052 0.6441 0.0522 -0.1448 182 ASP A CG 1274 O OD1 . ASP A 182 ? 1.3154 1.0651 1.0156 0.6790 0.0406 -0.1335 182 ASP A OD1 1275 O OD2 . ASP A 182 ? 1.3001 0.9741 0.9879 0.6106 0.0689 -0.1457 182 ASP A OD2 1276 N N . LEU A 183 ? 1.0615 1.2369 1.0618 0.6166 -0.0047 -0.1639 183 LEU A N 1277 C CA . LEU A 183 ? 0.9921 1.2529 1.0649 0.5687 -0.0323 -0.1687 183 LEU A CA 1278 C C . LEU A 183 ? 0.9920 1.3443 1.1077 0.5944 -0.0681 -0.1668 183 LEU A C 1279 O O . LEU A 183 ? 0.9572 1.3471 1.1076 0.5589 -0.1009 -0.1727 183 LEU A O 1280 C CB . LEU A 183 ? 0.9463 1.2697 1.0772 0.5327 -0.0183 -0.1702 183 LEU A CB 1281 N N . GLU A 184 ? 1.0231 0.9804 1.1420 0.2958 0.1960 -0.2430 184 GLU A N 1282 C CA . GLU A 184 ? 0.9869 1.0139 1.1699 0.3221 0.1925 -0.2247 184 GLU A CA 1283 C C . GLU A 184 ? 0.9765 0.9610 1.1771 0.3376 0.1653 -0.2009 184 GLU A C 1284 O O . GLU A 184 ? 0.9521 0.9884 1.2020 0.3614 0.1575 -0.1844 184 GLU A O 1285 C CB . GLU A 184 ? 1.0289 1.1044 1.2433 0.3685 0.2206 -0.2479 184 GLU A CB 1286 N N . LYS A 185 ? 0.9989 0.8930 1.1574 0.3210 0.1508 -0.1991 185 LYS A N 1287 C CA . LYS A 185 ? 1.0056 0.8448 1.1677 0.3313 0.1286 -0.1782 185 LYS A CA 1288 C C . LYS A 185 ? 0.9319 0.8211 1.1254 0.3119 0.1070 -0.1454 185 LYS A C 1289 O O . LYS A 185 ? 0.8827 0.7938 1.0668 0.2709 0.0999 -0.1369 185 LYS A O 1290 C CB . LYS A 185 ? 1.0467 0.7861 1.1550 0.3067 0.1212 -0.1860 185 LYS A CB 1291 C CG . LYS A 185 ? 1.0949 0.7540 1.1929 0.3242 0.1079 -0.1732 185 LYS A CG 1292 C CD . LYS A 185 ? 1.1434 0.7085 1.1876 0.2930 0.1046 -0.1853 185 LYS A CD 1293 N N . GLN A 186 ? 0.9334 0.8367 1.1602 0.3439 0.0959 -0.1277 186 GLN A N 1294 C CA . GLN A 186 ? 0.8728 0.8248 1.1285 0.3298 0.0755 -0.0983 186 GLN A CA 1295 C C . GLN A 186 ? 0.8846 0.7632 1.1167 0.3214 0.0545 -0.0777 186 GLN A C 1296 O O . GLN A 186 ? 0.9476 0.7557 1.1620 0.3492 0.0524 -0.0780 186 GLN A O 1297 C CB . GLN A 186 ? 0.8669 0.8988 1.1771 0.3681 0.0746 -0.0916 186 GLN A CB 1298 C CG . GLN A 186 ? 0.8502 0.9742 1.1923 0.3712 0.0974 -0.1103 186 GLN A CG 1299 C CD . GLN A 186 ? 0.7901 0.9716 1.1336 0.3199 0.0981 -0.1033 186 GLN A CD 1300 O OE1 . GLN A 186 ? 0.7480 0.9373 1.0939 0.2943 0.0782 -0.0807 186 GLN A OE1 1301 N NE2 . GLN A 186 ? 0.7950 1.0113 1.1312 0.3049 0.1220 -0.1230 186 GLN A NE2 1302 N N . GLU A 187 ? 0.8318 0.7235 1.0597 0.2827 0.0407 -0.0603 187 GLU A N 1303 C CA . GLU A 187 ? 0.8434 0.6744 1.0484 0.2685 0.0240 -0.0415 187 GLU A CA 1304 C C . GLU A 187 ? 0.7964 0.6731 1.0228 0.2592 0.0061 -0.0150 187 GLU A C 1305 O O . GLU A 187 ? 0.7445 0.6867 0.9893 0.2384 0.0052 -0.0122 187 GLU A O 1306 C CB . GLU A 187 ? 0.8380 0.6229 1.0071 0.2277 0.0253 -0.0502 187 GLU A CB 1307 C CG . GLU A 187 ? 0.9042 0.6308 1.0421 0.2301 0.0395 -0.0770 187 GLU A CG 1308 C CD . GLU A 187 ? 0.9979 0.6475 1.1178 0.2627 0.0422 -0.0796 187 GLU A CD 1309 O OE1 . GLU A 187 ? 1.0533 0.6761 1.1611 0.2852 0.0575 -0.1031 187 GLU A OE1 1310 O OE2 . GLU A 187 ? 1.0259 0.6364 1.1386 0.2664 0.0297 -0.0582 187 GLU A OE2 1311 N N . LYS A 188 ? 0.8260 0.6605 1.0425 0.2728 -0.0077 0.0042 188 LYS A N 1312 C CA . LYS A 188 ? 0.7918 0.6602 1.0201 0.2652 -0.0261 0.0294 188 LYS A CA 1313 C C . LYS A 188 ? 0.7515 0.6076 0.9584 0.2189 -0.0305 0.0364 188 LYS A C 1314 O O . LYS A 188 ? 0.7762 0.5676 0.9515 0.2015 -0.0282 0.0352 188 LYS A O 1315 C CB . LYS A 188 ? 0.8506 0.6719 1.0669 0.2974 -0.0400 0.0488 188 LYS A CB 1316 C CG . LYS A 188 ? 0.9049 0.7190 1.1357 0.3512 -0.0360 0.0409 188 LYS A CG 1317 N N . PRO A 189 ? 0.6936 0.6126 0.9177 0.1983 -0.0357 0.0421 189 PRO A N 1318 C CA . PRO A 189 ? 0.6664 0.5706 0.8702 0.1627 -0.0407 0.0496 189 PRO A CA 1319 C C . PRO A 189 ? 0.6897 0.5634 0.8766 0.1631 -0.0543 0.0717 189 PRO A C 1320 O O . PRO A 189 ? 0.7096 0.5976 0.9064 0.1880 -0.0656 0.0855 189 PRO A O 1321 C CB . PRO A 189 ? 0.6140 0.5850 0.8354 0.1446 -0.0421 0.0491 189 PRO A CB 1322 C CG . PRO A 189 ? 0.6150 0.6430 0.8694 0.1688 -0.0432 0.0494 189 PRO A CG 1323 C CD . PRO A 189 ? 0.6576 0.6589 0.9163 0.2016 -0.0339 0.0381 189 PRO A CD 1324 N N . VAL A 190 ? 0.6902 0.5253 0.8510 0.1360 -0.0530 0.0746 190 VAL A N 1325 C CA . VAL A 190 ? 0.7090 0.5162 0.8466 0.1279 -0.0623 0.0948 190 VAL A CA 1326 C C . VAL A 190 ? 0.6619 0.5048 0.7991 0.0989 -0.0642 0.0961 190 VAL A C 1327 O O . VAL A 190 ? 0.6294 0.4871 0.7722 0.0817 -0.0562 0.0813 190 VAL A O 1328 C CB . VAL A 190 ? 0.7577 0.4889 0.8621 0.1161 -0.0549 0.0955 190 VAL A CB 1329 C CG1 . VAL A 190 ? 0.8052 0.4949 0.8802 0.1223 -0.0646 0.1200 190 VAL A CG1 1330 C CG2 . VAL A 190 ? 0.7880 0.4790 0.8903 0.1316 -0.0453 0.0795 190 VAL A CG2 1331 N N . ALA A 191 ? 0.6643 0.5175 0.7908 0.0952 -0.0755 0.1133 191 ALA A N 1332 C CA . ALA A 191 ? 0.6295 0.5129 0.7522 0.0706 -0.0767 0.1124 191 ALA A CA 1333 C C . ALA A 191 ? 0.6546 0.5141 0.7454 0.0548 -0.0802 0.1265 191 ALA A C 1334 O O . ALA A 191 ? 0.6974 0.5294 0.7688 0.0652 -0.0883 0.1437 191 ALA A O 1335 C CB . ALA A 191 ? 0.6032 0.5457 0.7481 0.0747 -0.0854 0.1119 191 ALA A CB 1336 N N . TRP A 192 ? 0.6347 0.5030 0.7173 0.0313 -0.0733 0.1189 192 TRP A N 1337 C CA . TRP A 192 ? 0.6587 0.5112 0.7103 0.0133 -0.0719 0.1275 192 TRP A CA 1338 C C . TRP A 192 ? 0.6319 0.5106 0.6808 -0.0031 -0.0683 0.1170 192 TRP A C 1339 O O . TRP A 192 ? 0.6018 0.5002 0.6697 -0.0031 -0.0647 0.1026 192 TRP A O 1340 C CB . TRP A 192 ? 0.6915 0.5000 0.7252 0.0013 -0.0588 0.1282 192 TRP A CB 1341 C CG . TRP A 192 ? 0.6643 0.4779 0.7144 -0.0115 -0.0443 0.1081 192 TRP A CG 1342 C CD1 . TRP A 192 ? 0.6562 0.4815 0.7028 -0.0308 -0.0331 0.0986 192 TRP A CD1 1343 C CD2 . TRP A 192 ? 0.6563 0.4669 0.7282 -0.0046 -0.0406 0.0945 192 TRP A CD2 1344 N NE1 . TRP A 192 ? 0.6372 0.4726 0.7058 -0.0352 -0.0254 0.0808 192 TRP A NE1 1345 C CE2 . TRP A 192 ? 0.6409 0.4649 0.7221 -0.0214 -0.0302 0.0782 192 TRP A CE2 1346 C CE3 . TRP A 192 ? 0.6640 0.4646 0.7479 0.0153 -0.0450 0.0930 192 TRP A CE3 1347 C CZ2 . TRP A 192 ? 0.6325 0.4593 0.7313 -0.0213 -0.0268 0.0617 192 TRP A CZ2 1348 C CZ3 . TRP A 192 ? 0.6521 0.4502 0.7501 0.0145 -0.0384 0.0754 192 TRP A CZ3 1349 C CH2 . TRP A 192 ? 0.6405 0.4510 0.7442 -0.0049 -0.0307 0.0605 192 TRP A CH2 1350 N N . LEU A 193 ? 0.6530 0.5262 0.6725 -0.0162 -0.0692 0.1241 193 LEU A N 1351 C CA . LEU A 193 ? 0.6376 0.5263 0.6467 -0.0296 -0.0653 0.1133 193 LEU A CA 1352 C C . LEU A 193 ? 0.6484 0.5237 0.6414 -0.0436 -0.0482 0.1054 193 LEU A C 1353 O O . LEU A 193 ? 0.6743 0.5293 0.6587 -0.0497 -0.0396 0.1112 193 LEU A O 1354 C CB . LEU A 193 ? 0.6555 0.5562 0.6420 -0.0349 -0.0796 0.1227 193 LEU A CB 1355 C CG . LEU A 193 ? 0.6532 0.5815 0.6568 -0.0233 -0.0986 0.1319 193 LEU A CG 1356 C CD1 . LEU A 193 ? 0.6768 0.6209 0.6543 -0.0348 -0.1137 0.1390 193 LEU A CD1 1357 C CD2 . LEU A 193 ? 0.6223 0.5762 0.6584 -0.0194 -0.0968 0.1190 193 LEU A CD2 1358 N N . SER A 194 ? 0.6353 0.5214 0.6236 -0.0487 -0.0423 0.0914 194 SER A N 1359 C CA . SER A 194 ? 0.6485 0.5327 0.6238 -0.0584 -0.0254 0.0809 194 SER A CA 1360 C C . SER A 194 ? 0.6459 0.5347 0.6092 -0.0571 -0.0246 0.0674 194 SER A C 1361 O O . SER A 194 ? 0.6381 0.5277 0.6013 -0.0537 -0.0367 0.0676 194 SER A O 1362 C CB . SER A 194 ? 0.6313 0.5251 0.6365 -0.0563 -0.0133 0.0695 194 SER A CB 1363 O OG . SER A 194 ? 0.6095 0.5180 0.6360 -0.0440 -0.0159 0.0552 194 SER A OG 1364 N N . SER A 195 ? 0.6618 0.5521 0.6135 -0.0604 -0.0089 0.0547 195 SER A N 1365 C CA . SER A 195 ? 0.6706 0.5552 0.6075 -0.0544 -0.0062 0.0392 195 SER A CA 1366 C C . SER A 195 ? 0.6727 0.5716 0.6225 -0.0448 0.0117 0.0207 195 SER A C 1367 O O . SER A 195 ? 0.6758 0.5940 0.6387 -0.0511 0.0257 0.0190 195 SER A O 1368 C CB . SER A 195 ? 0.7110 0.5771 0.6012 -0.0674 -0.0096 0.0418 195 SER A CB 1369 O OG . SER A 195 ? 0.7455 0.6098 0.6103 -0.0751 0.0077 0.0355 195 SER A OG 1370 N N . VAL A 196 ? 0.6790 0.5685 0.6241 -0.0296 0.0111 0.0068 196 VAL A N 1371 C CA . VAL A 196 ? 0.6859 0.5924 0.6462 -0.0117 0.0248 -0.0121 196 VAL A CA 1372 C C . VAL A 196 ? 0.7253 0.5983 0.6459 -0.0024 0.0278 -0.0245 196 VAL A C 1373 O O . VAL A 196 ? 0.7384 0.5758 0.6292 -0.0094 0.0151 -0.0186 196 VAL A O 1374 C CB . VAL A 196 ? 0.6578 0.5813 0.6568 0.0070 0.0161 -0.0161 196 VAL A CB 1375 C CG1 . VAL A 196 ? 0.6676 0.6169 0.6865 0.0312 0.0262 -0.0360 196 VAL A CG1 1376 C CG2 . VAL A 196 ? 0.6275 0.5751 0.6594 -0.0048 0.0126 -0.0057 196 VAL A CG2 1377 N N . PRO A 197 ? 0.7506 0.6350 0.6693 0.0119 0.0457 -0.0433 197 PRO A N 1378 C CA . PRO A 197 ? 0.7977 0.6407 0.6768 0.0275 0.0489 -0.0583 197 PRO A CA 1379 C C . PRO A 197 ? 0.7975 0.6122 0.6789 0.0493 0.0334 -0.0590 197 PRO A C 1380 O O . PRO A 197 ? 0.7732 0.6171 0.6942 0.0703 0.0299 -0.0616 197 PRO A O 1381 C CB . PRO A 197 ? 0.8171 0.6925 0.7094 0.0462 0.0726 -0.0797 197 PRO A CB 1382 C CG . PRO A 197 ? 0.7713 0.7113 0.7204 0.0419 0.0781 -0.0762 197 PRO A CG 1383 C CD . PRO A 197 ? 0.7434 0.6777 0.6919 0.0118 0.0659 -0.0525 197 PRO A CD 1384 N N . SER A 198 ? 0.8319 0.5898 0.6675 0.0408 0.0234 -0.0559 198 SER A N 1385 C CA . SER A 198 ? 0.8497 0.5665 0.6725 0.0569 0.0106 -0.0551 198 SER A CA 1386 C C . SER A 198 ? 0.8866 0.5898 0.7074 0.0980 0.0177 -0.0731 198 SER A C 1387 O O . SER A 198 ? 0.9064 0.6253 0.7275 0.1119 0.0349 -0.0898 198 SER A O 1388 C CB . SER A 198 ? 0.8947 0.5503 0.6616 0.0327 0.0027 -0.0510 198 SER A CB 1389 O OG . SER A 198 ? 0.9393 0.5367 0.6755 0.0469 -0.0045 -0.0533 198 SER A OG 1390 N N . SER A 199 ? 0.8989 0.5746 0.7166 0.1191 0.0045 -0.0696 199 SER A N 1391 C CA . SER A 199 ? 0.9508 0.5986 0.7558 0.1636 0.0061 -0.0842 199 SER A CA 1392 C C . SER A 199 ? 1.0337 0.6020 0.7713 0.1680 0.0150 -0.0977 199 SER A C 1393 O O . SER A 199 ? 1.0887 0.6272 0.8099 0.2088 0.0197 -0.1130 199 SER A O 1394 C CB . SER A 199 ? 0.9568 0.5818 0.7612 0.1825 -0.0131 -0.0733 199 SER A CB 1395 N N . ALA A 200 ? 1.0464 0.5821 0.7450 0.1270 0.0165 -0.0930 200 ALA A N 1396 C CA . ALA A 200 ? 1.1326 0.5916 0.7616 0.1205 0.0248 -0.1071 200 ALA A CA 1397 C C . ALA A 200 ? 1.1406 0.6279 0.7647 0.1095 0.0440 -0.1219 200 ALA A C 1398 O O . ALA A 200 ? 1.0803 0.6408 0.7484 0.0941 0.0487 -0.1153 200 ALA A O 1399 C CB . ALA A 200 ? 1.1549 0.5580 0.7373 0.0783 0.0122 -0.0944 200 ALA A CB 1400 N N . HIS A 201 ? 1.2264 0.6487 0.7903 0.1163 0.0559 -0.1420 201 HIS A N 1401 C CA . HIS A 201 ? 1.2497 0.6877 0.7944 0.1047 0.0757 -0.1584 201 HIS A CA 1402 C C . HIS A 201 ? 1.2484 0.6788 0.7602 0.0495 0.0678 -0.1477 201 HIS A C 1403 O O . HIS A 201 ? 1.2935 0.6599 0.7557 0.0244 0.0554 -0.1446 201 HIS A O 1404 C CB . HIS A 201 ? 1.3497 0.7169 0.8378 0.1357 0.0925 -0.1873 201 HIS A CB 1405 C CG . HIS A 201 ? 1.3858 0.7555 0.8383 0.1201 0.1141 -0.2067 201 HIS A CG 1406 N ND1 . HIS A 201 ? 1.3752 0.8063 0.8591 0.1448 0.1392 -0.2238 201 HIS A ND1 1407 C CD2 . HIS A 201 ? 1.4371 0.7575 0.8224 0.0801 0.1148 -0.2125 201 HIS A CD2 1408 C CE1 . HIS A 201 ? 1.4214 0.8367 0.8551 0.1214 0.1558 -0.2386 201 HIS A CE1 1409 N NE2 . HIS A 201 ? 1.4579 0.8056 0.8304 0.0825 0.1398 -0.2321 201 HIS A NE2 1410 N N . GLY A 202 ? 1.2049 0.7009 0.7422 0.0301 0.0746 -0.1419 202 GLY A N 1411 C CA . GLY A 202 ? 1.2074 0.7046 0.7140 -0.0169 0.0654 -0.1314 202 GLY A CA 1412 C C . GLY A 202 ? 1.1495 0.6703 0.6855 -0.0423 0.0405 -0.1045 202 GLY A C 1413 O O . GLY A 202 ? 1.1616 0.6733 0.6687 -0.0791 0.0267 -0.0965 202 GLY A O 1414 N N . HIS A 203 ? 1.0894 0.6448 0.6836 -0.0221 0.0348 -0.0924 203 HIS A N 1415 C CA . HIS A 203 ? 1.0341 0.6168 0.6619 -0.0402 0.0148 -0.0690 203 HIS A CA 1416 C C . HIS A 203 ? 0.9607 0.6159 0.6523 -0.0338 0.0153 -0.0547 203 HIS A C 1417 O O . HIS A 203 ? 0.9483 0.6337 0.6647 -0.0138 0.0310 -0.0627 203 HIS A O 1418 C CB . HIS A 203 ? 1.0413 0.5847 0.6675 -0.0282 0.0053 -0.0667 203 HIS A CB 1419 C CG . HIS A 203 ? 1.1223 0.5864 0.6811 -0.0456 0.0018 -0.0760 203 HIS A CG 1420 N ND1 . HIS A 203 ? 1.1283 0.5785 0.6706 -0.0821 -0.0132 -0.0648 203 HIS A ND1 1421 C CD2 . HIS A 203 ? 1.2047 0.5969 0.7067 -0.0327 0.0123 -0.0966 203 HIS A CD2 1422 C CE1 . HIS A 203 ? 1.2128 0.5840 0.6890 -0.0961 -0.0119 -0.0776 203 HIS A CE1 1423 N NE2 . HIS A 203 ? 1.2598 0.5887 0.7073 -0.0651 0.0031 -0.0969 203 HIS A NE2 1424 N N . ARG A 204 ? 0.9183 0.6005 0.6350 -0.0523 -0.0008 -0.0347 204 ARG A N 1425 C CA . ARG A 204 ? 0.8598 0.5973 0.6290 -0.0493 -0.0023 -0.0201 204 ARG A CA 1426 C C . ARG A 204 ? 0.8211 0.5704 0.6224 -0.0498 -0.0176 -0.0065 204 ARG A C 1427 O O . ARG A 204 ? 0.8362 0.5704 0.6204 -0.0679 -0.0300 -0.0007 204 ARG A O 1428 C CB . ARG A 204 ? 0.8622 0.6206 0.6198 -0.0725 -0.0052 -0.0086 204 ARG A CB 1429 C CG . ARG A 204 ? 0.8848 0.6521 0.6274 -0.0712 0.0143 -0.0171 204 ARG A CG 1430 C CD . ARG A 204 ? 0.8412 0.6505 0.6280 -0.0663 0.0213 -0.0068 204 ARG A CD 1431 N NE . ARG A 204 ? 0.8584 0.6835 0.6479 -0.0575 0.0462 -0.0218 204 ARG A NE 1432 C CZ . ARG A 204 ? 0.8352 0.6980 0.6646 -0.0541 0.0576 -0.0197 204 ARG A CZ 1433 N NH1 . ARG A 204 ? 0.7971 0.6759 0.6619 -0.0571 0.0457 -0.0034 204 ARG A NH1 1434 N NH2 . ARG A 204 ? 0.8599 0.7456 0.6935 -0.0490 0.0822 -0.0357 204 ARG A NH2 1435 N N . GLN A 205 ? 0.7789 0.5579 0.6257 -0.0323 -0.0157 -0.0031 205 GLN A N 1436 C CA . GLN A 205 ? 0.7412 0.5346 0.6174 -0.0328 -0.0279 0.0086 205 GLN A CA 1437 C C . GLN A 205 ? 0.7080 0.5376 0.6105 -0.0435 -0.0323 0.0233 205 GLN A C 1438 O O . GLN A 205 ? 0.7027 0.5509 0.6189 -0.0407 -0.0235 0.0238 205 GLN A O 1439 C CB . GLN A 205 ? 0.7237 0.5254 0.6287 -0.0078 -0.0255 0.0028 205 GLN A CB 1440 C CG . GLN A 205 ? 0.7011 0.5034 0.6208 -0.0072 -0.0365 0.0111 205 GLN A CG 1441 N N . LEU A 206 ? 0.6931 0.5318 0.6011 -0.0557 -0.0452 0.0349 206 LEU A N 1442 C CA . LEU A 206 ? 0.6649 0.5329 0.5969 -0.0590 -0.0514 0.0495 206 LEU A CA 1443 C C . LEU A 206 ? 0.6304 0.5154 0.6008 -0.0473 -0.0536 0.0531 206 LEU A C 1444 O O . LEU A 206 ? 0.6248 0.5178 0.6039 -0.0502 -0.0611 0.0564 206 LEU A O 1445 C CB . LEU A 206 ? 0.6767 0.5545 0.5939 -0.0764 -0.0655 0.0593 206 LEU A CB 1446 C CG . LEU A 206 ? 0.7083 0.5690 0.5801 -0.0943 -0.0680 0.0550 206 LEU A CG 1447 C CD1 . LEU A 206 ? 0.7079 0.5952 0.5789 -0.1100 -0.0866 0.0663 206 LEU A CD1 1448 C CD2 . LEU A 206 ? 0.7166 0.5678 0.5672 -0.0931 -0.0574 0.0537 206 LEU A CD2 1449 N N . VAL A 207 ? 0.6166 0.5085 0.6084 -0.0366 -0.0456 0.0509 207 VAL A N 1450 C CA . VAL A 207 ? 0.5914 0.4968 0.6153 -0.0276 -0.0475 0.0533 207 VAL A CA 1451 C C . VAL A 207 ? 0.5879 0.5046 0.6225 -0.0294 -0.0557 0.0675 207 VAL A C 1452 O O . VAL A 207 ? 0.6054 0.5197 0.6283 -0.0345 -0.0578 0.0772 207 VAL A O 1453 C CB . VAL A 207 ? 0.5830 0.4943 0.6249 -0.0216 -0.0375 0.0464 207 VAL A CB 1454 C CG1 . VAL A 207 ? 0.5640 0.4827 0.6319 -0.0166 -0.0398 0.0485 207 VAL A CG1 1455 C CG2 . VAL A 207 ? 0.5855 0.4969 0.6269 -0.0118 -0.0324 0.0315 207 VAL A CG2 1456 N N . CYS A 208 ? 0.5714 0.5004 0.6254 -0.0234 -0.0605 0.0685 208 CYS A N 1457 C CA . CYS A 208 ? 0.5696 0.5117 0.6416 -0.0162 -0.0664 0.0786 208 CYS A CA 1458 C C . CYS A 208 ? 0.5556 0.4959 0.6492 -0.0050 -0.0608 0.0718 208 CYS A C 1459 O O . CYS A 208 ? 0.5413 0.4860 0.6390 -0.0041 -0.0584 0.0627 208 CYS A O 1460 C CB . CYS A 208 ? 0.5704 0.5390 0.6476 -0.0198 -0.0762 0.0834 208 CYS A CB 1461 S SG . CYS A 208 ? 0.5754 0.5697 0.6832 -0.0011 -0.0833 0.0930 208 CYS A SG 1462 N N . HIS A 209 ? 0.5650 0.4929 0.6658 0.0016 -0.0587 0.0761 209 HIS A N 1463 C CA . HIS A 209 ? 0.5595 0.4791 0.6750 0.0088 -0.0528 0.0671 209 HIS A CA 1464 C C . HIS A 209 ? 0.5675 0.4919 0.6976 0.0242 -0.0559 0.0706 209 HIS A C 1465 O O . HIS A 209 ? 0.5870 0.5106 0.7164 0.0324 -0.0624 0.0833 209 HIS A O 1466 C CB . HIS A 209 ? 0.5758 0.4712 0.6856 0.0020 -0.0460 0.0666 209 HIS A CB 1467 C CG . HIS A 209 ? 0.5662 0.4668 0.6688 -0.0106 -0.0398 0.0598 209 HIS A CG 1468 N ND1 . HIS A 209 ? 0.5824 0.4763 0.6672 -0.0209 -0.0362 0.0673 209 HIS A ND1 1469 C CD2 . HIS A 209 ? 0.5465 0.4612 0.6574 -0.0118 -0.0365 0.0456 209 HIS A CD2 1470 C CE1 . HIS A 209 ? 0.5693 0.4756 0.6550 -0.0275 -0.0284 0.0560 209 HIS A CE1 1471 N NE2 . HIS A 209 ? 0.5508 0.4708 0.6539 -0.0203 -0.0300 0.0432 209 HIS A NE2 1472 N N . VAL A 210 ? 0.5574 0.4882 0.6990 0.0302 -0.0515 0.0590 210 VAL A N 1473 C CA . VAL A 210 ? 0.5694 0.5026 0.7252 0.0479 -0.0500 0.0574 210 VAL A CA 1474 C C . VAL A 210 ? 0.5821 0.4898 0.7362 0.0496 -0.0421 0.0433 210 VAL A C 1475 O O . VAL A 210 ? 0.5685 0.4813 0.7190 0.0408 -0.0393 0.0316 210 VAL A O 1476 C CB . VAL A 210 ? 0.5542 0.5281 0.7240 0.0518 -0.0499 0.0547 210 VAL A CB 1477 C CG1 . VAL A 210 ? 0.5699 0.5556 0.7592 0.0749 -0.0478 0.0537 210 VAL A CG1 1478 C CG2 . VAL A 210 ? 0.5439 0.5445 0.7115 0.0406 -0.0581 0.0648 210 VAL A CG2 1479 N N . SER A 211 ? 0.6182 0.4942 0.7704 0.0608 -0.0399 0.0442 211 SER A N 1480 C CA . SER A 211 ? 0.6411 0.4851 0.7857 0.0569 -0.0327 0.0293 211 SER A CA 1481 C C . SER A 211 ? 0.6849 0.4983 0.8282 0.0782 -0.0282 0.0253 211 SER A C 1482 O O . SER A 211 ? 0.7138 0.5094 0.8555 0.0951 -0.0321 0.0389 211 SER A O 1483 C CB . SER A 211 ? 0.6548 0.4713 0.7862 0.0360 -0.0314 0.0309 211 SER A CB 1484 O OG . SER A 211 ? 0.6656 0.4641 0.7922 0.0241 -0.0261 0.0134 211 SER A OG 1485 N N . GLY A 212 ? 0.6973 0.5029 0.8378 0.0795 -0.0208 0.0062 212 GLY A N 1486 C CA . GLY A 212 ? 0.7495 0.5125 0.8810 0.0977 -0.0137 -0.0036 212 GLY A CA 1487 C C . GLY A 212 ? 0.7539 0.5423 0.9005 0.1264 -0.0078 -0.0105 212 GLY A C 1488 O O . GLY A 212 ? 0.8046 0.5576 0.9459 0.1506 -0.0022 -0.0162 212 GLY A O 1489 N N . PHE A 213 ? 0.7077 0.5550 0.8709 0.1235 -0.0074 -0.0111 213 PHE A N 1490 C CA . PHE A 213 ? 0.7082 0.5947 0.8908 0.1464 0.0005 -0.0173 213 PHE A CA 1491 C C . PHE A 213 ? 0.7149 0.6069 0.8863 0.1424 0.0139 -0.0398 213 PHE A C 1492 O O . PHE A 213 ? 0.7087 0.5872 0.8590 0.1191 0.0127 -0.0478 213 PHE A O 1493 C CB . PHE A 213 ? 0.6684 0.6180 0.8743 0.1422 -0.0055 -0.0033 213 PHE A CB 1494 C CG . PHE A 213 ? 0.6318 0.6005 0.8267 0.1118 -0.0078 -0.0024 213 PHE A CG 1495 C CD1 . PHE A 213 ? 0.6180 0.5685 0.8007 0.0931 -0.0181 0.0078 213 PHE A CD1 1496 C CD2 . PHE A 213 ? 0.6230 0.6246 0.8161 0.1034 0.0014 -0.0119 213 PHE A CD2 1497 C CE1 . PHE A 213 ? 0.6021 0.5648 0.7729 0.0715 -0.0208 0.0081 213 PHE A CE1 1498 C CE2 . PHE A 213 ? 0.6172 0.6242 0.7923 0.0787 -0.0020 -0.0091 213 PHE A CE2 1499 C CZ . PHE A 213 ? 0.5989 0.5854 0.7638 0.0652 -0.0140 0.0006 213 PHE A CZ 1500 N N . TYR A 214 ? 0.7324 0.6481 0.9178 0.1669 0.0264 -0.0504 214 TYR A N 1501 C CA . TYR A 214 ? 0.7434 0.6733 0.9171 0.1651 0.0425 -0.0719 214 TYR A CA 1502 C C . TYR A 214 ? 0.7450 0.7327 0.9506 0.1907 0.0555 -0.0758 214 TYR A C 1503 O O . TYR A 214 ? 0.7647 0.7551 0.9944 0.2221 0.0534 -0.0707 214 TYR A O 1504 C CB . TYR A 214 ? 0.7977 0.6636 0.9408 0.1700 0.0498 -0.0931 214 TYR A CB 1505 C CG . TYR A 214 ? 0.8113 0.6836 0.9293 0.1599 0.0635 -0.1157 214 TYR A CG 1506 N N . PRO A 215 ? 0.7295 0.7663 0.9352 0.1779 0.0688 -0.0843 215 PRO A N 1507 C CA . PRO A 215 ? 0.7153 0.7515 0.8881 0.1441 0.0705 -0.0875 215 PRO A CA 1508 C C . PRO A 215 ? 0.6704 0.7150 0.8396 0.1162 0.0536 -0.0664 215 PRO A C 1509 O O . PRO A 215 ? 0.6473 0.6948 0.8369 0.1191 0.0401 -0.0500 215 PRO A O 1510 C CB . PRO A 215 ? 0.7266 0.8183 0.9053 0.1445 0.0929 -0.0995 215 PRO A CB 1511 C CG . PRO A 215 ? 0.7227 0.8684 0.9522 0.1717 0.0975 -0.0959 215 PRO A CG 1512 C CD . PRO A 215 ? 0.7409 0.8372 0.9784 0.2023 0.0865 -0.0943 215 PRO A CD 1513 N N . LYS A 216 ? 0.6657 0.7096 0.8037 0.0910 0.0548 -0.0675 216 LYS A N 1514 C CA . LYS A 216 ? 0.6374 0.6740 0.7609 0.0675 0.0394 -0.0511 216 LYS A CA 1515 C C . LYS A 216 ? 0.6111 0.6883 0.7553 0.0571 0.0369 -0.0347 216 LYS A C 1516 O O . LYS A 216 ? 0.5889 0.6548 0.7364 0.0502 0.0217 -0.0208 216 LYS A O 1517 C CB . LYS A 216 ? 0.6549 0.6741 0.7334 0.0486 0.0402 -0.0563 216 LYS A CB 1518 C CG . LYS A 216 ? 0.6474 0.6349 0.7056 0.0372 0.0204 -0.0475 216 LYS A CG 1519 C CD . LYS A 216 ? 0.6905 0.6578 0.7031 0.0273 0.0182 -0.0554 216 LYS A CD 1520 C CE . LYS A 216 ? 0.6863 0.6319 0.6820 0.0205 -0.0027 -0.0465 216 LYS A CE 1521 N NZ . LYS A 216 ? 0.7095 0.6463 0.6618 0.0083 -0.0054 -0.0378 216 LYS A NZ 1522 N N . PRO A 217 ? 0.6165 0.7435 0.7739 0.0533 0.0526 -0.0379 217 PRO A N 1523 C CA . PRO A 217 ? 0.5977 0.7625 0.7683 0.0339 0.0495 -0.0240 217 PRO A CA 1524 C C . PRO A 217 ? 0.5744 0.7608 0.7849 0.0479 0.0361 -0.0135 217 PRO A C 1525 O O . PRO A 217 ? 0.5780 0.7981 0.8255 0.0736 0.0401 -0.0183 217 PRO A O 1526 C CB . PRO A 217 ? 0.6143 0.8351 0.7944 0.0256 0.0723 -0.0333 217 PRO A CB 1527 C CG . PRO A 217 ? 0.6445 0.8408 0.7964 0.0338 0.0866 -0.0502 217 PRO A CG 1528 C CD . PRO A 217 ? 0.6442 0.7982 0.8028 0.0617 0.0753 -0.0555 217 PRO A CD 1529 N N . VAL A 218 ? 0.5553 0.7192 0.7540 0.0330 0.0198 0.0005 218 VAL A N 1530 C CA . VAL A 218 ? 0.5342 0.7115 0.7580 0.0403 0.0048 0.0125 218 VAL A CA 1531 C C . VAL A 218 ? 0.5274 0.7178 0.7400 0.0097 -0.0022 0.0230 218 VAL A C 1532 O O . VAL A 218 ? 0.5334 0.6982 0.7104 -0.0137 0.0013 0.0234 218 VAL A O 1533 C CB . VAL A 218 ? 0.5308 0.6541 0.7454 0.0550 -0.0075 0.0168 218 VAL A CB 1534 C CG1 . VAL A 218 ? 0.5270 0.6041 0.7051 0.0374 -0.0122 0.0178 218 VAL A CG1 1535 C CG2 . VAL A 218 ? 0.5201 0.6537 0.7531 0.0628 -0.0223 0.0305 218 VAL A CG2 1536 N N . TRP A 219 ? 0.5206 0.7464 0.7592 0.0110 -0.0132 0.0316 219 TRP A N 1537 C CA . TRP A 219 ? 0.5211 0.7656 0.7516 -0.0194 -0.0204 0.0392 219 TRP A CA 1538 C C . TRP A 219 ? 0.5158 0.7381 0.7420 -0.0148 -0.0393 0.0502 219 TRP A C 1539 O O . TRP A 219 ? 0.5136 0.7581 0.7670 0.0078 -0.0489 0.0553 219 TRP A O 1540 C CB . TRP A 219 ? 0.5204 0.8488 0.7906 -0.0265 -0.0155 0.0362 219 TRP A CB 1541 C CG . TRP A 219 ? 0.5286 0.8817 0.7891 -0.0664 -0.0202 0.0405 219 TRP A CG 1542 C CD1 . TRP A 219 ? 0.5533 0.9074 0.7885 -0.1043 -0.0068 0.0369 219 TRP A CD1 1543 C CD2 . TRP A 219 ? 0.5264 0.9023 0.7963 -0.0756 -0.0394 0.0487 219 TRP A CD2 1544 N NE1 . TRP A 219 ? 0.5626 0.9359 0.7913 -0.1386 -0.0159 0.0411 219 TRP A NE1 1545 C CE2 . TRP A 219 ? 0.5467 0.9366 0.7973 -0.1216 -0.0366 0.0475 219 TRP A CE2 1546 C CE3 . TRP A 219 ? 0.5158 0.8969 0.8022 -0.0516 -0.0591 0.0574 219 TRP A CE3 1547 C CZ2 . TRP A 219 ? 0.5533 0.9657 0.8030 -0.1447 -0.0533 0.0521 219 TRP A CZ2 1548 C CZ3 . TRP A 219 ? 0.5241 0.9295 0.8083 -0.0725 -0.0764 0.0637 219 TRP A CZ3 1549 C CH2 . TRP A 219 ? 0.5413 0.9641 0.8086 -0.1190 -0.0737 0.0598 219 TRP A CH2 1550 N N . VAL A 220 ? 0.5240 0.6988 0.7120 -0.0343 -0.0441 0.0539 220 VAL A N 1551 C CA . VAL A 220 ? 0.5259 0.6781 0.7028 -0.0337 -0.0587 0.0625 220 VAL A CA 1552 C C . VAL A 220 ? 0.5468 0.6910 0.6947 -0.0667 -0.0632 0.0643 220 VAL A C 1553 O O . VAL A 220 ? 0.5613 0.6698 0.6763 -0.0840 -0.0558 0.0603 220 VAL A O 1554 C CB . VAL A 220 ? 0.5207 0.6146 0.6771 -0.0201 -0.0586 0.0623 220 VAL A CB 1555 C CG1 . VAL A 220 ? 0.5211 0.6023 0.6728 -0.0153 -0.0703 0.0713 220 VAL A CG1 1556 C CG2 . VAL A 220 ? 0.5162 0.6038 0.6886 0.0034 -0.0509 0.0562 220 VAL A CG2 1557 N N . MET A 221 ? 0.5556 0.7282 0.7111 -0.0747 -0.0764 0.0702 221 MET A N 1558 C CA . MET A 221 ? 0.5863 0.7465 0.7098 -0.1078 -0.0820 0.0700 221 MET A CA 1559 C C . MET A 221 ? 0.5972 0.7554 0.7126 -0.1058 -0.0981 0.0769 221 MET A C 1560 O O . MET A 221 ? 0.5949 0.7963 0.7405 -0.0890 -0.1095 0.0840 221 MET A O 1561 C CB . MET A 221 ? 0.5983 0.8156 0.7372 -0.1369 -0.0802 0.0664 221 MET A CB 1562 C CG . MET A 221 ? 0.6218 0.8224 0.7435 -0.1551 -0.0624 0.0601 221 MET A CG 1563 S SD . MET A 221 ? 0.6927 0.8034 0.7419 -0.1844 -0.0595 0.0583 221 MET A SD 1564 C CE . MET A 221 ? 0.7306 0.8765 0.7692 -0.2391 -0.0564 0.0546 221 MET A CE 1565 N N . TRP A 222 ? 0.6205 0.7261 0.6915 -0.1205 -0.0989 0.0748 222 TRP A N 1566 C CA . TRP A 222 ? 0.6372 0.7404 0.6898 -0.1270 -0.1127 0.0793 222 TRP A CA 1567 C C . TRP A 222 ? 0.6577 0.8085 0.7121 -0.1585 -0.1245 0.0778 222 TRP A C 1568 O O . TRP A 222 ? 0.6712 0.8264 0.7182 -0.1861 -0.1175 0.0705 222 TRP A O 1569 C CB . TRP A 222 ? 0.6599 0.6946 0.6643 -0.1316 -0.1069 0.0740 222 TRP A CB 1570 C CG . TRP A 222 ? 0.6435 0.6478 0.6515 -0.1029 -0.0990 0.0758 222 TRP A CG 1571 C CD1 . TRP A 222 ? 0.6277 0.6084 0.6417 -0.0883 -0.0871 0.0709 222 TRP A CD1 1572 C CD2 . TRP A 222 ? 0.6461 0.6423 0.6492 -0.0897 -0.1026 0.0825 222 TRP A CD2 1573 N NE1 . TRP A 222 ? 0.6157 0.5802 0.6343 -0.0688 -0.0831 0.0724 222 TRP A NE1 1574 C CE2 . TRP A 222 ? 0.6287 0.5996 0.6392 -0.0704 -0.0908 0.0800 222 TRP A CE2 1575 C CE3 . TRP A 222 ? 0.6613 0.6695 0.6511 -0.0945 -0.1152 0.0910 222 TRP A CE3 1576 C CZ2 . TRP A 222 ? 0.6239 0.5808 0.6301 -0.0596 -0.0882 0.0851 222 TRP A CZ2 1577 C CZ3 . TRP A 222 ? 0.6623 0.6501 0.6421 -0.0810 -0.1128 0.0980 222 TRP A CZ3 1578 C CH2 . TRP A 222 ? 0.6405 0.6029 0.6291 -0.0656 -0.0980 0.0948 222 TRP A CH2 1579 N N . MET A 223 ? 0.6651 0.8522 0.7274 -0.1560 -0.1429 0.0853 223 MET A N 1580 C CA . MET A 223 ? 0.6792 0.9326 0.7560 -0.1822 -0.1586 0.0844 223 MET A CA 1581 C C . MET A 223 ? 0.7131 0.9595 0.7532 -0.1987 -0.1771 0.0865 223 MET A C 1582 O O . MET A 223 ? 0.7183 0.9345 0.7398 -0.1776 -0.1823 0.0950 223 MET A O 1583 C CB . MET A 223 ? 0.6546 0.9906 0.7941 -0.1557 -0.1684 0.0921 223 MET A CB 1584 C CG . MET A 223 ? 0.6275 0.9795 0.8048 -0.1383 -0.1496 0.0880 223 MET A CG 1585 S SD . MET A 223 ? 0.6407 1.0497 0.8373 -0.1797 -0.1382 0.0753 223 MET A SD 1586 C CE . MET A 223 ? 0.6276 1.1638 0.8969 -0.1644 -0.1560 0.0784 223 MET A CE 1587 N N . ARG A 224 ? 0.7430 1.0151 0.7683 -0.2404 -0.1857 0.0780 224 ARG A N 1588 C CA . ARG A 224 ? 0.7769 1.0718 0.7785 -0.2592 -0.2094 0.0795 224 ARG A CA 1589 C C . ARG A 224 ? 0.7678 1.1716 0.8237 -0.2672 -0.2292 0.0821 224 ARG A C 1590 O O . ARG A 224 ? 0.7924 1.2328 0.8460 -0.3117 -0.2341 0.0709 224 ARG A O 1591 C CB . ARG A 224 ? 0.8297 1.0702 0.7678 -0.3056 -0.2059 0.0642 224 ARG A CB 1592 C CG . ARG A 224 ? 0.8509 0.9891 0.7335 -0.2970 -0.1876 0.0587 224 ARG A CG 1593 C CD . ARG A 224 ? 0.9205 1.0127 0.7351 -0.3310 -0.1932 0.0464 224 ARG A CD 1594 N NE . ARG A 224 ? 0.9369 1.0130 0.7263 -0.3106 -0.2010 0.0533 224 ARG A NE 1595 C CZ . ARG A 224 ? 0.9544 0.9603 0.7084 -0.2914 -0.1838 0.0501 224 ARG A CZ 1596 N NH1 . ARG A 224 ? 0.9496 0.8952 0.6906 -0.2856 -0.1609 0.0400 224 ARG A NH1 1597 N NH2 . ARG A 224 ? 0.9764 0.9750 0.7069 -0.2779 -0.1897 0.0572 224 ARG A NH2 1598 N N . GLY A 225 ? 0.7373 1.1928 0.8423 -0.2240 -0.2400 0.0959 225 GLY A N 1599 C CA . GLY A 225 ? 0.7263 1.2955 0.8938 -0.2193 -0.2590 0.0985 225 GLY A CA 1600 C C . GLY A 225 ? 0.6984 1.3151 0.9133 -0.2306 -0.2390 0.0877 225 GLY A C 1601 O O . GLY A 225 ? 0.6667 1.2611 0.9024 -0.2006 -0.2189 0.0890 225 GLY A O 1602 N N . ASP A 226 ? 0.7157 1.3977 0.9441 -0.2775 -0.2438 0.0759 226 ASP A N 1603 C CA . ASP A 226 ? 0.6994 1.4316 0.9679 -0.2975 -0.2227 0.0649 226 ASP A CA 1604 C C . ASP A 226 ? 0.7134 1.3493 0.9279 -0.3306 -0.1935 0.0558 226 ASP A C 1605 O O . ASP A 226 ? 0.7050 1.3581 0.9392 -0.3435 -0.1711 0.0492 226 ASP A O 1606 C CB . ASP A 226 ? 0.7158 1.5700 1.0273 -0.3371 -0.2385 0.0558 226 ASP A CB 1607 C CG . ASP A 226 ? 0.7722 1.5981 1.0261 -0.4035 -0.2472 0.0451 226 ASP A CG 1608 O OD1 . ASP A 226 ? 0.8035 1.5172 0.9838 -0.4119 -0.2439 0.0456 226 ASP A OD1 1609 O OD2 . ASP A 226 ? 0.7927 1.7118 1.0755 -0.4483 -0.2567 0.0345 226 ASP A OD2 1610 N N . GLN A 227 ? 0.7409 1.2755 0.8850 -0.3419 -0.1936 0.0556 227 GLN A N 1611 C CA . GLN A 227 ? 0.7672 1.2029 0.8527 -0.3693 -0.1702 0.0475 227 GLN A CA 1612 C C . GLN A 227 ? 0.7376 1.0999 0.8134 -0.3255 -0.1521 0.0536 227 GLN A C 1613 O O . GLN A 227 ? 0.7226 1.0520 0.7913 -0.2884 -0.1587 0.0616 227 GLN A O 1614 C CB . GLN A 227 ? 0.8238 1.1884 0.8369 -0.4042 -0.1783 0.0404 227 GLN A CB 1615 N N . GLU A 228 ? 0.7359 1.0750 0.8095 -0.3331 -0.1295 0.0498 228 GLU A N 1616 C CA . GLU A 228 ? 0.7151 0.9846 0.7743 -0.2984 -0.1132 0.0534 228 GLU A CA 1617 C C . GLU A 228 ? 0.7549 0.9154 0.7420 -0.3086 -0.1079 0.0498 228 GLU A C 1618 O O . GLU A 228 ? 0.8063 0.9257 0.7480 -0.3498 -0.1021 0.0427 228 GLU A O 1619 C CB . GLU A 228 ? 0.7083 0.9944 0.7847 -0.3052 -0.0924 0.0506 228 GLU A CB 1620 C CG . GLU A 228 ? 0.6730 1.0637 0.8228 -0.2863 -0.0917 0.0514 228 GLU A CG 1621 C CD . GLU A 228 ? 0.6805 1.0799 0.8384 -0.2934 -0.0672 0.0470 228 GLU A CD 1622 O OE1 . GLU A 228 ? 0.6545 1.0540 0.8356 -0.2534 -0.0587 0.0487 228 GLU A OE1 1623 O OE2 . GLU A 228 ? 0.7209 1.1221 0.8563 -0.3416 -0.0557 0.0415 228 GLU A OE2 1624 N N . GLN A 229 ? 0.7384 0.8514 0.7142 -0.2712 -0.1089 0.0539 229 GLN A N 1625 C CA . GLN A 229 ? 0.7762 0.7935 0.6906 -0.2718 -0.1031 0.0489 229 GLN A CA 1626 C C . GLN A 229 ? 0.7932 0.7495 0.6813 -0.2686 -0.0860 0.0469 229 GLN A C 1627 O O . GLN A 229 ? 0.7565 0.7139 0.6684 -0.2362 -0.0791 0.0511 229 GLN A O 1628 C CB . GLN A 229 ? 0.7542 0.7530 0.6695 -0.2356 -0.1081 0.0528 229 GLN A CB 1629 C CG . GLN A 229 ? 0.7579 0.7941 0.6755 -0.2426 -0.1261 0.0557 229 GLN A CG 1630 C CD . GLN A 229 ? 0.8120 0.8295 0.6830 -0.2869 -0.1329 0.0458 229 GLN A CD 1631 O OE1 . GLN A 229 ? 0.8170 0.8925 0.7044 -0.3175 -0.1436 0.0445 229 GLN A OE1 1632 N NE2 . GLN A 229 ? 0.8578 0.7957 0.6706 -0.2912 -0.1260 0.0367 229 GLN A NE2 1633 N N . GLN A 230 ? 0.8561 0.7545 0.6895 -0.3032 -0.0804 0.0406 230 GLN A N 1634 C CA . GLN A 230 ? 0.8864 0.7273 0.6869 -0.3074 -0.0662 0.0414 230 GLN A CA 1635 C C . GLN A 230 ? 0.8903 0.6586 0.6641 -0.2674 -0.0618 0.0418 230 GLN A C 1636 O O . GLN A 230 ? 0.9050 0.6390 0.6630 -0.2579 -0.0535 0.0454 230 GLN A O 1637 C CB . GLN A 230 ? 0.9669 0.7591 0.7095 -0.3598 -0.0617 0.0359 230 GLN A CB 1638 C CG . GLN A 230 ? 0.9704 0.8443 0.7443 -0.4051 -0.0616 0.0350 230 GLN A CG 1639 C CD . GLN A 230 ? 0.9566 0.8702 0.7596 -0.4058 -0.0475 0.0407 230 GLN A CD 1640 O OE1 . GLN A 230 ? 0.8939 0.8910 0.7631 -0.3802 -0.0483 0.0438 230 GLN A OE1 1641 N NE2 . GLN A 230 ? 1.0218 0.8692 0.7692 -0.4348 -0.0335 0.0420 230 GLN A NE2 1642 N N . GLY A 231 ? 0.8818 0.6320 0.6509 -0.2444 -0.0675 0.0380 231 GLY A N 1643 C CA . GLY A 231 ? 0.8777 0.5801 0.6353 -0.2039 -0.0637 0.0366 231 GLY A CA 1644 C C . GLY A 231 ? 0.8076 0.5643 0.6233 -0.1688 -0.0644 0.0420 231 GLY A C 1645 O O . GLY A 231 ? 0.7973 0.5352 0.6159 -0.1372 -0.0628 0.0394 231 GLY A O 1646 N N . THR A 232 ? 0.7637 0.5890 0.6260 -0.1746 -0.0661 0.0479 232 THR A N 1647 C CA . THR A 232 ? 0.7074 0.5742 0.6185 -0.1438 -0.0656 0.0520 232 THR A CA 1648 C C . THR A 232 ? 0.7148 0.5505 0.6148 -0.1285 -0.0586 0.0515 232 THR A C 1649 O O . THR A 232 ? 0.7454 0.5659 0.6233 -0.1469 -0.0533 0.0529 232 THR A O 1650 C CB . THR A 232 ? 0.6722 0.6134 0.6312 -0.1499 -0.0680 0.0567 232 THR A CB 1651 O OG1 . THR A 232 ? 0.6790 0.6526 0.6439 -0.1672 -0.0784 0.0581 232 THR A OG1 1652 C CG2 . THR A 232 ? 0.6273 0.5975 0.6289 -0.1167 -0.0677 0.0597 232 THR A CG2 1653 N N . HIS A 233 ? 0.6950 0.5226 0.6078 -0.0974 -0.0588 0.0497 233 HIS A N 1654 C CA . HIS A 233 ? 0.7054 0.5072 0.6073 -0.0798 -0.0562 0.0487 233 HIS A CA 1655 C C . HIS A 233 ? 0.6599 0.5043 0.6057 -0.0612 -0.0552 0.0486 233 HIS A C 1656 O O . HIS A 233 ? 0.6313 0.4940 0.6046 -0.0449 -0.0571 0.0466 233 HIS A O 1657 C CB . HIS A 233 ? 0.7327 0.4855 0.6066 -0.0593 -0.0584 0.0434 233 HIS A CB 1658 C CG . HIS A 233 ? 0.7461 0.4811 0.6131 -0.0361 -0.0605 0.0426 233 HIS A CG 1659 N ND1 . HIS A 233 ? 0.7318 0.4797 0.6216 -0.0078 -0.0637 0.0367 233 HIS A ND1 1660 C CD2 . HIS A 233 ? 0.7766 0.4849 0.6146 -0.0387 -0.0608 0.0471 233 HIS A CD2 1661 C CE1 . HIS A 233 ? 0.7418 0.4752 0.6192 0.0078 -0.0685 0.0371 233 HIS A CE1 1662 N NE2 . HIS A 233 ? 0.7738 0.4791 0.6164 -0.0096 -0.0670 0.0442 233 HIS A NE2 1663 N N . ARG A 234 ? 0.6627 0.5191 0.6102 -0.0666 -0.0506 0.0501 234 ARG A N 1664 C CA . ARG A 234 ? 0.6312 0.5191 0.6114 -0.0502 -0.0483 0.0473 234 ARG A CA 1665 C C . ARG A 234 ? 0.6325 0.4976 0.6065 -0.0275 -0.0531 0.0425 234 ARG A C 1666 O O . ARG A 234 ? 0.6660 0.4913 0.6037 -0.0233 -0.0568 0.0429 234 ARG A O 1667 C CB . ARG A 234 ? 0.6419 0.5454 0.6174 -0.0628 -0.0396 0.0478 234 ARG A CB 1668 N N . GLY A 235 ? 0.6017 0.4916 0.6100 -0.0130 -0.0539 0.0379 235 GLY A N 1669 C CA . GLY A 235 ? 0.5979 0.4814 0.6089 0.0045 -0.0588 0.0310 235 GLY A CA 1670 C C . GLY A 235 ? 0.6084 0.4929 0.6101 0.0070 -0.0583 0.0275 235 GLY A C 1671 O O . GLY A 235 ? 0.6229 0.5079 0.6107 -0.0050 -0.0519 0.0309 235 GLY A O 1672 N N . ASP A 236 ? 0.6058 0.4942 0.6139 0.0202 -0.0646 0.0196 236 ASP A N 1673 C CA . ASP A 236 ? 0.6182 0.5104 0.6173 0.0218 -0.0648 0.0138 236 ASP A CA 1674 C C . ASP A 236 ? 0.5950 0.5114 0.6284 0.0225 -0.0595 0.0047 236 ASP A C 1675 O O . ASP A 236 ? 0.5785 0.5041 0.6366 0.0257 -0.0618 0.0008 236 ASP A O 1676 C CB . ASP A 236 ? 0.6405 0.5199 0.6173 0.0351 -0.0785 0.0103 236 ASP A CB 1677 N N . PHE A 237 ? 0.6015 0.5245 0.6331 0.0187 -0.0506 0.0008 237 PHE A N 1678 C CA . PHE A 237 ? 0.5940 0.5275 0.6500 0.0223 -0.0448 -0.0093 237 PHE A CA 1679 C C . PHE A 237 ? 0.5955 0.5267 0.6564 0.0250 -0.0538 -0.0207 237 PHE A C 1680 O O . PHE A 237 ? 0.6107 0.5399 0.6516 0.0267 -0.0637 -0.0252 237 PHE A O 1681 C CB . PHE A 237 ? 0.6101 0.5491 0.6565 0.0218 -0.0331 -0.0162 237 PHE A CB 1682 C CG . PHE A 237 ? 0.6035 0.5590 0.6523 0.0160 -0.0223 -0.0077 237 PHE A CG 1683 C CD1 . PHE A 237 ? 0.5778 0.5504 0.6562 0.0178 -0.0202 -0.0002 237 PHE A CD1 1684 C CD2 . PHE A 237 ? 0.6290 0.5866 0.6491 0.0066 -0.0141 -0.0078 237 PHE A CD2 1685 C CE1 . PHE A 237 ? 0.5667 0.5662 0.6525 0.0102 -0.0120 0.0056 237 PHE A CE1 1686 C CE2 . PHE A 237 ? 0.6259 0.6077 0.6520 -0.0040 -0.0022 -0.0019 237 PHE A CE2 1687 C CZ . PHE A 237 ? 0.5898 0.5967 0.6522 -0.0021 -0.0020 0.0039 237 PHE A CZ 1688 N N . LEU A 238 ? 0.5870 0.5187 0.6726 0.0239 -0.0512 -0.0249 238 LEU A N 1689 C CA . LEU A 238 ? 0.5970 0.5310 0.6903 0.0192 -0.0578 -0.0372 238 LEU A CA 1690 C C . LEU A 238 ? 0.6186 0.5366 0.7169 0.0150 -0.0498 -0.0489 238 LEU A C 1691 O O . LEU A 238 ? 0.6200 0.5244 0.7280 0.0188 -0.0406 -0.0433 238 LEU A O 1692 C CB . LEU A 238 ? 0.5802 0.5245 0.6931 0.0158 -0.0612 -0.0324 238 LEU A CB 1693 C CG . LEU A 238 ? 0.5701 0.5237 0.6790 0.0224 -0.0674 -0.0232 238 LEU A CG 1694 C CD1 . LEU A 238 ? 0.5494 0.5166 0.6799 0.0179 -0.0659 -0.0234 238 LEU A CD1 1695 C CD2 . LEU A 238 ? 0.5948 0.5545 0.6848 0.0312 -0.0802 -0.0276 238 LEU A CD2 1696 N N . PRO A 239 ? 0.6441 0.5606 0.7324 0.0081 -0.0548 -0.0657 239 PRO A N 1697 C CA . PRO A 239 ? 0.6770 0.5679 0.7606 0.0023 -0.0470 -0.0806 239 PRO A CA 1698 C C . PRO A 239 ? 0.6861 0.5598 0.7855 -0.0104 -0.0439 -0.0821 239 PRO A C 1699 O O . PRO A 239 ? 0.6688 0.5629 0.7842 -0.0204 -0.0497 -0.0782 239 PRO A O 1700 C CB . PRO A 239 ? 0.7024 0.6012 0.7657 -0.0056 -0.0570 -0.0985 239 PRO A CB 1701 C CG . PRO A 239 ? 0.6789 0.6124 0.7509 -0.0064 -0.0733 -0.0929 239 PRO A CG 1702 C CD . PRO A 239 ? 0.6494 0.5869 0.7265 0.0064 -0.0701 -0.0722 239 PRO A CD 1703 N N . ASN A 240 ? 0.7212 0.5550 0.8129 -0.0098 -0.0333 -0.0882 240 ASN A N 1704 C CA . ASN A 240 ? 0.7480 0.5503 0.8435 -0.0250 -0.0288 -0.0883 240 ASN A CA 1705 C C . ASN A 240 ? 0.8005 0.5689 0.8772 -0.0441 -0.0267 -0.1111 240 ASN A C 1706 O O . ASN A 240 ? 0.8264 0.5794 0.8832 -0.0378 -0.0244 -0.1267 240 ASN A O 1707 C CB . ASN A 240 ? 0.7586 0.5281 0.8551 -0.0086 -0.0198 -0.0716 240 ASN A CB 1708 C CG . ASN A 240 ? 0.7133 0.5167 0.8256 0.0065 -0.0227 -0.0512 240 ASN A CG 1709 O OD1 . ASN A 240 ? 0.6928 0.5251 0.8067 0.0177 -0.0247 -0.0506 240 ASN A OD1 1710 N ND2 . ASN A 240 ? 0.7017 0.4978 0.8203 0.0040 -0.0224 -0.0345 240 ASN A ND2 1711 N N . ASP A 242 ? 0.9654 0.5517 0.9825 -0.0098 0.0061 -0.1251 242 ASP A N 1712 C CA . ASP A 242 ? 0.9704 0.5763 0.9750 -0.0139 0.0049 -0.1487 242 ASP A CA 1713 C C . ASP A 242 ? 0.9516 0.5838 0.9610 0.0197 0.0114 -0.1473 242 ASP A C 1714 O O . ASP A 242 ? 0.9823 0.5847 0.9895 0.0480 0.0226 -0.1454 242 ASP A O 1715 C CB . ASP A 242 ? 1.0520 0.5919 1.0199 -0.0305 0.0113 -0.1753 242 ASP A CB 1716 N N . GLU A 243 ? 0.9064 0.5956 0.9218 0.0165 0.0044 -0.1476 243 GLU A N 1717 C CA . GLU A 243 ? 0.8890 0.6094 0.9043 0.0387 0.0120 -0.1475 243 GLU A CA 1718 C C . GLU A 243 ? 0.8459 0.5966 0.8913 0.0599 0.0148 -0.1234 243 GLU A C 1719 O O . GLU A 243 ? 0.8315 0.6160 0.8817 0.0739 0.0222 -0.1216 243 GLU A O 1720 C CB . GLU A 243 ? 0.9516 0.6357 0.9404 0.0528 0.0279 -0.1716 243 GLU A CB 1721 N N . THR A 244 ? 0.8306 0.5712 0.8937 0.0588 0.0091 -0.1055 244 THR A N 1722 C CA . THR A 244 ? 0.7894 0.5619 0.8789 0.0737 0.0072 -0.0821 244 THR A CA 1723 C C . THR A 244 ? 0.7322 0.5529 0.8306 0.0595 -0.0026 -0.0706 244 THR A C 1724 O O . THR A 244 ? 0.7265 0.5589 0.8110 0.0449 -0.0078 -0.0801 244 THR A O 1725 C CB . THR A 244 ? 0.8051 0.5434 0.9012 0.0778 0.0042 -0.0665 244 THR A CB 1726 O OG1 . THR A 244 ? 0.8277 0.5337 0.9098 0.0508 0.0000 -0.0713 244 THR A OG1 1727 C CG2 . THR A 244 ? 0.8556 0.5530 0.9469 0.1071 0.0135 -0.0702 244 THR A CG2 1728 N N . TRP A 245 ? 0.6975 0.5424 0.8151 0.0651 -0.0063 -0.0506 245 TRP A N 1729 C CA . TRP A 245 ? 0.6573 0.5387 0.7780 0.0545 -0.0138 -0.0401 245 TRP A CA 1730 C C . TRP A 245 ? 0.6303 0.5177 0.7633 0.0493 -0.0216 -0.0220 245 TRP A C 1731 O O . TRP A 245 ? 0.6391 0.5204 0.7829 0.0592 -0.0211 -0.0106 245 TRP A O 1732 C CB . TRP A 245 ? 0.6463 0.5610 0.7692 0.0620 -0.0072 -0.0382 245 TRP A CB 1733 C CG . TRP A 245 ? 0.6753 0.5916 0.7757 0.0589 -0.0006 -0.0543 245 TRP A CG 1734 C CD1 . TRP A 245 ? 0.7035 0.6295 0.8013 0.0702 0.0140 -0.0653 245 TRP A CD1 1735 C CD2 . TRP A 245 ? 0.6884 0.5990 0.7634 0.0448 -0.0087 -0.0614 245 TRP A CD2 1736 N NE1 . TRP A 245 ? 0.7283 0.6504 0.7949 0.0608 0.0168 -0.0786 245 TRP A NE1 1737 C CE2 . TRP A 245 ? 0.7143 0.6263 0.7659 0.0459 0.0009 -0.0755 245 TRP A CE2 1738 C CE3 . TRP A 245 ? 0.6861 0.5945 0.7564 0.0335 -0.0236 -0.0578 245 TRP A CE3 1739 C CZ2 . TRP A 245 ? 0.7317 0.6383 0.7502 0.0351 -0.0064 -0.0839 245 TRP A CZ2 1740 C CZ3 . TRP A 245 ? 0.7012 0.6100 0.7455 0.0263 -0.0319 -0.0668 245 TRP A CZ3 1741 C CH2 . TRP A 245 ? 0.7267 0.6324 0.7429 0.0266 -0.0247 -0.0787 245 TRP A CH2 1742 N N . TYR A 246 ? 0.6036 0.5028 0.7321 0.0359 -0.0293 -0.0196 246 TYR A N 1743 C CA . TYR A 246 ? 0.5810 0.4864 0.7165 0.0303 -0.0345 -0.0056 246 TYR A CA 1744 C C . TYR A 246 ? 0.5593 0.4867 0.6887 0.0281 -0.0388 0.0013 246 TYR A C 1745 O O . TYR A 246 ? 0.5586 0.4912 0.6745 0.0261 -0.0413 -0.0048 246 TYR A O 1746 C CB . TYR A 246 ? 0.5839 0.4800 0.7204 0.0170 -0.0372 -0.0106 246 TYR A CB 1747 C CG . TYR A 246 ? 0.5666 0.4736 0.7069 0.0110 -0.0400 0.0002 246 TYR A CG 1748 C CD1 . TYR A 246 ? 0.5702 0.4629 0.7115 0.0077 -0.0370 0.0118 246 TYR A CD1 1749 C CD2 . TYR A 246 ? 0.5531 0.4802 0.6906 0.0103 -0.0454 -0.0011 246 TYR A CD2 1750 C CE1 . TYR A 246 ? 0.5628 0.4653 0.7025 0.0010 -0.0375 0.0199 246 TYR A CE1 1751 C CE2 . TYR A 246 ? 0.5420 0.4765 0.6801 0.0071 -0.0458 0.0057 246 TYR A CE2 1752 C CZ . TYR A 246 ? 0.5452 0.4696 0.6846 0.0011 -0.0410 0.0152 246 TYR A CZ 1753 O OH . TYR A 246 ? 0.5423 0.4739 0.6775 -0.0029 -0.0396 0.0199 246 TYR A OH 1754 N N . LEU A 247 ? 0.5477 0.4825 0.6817 0.0275 -0.0404 0.0147 247 LEU A N 1755 C CA . LEU A 247 ? 0.5375 0.4840 0.6608 0.0219 -0.0435 0.0212 247 LEU A CA 1756 C C . LEU A 247 ? 0.5336 0.4791 0.6568 0.0168 -0.0471 0.0317 247 LEU A C 1757 O O . LEU A 247 ? 0.5387 0.4821 0.6714 0.0195 -0.0472 0.0386 247 LEU A O 1758 C CB . LEU A 247 ? 0.5379 0.5034 0.6635 0.0229 -0.0391 0.0236 247 LEU A CB 1759 C CG . LEU A 247 ? 0.5438 0.5145 0.6509 0.0103 -0.0405 0.0289 247 LEU A CG 1760 C CD1 . LEU A 247 ? 0.5629 0.5142 0.6425 0.0077 -0.0419 0.0231 247 LEU A CD1 1761 C CD2 . LEU A 247 ? 0.5393 0.5405 0.6560 0.0053 -0.0345 0.0317 247 LEU A CD2 1762 N N . GLN A 248 ? 0.5326 0.4743 0.6397 0.0106 -0.0502 0.0330 248 GLN A N 1763 C CA . GLN A 248 ? 0.5339 0.4732 0.6339 0.0042 -0.0524 0.0409 248 GLN A CA 1764 C C . GLN A 248 ? 0.5400 0.4762 0.6191 -0.0049 -0.0547 0.0439 248 GLN A C 1765 O O . GLN A 248 ? 0.5497 0.4753 0.6129 -0.0055 -0.0545 0.0400 248 GLN A O 1766 C CB . GLN A 248 ? 0.5370 0.4681 0.6354 0.0043 -0.0508 0.0368 248 GLN A CB 1767 C CG . GLN A 248 ? 0.5599 0.4846 0.6455 0.0087 -0.0523 0.0286 248 GLN A CG 1768 C CD . GLN A 248 ? 0.5776 0.5089 0.6711 0.0105 -0.0483 0.0221 248 GLN A CD 1769 O OE1 . GLN A 248 ? 0.5816 0.5228 0.6928 0.0062 -0.0441 0.0198 248 GLN A OE1 1770 N NE2 . GLN A 248 ? 0.5937 0.5182 0.6722 0.0160 -0.0481 0.0181 248 GLN A NE2 1771 N N . ALA A 249 ? 0.5417 0.4837 0.6162 -0.0140 -0.0576 0.0514 249 ALA A N 1772 C CA . ALA A 249 ? 0.5541 0.4915 0.6061 -0.0294 -0.0599 0.0534 249 ALA A CA 1773 C C . ALA A 249 ? 0.5701 0.4899 0.6001 -0.0367 -0.0622 0.0542 249 ALA A C 1774 O O . ALA A 249 ? 0.5661 0.4984 0.6009 -0.0400 -0.0659 0.0602 249 ALA A O 1775 C CB . ALA A 249 ? 0.5476 0.5198 0.6160 -0.0381 -0.0621 0.0589 249 ALA A CB 1776 N N . THR A 250 ? 0.5941 0.4813 0.5955 -0.0373 -0.0602 0.0478 250 THR A N 1777 C CA . THR A 250 ? 0.6193 0.4840 0.5956 -0.0403 -0.0591 0.0441 250 THR A CA 1778 C C . THR A 250 ? 0.6476 0.4981 0.5931 -0.0631 -0.0629 0.0454 250 THR A C 1779 O O . THR A 250 ? 0.6558 0.5076 0.5953 -0.0773 -0.0647 0.0477 250 THR A O 1780 C CB . THR A 250 ? 0.6367 0.4716 0.5970 -0.0237 -0.0549 0.0342 250 THR A CB 1781 O OG1 . THR A 250 ? 0.6836 0.4800 0.6083 -0.0284 -0.0567 0.0326 250 THR A OG1 1782 C CG2 . THR A 250 ? 0.6124 0.4664 0.6028 -0.0055 -0.0541 0.0311 250 THR A CG2 1783 N N . LEU A 251 ? 0.6684 0.5070 0.5927 -0.0696 -0.0629 0.0429 251 LEU A N 1784 C CA . LEU A 251 ? 0.7116 0.5276 0.5975 -0.0935 -0.0664 0.0400 251 LEU A CA 1785 C C . LEU A 251 ? 0.7491 0.5290 0.6000 -0.0895 -0.0604 0.0299 251 LEU A C 1786 O O . LEU A 251 ? 0.7364 0.5324 0.5964 -0.0816 -0.0572 0.0303 251 LEU A O 1787 C CB . LEU A 251 ? 0.7020 0.5602 0.6009 -0.1137 -0.0770 0.0486 251 LEU A CB 1788 C CG . LEU A 251 ? 0.7425 0.5860 0.6021 -0.1442 -0.0832 0.0442 251 LEU A CG 1789 C CD1 . LEU A 251 ? 0.7789 0.5813 0.6053 -0.1635 -0.0794 0.0373 251 LEU A CD1 1790 C CD2 . LEU A 251 ? 0.7295 0.6305 0.6118 -0.1598 -0.0974 0.0532 251 LEU A CD2 1791 N N . ASP A 252 ? 0.7999 0.5269 0.6071 -0.0949 -0.0574 0.0205 252 ASP A N 1792 C CA . ASP A 252 ? 0.8480 0.5333 0.6158 -0.0891 -0.0498 0.0073 252 ASP A CA 1793 C C . ASP A 252 ? 0.8863 0.5637 0.6189 -0.1204 -0.0550 0.0048 252 ASP A C 1794 O O . ASP A 252 ? 0.9098 0.5779 0.6239 -0.1486 -0.0626 0.0066 252 ASP A O 1795 C CB . ASP A 252 ? 0.9002 0.5220 0.6318 -0.0760 -0.0453 -0.0017 252 ASP A CB 1796 C CG . ASP A 252 ? 0.9521 0.5354 0.6536 -0.0548 -0.0346 -0.0179 252 ASP A CG 1797 O OD1 . ASP A 252 ? 1.0008 0.5661 0.6681 -0.0708 -0.0312 -0.0264 252 ASP A OD1 1798 O OD2 . ASP A 252 ? 0.9580 0.5314 0.6696 -0.0209 -0.0299 -0.0233 252 ASP A OD2 1799 N N . VAL A 253 ? 0.8973 0.5817 0.6194 -0.1180 -0.0505 0.0000 253 VAL A N 1800 C CA . VAL A 253 ? 0.9345 0.6177 0.6214 -0.1468 -0.0574 -0.0021 253 VAL A CA 1801 C C . VAL A 253 ? 0.9978 0.6349 0.6344 -0.1424 -0.0444 -0.0201 253 VAL A C 1802 O O . VAL A 253 ? 0.9895 0.6242 0.6361 -0.1143 -0.0295 -0.0271 253 VAL A O 1803 C CB . VAL A 253 ? 0.8927 0.6369 0.6106 -0.1521 -0.0677 0.0136 253 VAL A CB 1804 C CG1 . VAL A 253 ? 0.8444 0.6346 0.6081 -0.1564 -0.0808 0.0286 253 VAL A CG1 1805 C CG2 . VAL A 253 ? 0.8611 0.6212 0.6006 -0.1276 -0.0559 0.0164 253 VAL A CG2 1806 N N . GLU A 254 ? 1.0648 0.6689 0.6479 -0.1714 -0.0492 -0.0297 254 GLU A N 1807 C CA . GLU A 254 ? 1.1362 0.6942 0.6638 -0.1702 -0.0363 -0.0492 254 GLU A CA 1808 C C . GLU A 254 ? 1.1275 0.7294 0.6581 -0.1747 -0.0364 -0.0431 254 GLU A C 1809 O O . GLU A 254 ? 1.1226 0.7582 0.6522 -0.2004 -0.0543 -0.0312 254 GLU A O 1810 C CB . GLU A 254 ? 1.2161 0.7151 0.6780 -0.2040 -0.0419 -0.0632 254 GLU A CB 1811 C CG . GLU A 254 ? 1.2992 0.7352 0.6943 -0.2008 -0.0263 -0.0881 254 GLU A CG 1812 N N . ALA A 255 ? 1.1336 0.7373 0.6677 -0.1495 -0.0167 -0.0507 255 ALA A N 1813 C CA . ALA A 255 ? 1.1293 0.7719 0.6666 -0.1523 -0.0126 -0.0423 255 ALA A CA 1814 C C . ALA A 255 ? 1.1838 0.8218 0.6678 -0.1860 -0.0258 -0.0413 255 ALA A C 1815 O O . ALA A 255 ? 1.2555 0.8480 0.6787 -0.1986 -0.0190 -0.0616 255 ALA A O 1816 C CB . ALA A 255 ? 1.1439 0.7814 0.6778 -0.1277 0.0155 -0.0580 255 ALA A CB 1817 N N . GLY A 256 ? 1.1573 0.8413 0.6626 -0.1989 -0.0462 -0.0182 256 GLY A N 1818 C CA . GLY A 256 ? 1.2057 0.8971 0.6679 -0.2303 -0.0670 -0.0137 256 GLY A CA 1819 C C . GLY A 256 ? 1.1783 0.9085 0.6738 -0.2454 -0.0957 0.0015 256 GLY A C 1820 O O . GLY A 256 ? 1.2035 0.9608 0.6799 -0.2677 -0.1187 0.0103 256 GLY A O 1821 N N . GLU A 257 ? 1.1305 0.8681 0.6757 -0.2328 -0.0944 0.0042 257 GLU A N 1822 C CA . GLU A 257 ? 1.0995 0.8810 0.6846 -0.2448 -0.1164 0.0169 257 GLU A CA 1823 C C . GLU A 257 ? 1.0307 0.8625 0.6811 -0.2192 -0.1215 0.0390 257 GLU A C 1824 O O . GLU A 257 ? 0.9973 0.8717 0.6890 -0.2222 -0.1363 0.0488 257 GLU A O 1825 C CB . GLU A 257 ? 1.1070 0.8571 0.6926 -0.2543 -0.1108 0.0040 257 GLU A CB 1826 C CG . GLU A 257 ? 1.1927 0.8984 0.7150 -0.2909 -0.1144 -0.0150 257 GLU A CG 1827 C CD . GLU A 257 ? 1.2203 0.8847 0.7364 -0.3028 -0.1084 -0.0246 257 GLU A CD 1828 O OE1 . GLU A 257 ? 1.1715 0.8393 0.7293 -0.2788 -0.1000 -0.0172 257 GLU A OE1 1829 O OE2 . GLU A 257 ? 1.2896 0.9134 0.7532 -0.3387 -0.1121 -0.0396 257 GLU A OE2 1830 N N . GLU A 258 ? 1.0148 0.8409 0.6730 -0.1958 -0.1076 0.0451 258 GLU A N 1831 C CA . GLU A 258 ? 0.9628 0.8219 0.6736 -0.1724 -0.1096 0.0640 258 GLU A CA 1832 C C . GLU A 258 ? 0.9534 0.8605 0.6833 -0.1759 -0.1365 0.0836 258 GLU A C 1833 O O . GLU A 258 ? 0.9102 0.8498 0.6907 -0.1619 -0.1435 0.0934 258 GLU A O 1834 C CB . GLU A 258 ? 0.9700 0.8139 0.6709 -0.1582 -0.0922 0.0680 258 GLU A CB 1835 C CG . GLU A 258 ? 0.9697 0.7876 0.6784 -0.1436 -0.0653 0.0511 258 GLU A CG 1836 C CD . GLU A 258 ? 1.0346 0.8152 0.6907 -0.1525 -0.0504 0.0293 258 GLU A CD 1837 O OE1 . GLU A 258 ? 1.0565 0.8287 0.6982 -0.1457 -0.0299 0.0225 258 GLU A OE1 1838 O OE2 . GLU A 258 ? 1.0603 0.8192 0.6876 -0.1674 -0.0576 0.0176 258 GLU A OE2 1839 N N . ALA A 259 ? 0.9994 0.9120 0.6870 -0.1930 -0.1520 0.0880 259 ALA A N 1840 C CA . ALA A 259 ? 1.0031 0.9635 0.7032 -0.1916 -0.1810 0.1082 259 ALA A CA 1841 C C . ALA A 259 ? 0.9831 0.9949 0.7192 -0.2038 -0.2005 0.1058 259 ALA A C 1842 O O . ALA A 259 ? 0.9953 0.9972 0.7181 -0.2292 -0.1964 0.0874 259 ALA A O 1843 C CB . ALA A 259 ? 1.0678 1.0188 0.7051 -0.2078 -0.1937 0.1131 259 ALA A CB 1844 N N . GLY A 260 ? 0.9577 1.0231 0.7379 -0.1856 -0.2204 0.1239 260 GLY A N 1845 C CA . GLY A 260 ? 0.9367 1.0691 0.7598 -0.1954 -0.2391 0.1224 260 GLY A CA 1846 C C . GLY A 260 ? 0.8793 1.0247 0.7579 -0.1836 -0.2232 0.1167 260 GLY A C 1847 O O . GLY A 260 ? 0.8635 1.0682 0.7828 -0.1918 -0.2332 0.1143 260 GLY A O 1848 N N . LEU A 261 ? 0.8503 0.9449 0.7301 -0.1659 -0.1983 0.1140 261 LEU A N 1849 C CA . LEU A 261 ? 0.7992 0.8965 0.7219 -0.1543 -0.1821 0.1082 261 LEU A CA 1850 C C . LEU A 261 ? 0.7641 0.8845 0.7326 -0.1181 -0.1838 0.1226 261 LEU A C 1851 O O . LEU A 261 ? 0.7797 0.8938 0.7391 -0.0998 -0.1929 0.1378 261 LEU A O 1852 C CB . LEU A 261 ? 0.7964 0.8286 0.6944 -0.1548 -0.1566 0.0952 261 LEU A CB 1853 C CG . LEU A 261 ? 0.8258 0.8231 0.6839 -0.1848 -0.1493 0.0772 261 LEU A CG 1854 C CD1 . LEU A 261 ? 0.8226 0.7608 0.6641 -0.1723 -0.1262 0.0668 261 LEU A CD1 1855 C CD2 . LEU A 261 ? 0.8144 0.8444 0.6946 -0.2057 -0.1536 0.0719 261 LEU A CD2 1856 N N . ALA A 262 ? 0.7236 0.8636 0.7346 -0.1087 -0.1740 0.1176 262 ALA A N 1857 C CA . ALA A 262 ? 0.6968 0.8559 0.7503 -0.0743 -0.1737 0.1273 262 ALA A CA 1858 C C . ALA A 262 ? 0.6611 0.8120 0.7417 -0.0669 -0.1537 0.1170 262 ALA A C 1859 O O . ALA A 262 ? 0.6520 0.8226 0.7415 -0.0862 -0.1479 0.1063 262 ALA A O 1860 C CB . ALA A 262 ? 0.7028 0.9351 0.7924 -0.0636 -0.1962 0.1365 262 ALA A CB 1861 N N . CYS A 263 ? 0.6478 0.7670 0.7364 -0.0418 -0.1433 0.1204 263 CYS A N 1862 C CA . CYS A 263 ? 0.6187 0.7335 0.7325 -0.0312 -0.1271 0.1113 263 CYS A CA 1863 C C . CYS A 263 ? 0.6080 0.7720 0.7666 -0.0078 -0.1323 0.1150 263 CYS A C 1864 O O . CYS A 263 ? 0.6233 0.7846 0.7906 0.0184 -0.1405 0.1262 263 CYS A O 1865 C CB . CYS A 263 ? 0.6134 0.6739 0.7144 -0.0192 -0.1135 0.1098 263 CYS A CB 1866 S SG . CYS A 263 ? 0.5941 0.6462 0.7157 -0.0117 -0.0959 0.0960 263 CYS A SG 1867 N N . ARG A 264 ? 0.5891 0.7954 0.7729 -0.0172 -0.1265 0.1053 264 ARG A N 1868 C CA . ARG A 264 ? 0.5819 0.8464 0.8127 0.0046 -0.1279 0.1048 264 ARG A CA 1869 C C . ARG A 264 ? 0.5656 0.8153 0.8089 0.0151 -0.1073 0.0936 264 ARG A C 1870 O O . ARG A 264 ? 0.5586 0.7901 0.7849 -0.0073 -0.0943 0.0842 264 ARG A O 1871 C CB . ARG A 264 ? 0.5823 0.9220 0.8360 -0.0179 -0.1355 0.1009 264 ARG A CB 1872 C CG . ARG A 264 ? 0.5819 0.9998 0.8915 0.0068 -0.1385 0.0996 264 ARG A CG 1873 C CD . ARG A 264 ? 0.5924 1.0913 0.9271 -0.0250 -0.1407 0.0918 264 ARG A CD 1874 N NE . ARG A 264 ? 0.6038 1.1962 0.9966 0.0009 -0.1526 0.0931 264 ARG A NE 1875 C CZ . ARG A 264 ? 0.6242 1.2680 1.0314 0.0066 -0.1799 0.1027 264 ARG A CZ 1876 N NH1 . ARG A 264 ? 0.6409 1.2483 1.0040 -0.0157 -0.1967 0.1112 264 ARG A NH1 1877 N NH2 . ARG A 264 ? 0.6315 1.3665 1.0971 0.0364 -0.1910 0.1030 264 ARG A NH2 1878 N N . VAL A 265 ? 0.5685 0.8209 0.8360 0.0501 -0.1050 0.0944 265 VAL A N 1879 C CA . VAL A 265 ? 0.5586 0.7932 0.8333 0.0615 -0.0858 0.0821 265 VAL A CA 1880 C C . VAL A 265 ? 0.5600 0.8552 0.8792 0.0858 -0.0805 0.0752 265 VAL A C 1881 O O . VAL A 265 ? 0.5788 0.8856 0.9187 0.1200 -0.0897 0.0815 265 VAL A O 1882 C CB . VAL A 265 ? 0.5699 0.7329 0.8227 0.0786 -0.0819 0.0836 265 VAL A CB 1883 C CG1 . VAL A 265 ? 0.5654 0.7114 0.8215 0.0865 -0.0639 0.0685 265 VAL A CG1 1884 C CG2 . VAL A 265 ? 0.5648 0.6792 0.7797 0.0559 -0.0843 0.0880 265 VAL A CG2 1885 N N . LYS A 266 ? 0.5475 0.8787 0.8781 0.0688 -0.0647 0.0625 266 LYS A N 1886 C CA . LYS A 266 ? 0.5497 0.9439 0.9227 0.0889 -0.0531 0.0516 266 LYS A CA 1887 C C . LYS A 266 ? 0.5569 0.9106 0.9178 0.1018 -0.0323 0.0379 266 LYS A C 1888 O O . LYS A 266 ? 0.5499 0.8639 0.8770 0.0771 -0.0221 0.0327 266 LYS A O 1889 C CB . LYS A 266 ? 0.5391 1.0098 0.9323 0.0563 -0.0465 0.0455 266 LYS A CB 1890 C CG . LYS A 266 ? 0.5355 1.0657 0.9493 0.0433 -0.0674 0.0549 266 LYS A CG 1891 C CD . LYS A 266 ? 0.5303 1.1403 0.9664 0.0060 -0.0580 0.0460 266 LYS A CD 1892 N N . HIS A 267 ? 0.5763 0.9381 0.9619 0.1424 -0.0276 0.0316 267 HIS A N 1893 C CA . HIS A 267 ? 0.5920 0.9156 0.9650 0.1571 -0.0082 0.0158 267 HIS A CA 1894 C C . HIS A 267 ? 0.6145 0.9877 1.0282 0.1966 0.0031 0.0031 267 HIS A C 1895 O O . HIS A 267 ? 0.6293 1.0328 1.0746 0.2297 -0.0100 0.0105 267 HIS A O 1896 C CB . HIS A 267 ? 0.6069 0.8385 0.9444 0.1670 -0.0144 0.0199 267 HIS A CB 1897 C CG . HIS A 267 ? 0.6258 0.8117 0.9395 0.1689 0.0029 0.0025 267 HIS A CG 1898 N ND1 . HIS A 267 ? 0.6615 0.8404 0.9854 0.2023 0.0154 -0.0120 267 HIS A ND1 1899 C CD2 . HIS A 267 ? 0.6220 0.7681 0.9004 0.1425 0.0086 -0.0035 267 HIS A CD2 1900 C CE1 . HIS A 267 ? 0.6804 0.8158 0.9736 0.1924 0.0284 -0.0272 267 HIS A CE1 1901 N NE2 . HIS A 267 ? 0.6587 0.7768 0.9254 0.1567 0.0231 -0.0215 267 HIS A NE2 1902 N N . SER A 268 ? 0.6245 1.0043 1.0343 0.1955 0.0273 -0.0161 268 SER A N 1903 C CA . SER A 268 ? 0.6536 1.0815 1.0995 0.2330 0.0444 -0.0334 268 SER A CA 1904 C C . SER A 268 ? 0.6932 1.0803 1.1474 0.2872 0.0364 -0.0332 268 SER A C 1905 O O . SER A 268 ? 0.7145 1.1564 1.2113 0.3279 0.0415 -0.0415 268 SER A O 1906 C CB . SER A 268 ? 0.6679 1.0843 1.0897 0.2203 0.0726 -0.0550 268 SER A CB 1907 O OG . SER A 268 ? 0.6866 1.0062 1.0564 0.2134 0.0713 -0.0574 268 SER A OG 1908 N N . SER A 269 ? 0.7094 1.0003 1.1221 0.2875 0.0246 -0.0241 269 SER A N 1909 C CA . SER A 269 ? 0.7626 0.9898 1.1670 0.3325 0.0184 -0.0229 269 SER A CA 1910 C C . SER A 269 ? 0.7756 1.0165 1.2003 0.3593 -0.0077 0.0001 269 SER A C 1911 O O . SER A 269 ? 0.8296 1.0190 1.2468 0.4017 -0.0147 0.0044 269 SER A O 1912 C CB . SER A 269 ? 0.7812 0.8999 1.1298 0.3153 0.0187 -0.0239 269 SER A CB 1913 O OG . SER A 269 ? 0.7533 0.8450 1.0815 0.2848 0.0002 -0.0030 269 SER A OG 1914 N N . LEU A 270 ? 0.7344 1.0384 1.1785 0.3338 -0.0227 0.0149 270 LEU A N 1915 C CA . LEU A 270 ? 0.7463 1.0738 1.2074 0.3545 -0.0502 0.0370 270 LEU A CA 1916 C C . LEU A 270 ? 0.7577 1.1885 1.2814 0.3945 -0.0529 0.0316 270 LEU A C 1917 O O . LEU A 270 ? 0.7972 1.2300 1.3352 0.4403 -0.0723 0.0440 270 LEU A O 1918 C CB . LEU A 270 ? 0.7032 1.0488 1.1517 0.3070 -0.0660 0.0531 270 LEU A CB 1919 C CG . LEU A 270 ? 0.6854 0.9469 1.0798 0.2671 -0.0631 0.0572 270 LEU A CG 1920 C CD1 . LEU A 270 ? 0.6458 0.9408 1.0341 0.2220 -0.0726 0.0660 270 LEU A CD1 1921 C CD2 . LEU A 270 ? 0.7239 0.8918 1.0797 0.2837 -0.0744 0.0716 270 LEU A CD2 1922 N N . GLY A 271 ? 0.7282 1.2460 1.2879 0.3770 -0.0332 0.0132 271 GLY A N 1923 C CA . GLY A 271 ? 0.7349 1.3687 1.3622 0.4102 -0.0299 0.0029 271 GLY A CA 1924 C C . GLY A 271 ? 0.7148 1.4405 1.3805 0.4009 -0.0572 0.0190 271 GLY A C 1925 O O . GLY A 271 ? 0.7419 1.5254 1.4506 0.4490 -0.0748 0.0243 271 GLY A O 1926 N N . GLY A 272 ? 0.6753 1.4128 1.3229 0.3402 -0.0620 0.0263 272 GLY A N 1927 C CA . GLY A 272 ? 0.6593 1.4806 1.3353 0.3199 -0.0875 0.0391 272 GLY A CA 1928 C C . GLY A 272 ? 0.6865 1.4619 1.3398 0.3425 -0.1231 0.0646 272 GLY A C 1929 O O . GLY A 272 ? 0.7026 1.5537 1.3959 0.3705 -0.1483 0.0737 272 GLY A O 1930 N N . GLN A 273 ? 0.6951 1.3496 1.2835 0.3299 -0.1251 0.0760 273 GLN A N 1931 C CA . GLN A 273 ? 0.7237 1.3172 1.2749 0.3417 -0.1542 0.1012 273 GLN A CA 1932 C C . GLN A 273 ? 0.7101 1.1983 1.1956 0.3001 -0.1464 0.1064 273 GLN A C 1933 O O . GLN A 273 ? 0.7343 1.1279 1.1838 0.3135 -0.1360 0.1066 273 GLN A O 1934 C CB . GLN A 273 ? 0.7854 1.3345 1.3365 0.4093 -0.1641 0.1098 273 GLN A CB 1935 N N . ASP A 274 ? 0.6758 1.1840 1.1468 0.2492 -0.1514 0.1092 274 ASP A N 1936 C CA . ASP A 274 ? 0.6541 1.0859 1.0739 0.2065 -0.1394 0.1079 274 ASP A CA 1937 C C . ASP A 274 ? 0.6783 1.0250 1.0461 0.2047 -0.1531 0.1264 274 ASP A C 1938 O O . ASP A 274 ? 0.7048 1.0614 1.0662 0.2171 -0.1777 0.1439 274 ASP A O 1939 C CB . ASP A 274 ? 0.6204 1.1013 1.0415 0.1546 -0.1370 0.1015 274 ASP A CB 1940 C CG . ASP A 274 ? 0.6040 1.1620 1.0676 0.1448 -0.1181 0.0830 274 ASP A CG 1941 O OD1 . ASP A 274 ? 0.6095 1.1461 1.0767 0.1585 -0.0955 0.0700 274 ASP A OD1 1942 O OD2 . ASP A 274 ? 0.5954 1.2355 1.0855 0.1199 -0.1250 0.0805 274 ASP A OD2 1943 N N . ILE A 275 ? 0.6722 0.9394 1.0024 0.1881 -0.1366 0.1218 275 ILE A N 1944 C CA . ILE A 275 ? 0.6880 0.8798 0.9679 0.1732 -0.1422 0.1349 275 ILE A CA 1945 C C . ILE A 275 ? 0.6667 0.8845 0.9310 0.1338 -0.1512 0.1382 275 ILE A C 1946 O O . ILE A 275 ? 0.6346 0.8687 0.9003 0.1031 -0.1391 0.1251 275 ILE A O 1947 C CB . ILE A 275 ? 0.6813 0.8013 0.9350 0.1605 -0.1205 0.1241 275 ILE A CB 1948 C CG1 . ILE A 275 ? 0.7054 0.8003 0.9723 0.1936 -0.1086 0.1148 275 ILE A CG1 1949 C CG2 . ILE A 275 ? 0.7004 0.7507 0.9073 0.1452 -0.1234 0.1362 275 ILE A CG2 1950 N N . ILE A 276 ? 0.6930 0.9098 0.9372 0.1351 -0.1729 0.1557 276 ILE A N 1951 C CA . ILE A 276 ? 0.6834 0.9195 0.9058 0.0982 -0.1827 0.1577 276 ILE A CA 1952 C C . ILE A 276 ? 0.7101 0.8774 0.8773 0.0879 -0.1868 0.1709 276 ILE A C 1953 O O . ILE A 276 ? 0.7520 0.8980 0.9008 0.1095 -0.2025 0.1893 276 ILE A O 1954 C CB . ILE A 276 ? 0.6921 1.0151 0.9431 0.1001 -0.2070 0.1627 276 ILE A CB 1955 C CG1 . ILE A 276 ? 0.6729 1.0731 0.9853 0.1167 -0.2013 0.1503 276 ILE A CG1 1956 C CG2 . ILE A 276 ? 0.6850 1.0269 0.9127 0.0535 -0.2125 0.1577 276 ILE A CG2 1957 C CD1 . ILE A 276 ? 0.6944 1.1780 1.0476 0.1459 -0.2274 0.1591 276 ILE A CD1 1958 N N . LEU A 277 ? 0.6897 0.8221 0.8287 0.0561 -0.1718 0.1614 277 LEU A N 1959 C CA . LEU A 277 ? 0.7126 0.7851 0.8018 0.0431 -0.1690 0.1695 277 LEU A CA 1960 C C . LEU A 277 ? 0.7196 0.8029 0.7778 0.0120 -0.1764 0.1679 277 LEU A C 1961 O O . LEU A 277 ? 0.6961 0.7839 0.7524 -0.0119 -0.1655 0.1521 277 LEU A O 1962 C CB . LEU A 277 ? 0.6928 0.7143 0.7731 0.0356 -0.1444 0.1582 277 LEU A CB 1963 C CG . LEU A 277 ? 0.6980 0.6846 0.7900 0.0593 -0.1348 0.1593 277 LEU A CG 1964 C CD1 . LEU A 277 ? 0.6815 0.6263 0.7592 0.0426 -0.1142 0.1478 277 LEU A CD1 1965 C CD2 . LEU A 277 ? 0.7538 0.7074 0.8247 0.0809 -0.1474 0.1805 277 LEU A CD2 1966 N N . TYR A 278 ? 0.7599 0.8402 0.7873 0.0132 -0.1952 0.1843 278 TYR A N 1967 C CA . TYR A 278 ? 0.7780 0.8645 0.7675 -0.0163 -0.2039 0.1825 278 TYR A CA 1968 C C . TYR A 278 ? 0.7940 0.8184 0.7342 -0.0331 -0.1862 0.1803 278 TYR A C 1969 O O . TYR A 278 ? 0.8243 0.8073 0.7395 -0.0225 -0.1832 0.1944 278 TYR A O 1970 C CB . TYR A 278 ? 0.8228 0.9419 0.7998 -0.0074 -0.2352 0.2009 278 TYR A CB 1971 C CG . TYR A 278 ? 0.8138 1.0157 0.8422 0.0019 -0.2548 0.1987 278 TYR A CG 1972 C CD1 . TYR A 278 ? 0.8131 1.0429 0.8879 0.0410 -0.2611 0.2063 278 TYR A CD1 1973 C CD2 . TYR A 278 ? 0.8176 1.0715 0.8483 -0.0297 -0.2656 0.1872 278 TYR A CD2 1974 C CE1 . TYR A 278 ? 0.8027 1.1208 0.9312 0.0508 -0.2768 0.2022 278 TYR A CE1 1975 C CE2 . TYR A 278 ? 0.8057 1.1470 0.8883 -0.0261 -0.2821 0.1836 278 TYR A CE2 1976 C CZ . TYR A 278 ? 0.7947 1.1731 0.9293 0.0152 -0.2872 0.1911 278 TYR A CZ 1977 O OH . TYR A 278 ? 0.7801 1.2561 0.9720 0.0201 -0.3012 0.1856 278 TYR A OH 1978 N N . TRP A 279 ? 0.7786 0.7957 0.7036 -0.0590 -0.1731 0.1622 279 TRP A N 1979 C CA . TRP A 279 ? 0.7967 0.7662 0.6782 -0.0739 -0.1550 0.1561 279 TRP A CA 1980 C C . TRP A 279 ? 0.8550 0.8127 0.6839 -0.0838 -0.1680 0.1694 279 TRP A C 1981 O O . TRP A 279 ? 0.8763 0.8554 0.6832 -0.1010 -0.1835 0.1664 279 TRP A O 1982 C CB . TRP A 279 ? 0.7804 0.7427 0.6534 -0.0943 -0.1410 0.1332 279 TRP A CB 1983 C CG . TRP A 279 ? 0.8014 0.7222 0.6339 -0.1042 -0.1212 0.1247 279 TRP A CG 1984 C CD1 . TRP A 279 ? 0.8445 0.7493 0.6242 -0.1213 -0.1223 0.1239 279 TRP A CD1 1985 C CD2 . TRP A 279 ? 0.7824 0.6796 0.6258 -0.0971 -0.0968 0.1145 279 TRP A CD2 1986 N NE1 . TRP A 279 ? 0.8586 0.7324 0.6173 -0.1240 -0.0974 0.1130 279 TRP A NE1 1987 C CE2 . TRP A 279 ? 0.8172 0.6898 0.6175 -0.1091 -0.0824 0.1072 279 TRP A CE2 1988 C CE3 . TRP A 279 ? 0.7420 0.6410 0.6273 -0.0822 -0.0862 0.1094 279 TRP A CE3 1989 C CZ2 . TRP A 279 ? 0.8103 0.6683 0.6154 -0.1053 -0.0575 0.0948 279 TRP A CZ2 1990 C CZ3 . TRP A 279 ? 0.7316 0.6137 0.6187 -0.0800 -0.0646 0.0979 279 TRP A CZ3 1991 C CH2 . TRP A 279 ? 0.7626 0.6284 0.6135 -0.0908 -0.0505 0.0907 279 TRP A CH2 1992 N N . GLY A 280 ? 0.8888 0.8098 0.6929 -0.0760 -0.1614 0.1840 280 GLY A N 1993 C CA . GLY A 280 ? 0.9558 0.8547 0.6983 -0.0878 -0.1690 0.1975 280 GLY A CA 1994 C C . GLY A 280 ? 0.9997 0.9035 0.7305 -0.0690 -0.1973 0.2254 280 GLY A C 1995 O O . GLY A 280 ? 1.0594 0.9533 0.7363 -0.0781 -0.2120 0.2389 280 GLY A O 1996 N N . SER A 281 ? 0.9780 0.8960 0.7566 -0.0406 -0.2057 0.2337 281 SER A N 1997 C CA . SER A 281 ? 1.0262 0.9397 0.7969 -0.0127 -0.2308 0.2608 281 SER A CA 1998 C C . SER A 281 ? 1.0792 0.9183 0.8074 -0.0090 -0.2161 0.2781 281 SER A C 1999 O O . SER A 281 ? 1.0581 0.8651 0.7867 -0.0237 -0.1857 0.2656 281 SER A O 2000 C CB . SER A 281 ? 0.9866 0.9414 0.8249 0.0187 -0.2410 0.2593 281 SER A CB 2001 O OG . SER A 281 ? 0.9438 0.8765 0.8155 0.0226 -0.2139 0.2452 281 SER A OG 2002 N N . LEU A 282 ? 1.1545 0.9670 0.8449 0.0099 -0.2386 0.3069 282 LEU A N 2003 C CA . LEU A 282 ? 1.2271 0.9583 0.8659 0.0114 -0.2269 0.3278 282 LEU A CA 2004 C C . LEU A 282 ? 1.2027 0.8992 0.8765 0.0190 -0.2013 0.3188 282 LEU A C 2005 O O . LEU A 282 ? 1.2343 0.8722 0.8737 0.0000 -0.1770 0.3218 282 LEU A O 2006 C CB . LEU A 282 ? 1.3100 1.0160 0.9094 0.0414 -0.2606 0.3623 282 LEU A CB 2007 N N . HIS A 283 ? 1.1525 0.8885 0.8931 0.0438 -0.2062 0.3063 283 HIS A N 2008 C CA . HIS A 283 ? 1.1258 0.8382 0.9030 0.0497 -0.1834 0.2926 283 HIS A CA 2009 C C . HIS A 283 ? 1.0695 0.7924 0.8610 0.0156 -0.1529 0.2662 283 HIS A C 2010 O O . HIS A 283 ? 1.0837 0.7622 0.8633 0.0007 -0.1294 0.2622 283 HIS A O 2011 C CB . HIS A 283 ? 1.0863 0.8451 0.9278 0.0847 -0.1961 0.2845 283 HIS A CB 2012 C CG . HIS A 283 ? 1.0725 0.8045 0.9457 0.0931 -0.1751 0.2702 283 HIS A CG 2013 N ND1 . HIS A 283 ? 1.1392 0.7958 0.9866 0.1077 -0.1698 0.2828 283 HIS A ND1 2014 C CD2 . HIS A 283 ? 1.0099 0.7761 0.9326 0.0875 -0.1591 0.2442 283 HIS A CD2 2015 C CE1 . HIS A 283 ? 1.1097 0.7588 0.9913 0.1093 -0.1513 0.2630 283 HIS A CE1 2016 N NE2 . HIS A 283 ? 1.0313 0.7482 0.9588 0.0982 -0.1452 0.2402 283 HIS A NE2 2017 N N . HIS A 284 ? 1.0145 0.7948 0.8297 0.0031 -0.1540 0.2481 284 HIS A N 2018 C CA . HIS A 284 ? 0.9708 0.7598 0.7953 -0.0234 -0.1281 0.2239 284 HIS A CA 2019 C C . HIS A 284 ? 1.0150 0.7644 0.7870 -0.0500 -0.1092 0.2278 284 HIS A C 2020 O O . HIS A 284 ? 0.9998 0.7365 0.7806 -0.0644 -0.0838 0.2142 284 HIS A O 2021 C CB . HIS A 284 ? 0.9268 0.7691 0.7696 -0.0326 -0.1345 0.2070 284 HIS A CB 2022 C CG . HIS A 284 ? 0.9018 0.7464 0.7467 -0.0538 -0.1105 0.1836 284 HIS A CG 2023 N ND1 . HIS A 284 ? 0.8881 0.7145 0.7487 -0.0576 -0.0870 0.1725 284 HIS A ND1 2024 C CD2 . HIS A 284 ? 0.8926 0.7558 0.7264 -0.0701 -0.1076 0.1682 284 HIS A CD2 2025 C CE1 . HIS A 284 ? 0.8630 0.7016 0.7251 -0.0710 -0.0718 0.1524 284 HIS A CE1 2026 N NE2 . HIS A 284 ? 0.8689 0.7239 0.7123 -0.0779 -0.0830 0.1493 284 HIS A NE2 2027 N N . ILE A 285 ? 1.0724 0.8070 0.7898 -0.0571 -0.1217 0.2459 285 ILE A N 2028 C CA . ILE A 285 ? 1.1248 0.8223 0.7848 -0.0844 -0.1022 0.2509 285 ILE A CA 2029 C C . ILE A 285 ? 1.1635 0.8062 0.8113 -0.0885 -0.0850 0.2617 285 ILE A C 2030 O O . ILE A 285 ? 1.1634 0.7968 0.8069 -0.1133 -0.0556 0.2493 285 ILE A O 2031 C CB . ILE A 285 ? 1.1962 0.8807 0.7893 -0.0903 -0.1219 0.2723 285 ILE A CB 2032 C CG1 . ILE A 285 ? 1.1705 0.9091 0.7744 -0.0871 -0.1454 0.2632 285 ILE A CG1 2033 C CG2 . ILE A 285 ? 1.2488 0.9008 0.7803 -0.1229 -0.0962 0.2730 285 ILE A CG2 2034 C CD1 . ILE A 285 ? 1.1381 0.9046 0.7490 -0.1093 -0.1266 0.2328 285 ILE A CD1 2035 N N . LEU A 286 ? 1.2013 0.8092 0.8447 -0.0639 -0.1033 0.2834 286 LEU A N 2036 C CA . LEU A 286 ? 1.2579 0.7967 0.8766 -0.0685 -0.0900 0.2968 286 LEU A CA 2037 C C . LEU A 286 ? 1.2067 0.7504 0.8747 -0.0773 -0.0659 0.2730 286 LEU A C 2038 O O . LEU A 286 ? 1.2461 0.7494 0.8920 -0.1034 -0.0423 0.2729 286 LEU A O 2039 C CB . LEU A 286 ? 1.3153 0.8103 0.9176 -0.0325 -0.1172 0.3238 286 LEU A CB 2040 C CG . LEU A 286 ? 1.4190 0.8649 0.9433 -0.0288 -0.1365 0.3585 286 LEU A CG 2041 C CD1 . LEU A 286 ? 1.4654 0.8843 0.9897 0.0190 -0.1684 0.3814 286 LEU A CD1 2042 C CD2 . LEU A 286 ? 1.5054 0.8756 0.9602 -0.0651 -0.1107 0.3718 286 LEU A CD2 2043 N N . ASP A 287 ? 1.1259 0.7200 0.8575 -0.0582 -0.0721 0.2532 287 ASP A N 2044 C CA . ASP A 287 ? 1.0780 0.6806 0.8557 -0.0631 -0.0541 0.2306 287 ASP A CA 2045 C C . ASP A 287 ? 1.0381 0.6766 0.8293 -0.0928 -0.0295 0.2077 287 ASP A C 2046 O O . ASP A 287 ? 1.0480 0.6712 0.8407 -0.1152 -0.0078 0.1989 287 ASP A O 2047 C CB . ASP A 287 ? 1.0174 0.6597 0.8515 -0.0329 -0.0685 0.2184 287 ASP A CB 2048 N N . ALA A 288 ? 0.9995 0.6859 0.7995 -0.0927 -0.0332 0.1972 288 ALA A N 2049 C CA . ALA A 288 ? 0.9679 0.6895 0.7800 -0.1128 -0.0114 0.1744 288 ALA A CA 2050 C C . ALA A 288 ? 1.0206 0.7205 0.7945 -0.1443 0.0136 0.1772 288 ALA A C 2051 O O . ALA A 288 ? 0.9993 0.7307 0.7933 -0.1601 0.0362 0.1562 288 ALA A O 2052 C CB . ALA A 288 ? 0.9413 0.6985 0.7505 -0.1077 -0.0206 0.1663 288 ALA A CB 2053 N N . GLN A 289 ? 1.0930 0.7411 0.8113 -0.1525 0.0096 0.2034 289 GLN A N 2054 C CA . GLN A 289 ? 1.1556 0.7744 0.8298 -0.1869 0.0350 0.2096 289 GLN A CA 2055 C C . GLN A 289 ? 1.1686 0.7614 0.8606 -0.2021 0.0503 0.2060 289 GLN A C 2056 O O . GLN A 289 ? 1.1788 0.7868 0.8745 -0.2339 0.0785 0.1927 289 GLN A O 2057 C CB . GLN A 289 ? 1.2444 0.8077 0.8419 -0.1913 0.0237 0.2418 289 GLN A CB 2058 N N . LYS A 290 ? 1.1711 0.7284 0.8750 -0.1801 0.0323 0.2156 290 LYS A N 2059 C CA . LYS A 290 ? 1.1936 0.7129 0.9064 -0.1940 0.0437 0.2121 290 LYS A CA 2060 C C . LYS A 290 ? 1.1240 0.7036 0.8994 -0.2064 0.0600 0.1791 290 LYS A C 2061 O O . LYS A 290 ? 1.1445 0.7039 0.9296 -0.2262 0.0718 0.1710 290 LYS A O 2062 C CB . LYS A 290 ? 1.2089 0.6807 0.9239 -0.1601 0.0202 0.2248 290 LYS A CB 2063 C CG . LYS A 290 ? 1.2986 0.6961 0.9481 -0.1469 0.0040 0.2597 290 LYS A CG 2064 N N . MET A 291 ? 1.0482 0.6984 0.8619 -0.1954 0.0595 0.1602 291 MET A N 2065 C CA . MET A 291 ? 0.9814 0.6915 0.8550 -0.1979 0.0689 0.1305 291 MET A CA 2066 C C . MET A 291 ? 0.9510 0.7242 0.8412 -0.2106 0.0880 0.1112 291 MET A C 2067 O O . MET A 291 ? 0.8931 0.7213 0.8320 -0.1971 0.0872 0.0886 291 MET A O 2068 C CB . MET A 291 ? 0.9202 0.6512 0.8351 -0.1622 0.0469 0.1219 291 MET A CB 2069 C CG . MET A 291 ? 0.8970 0.6439 0.8068 -0.1363 0.0292 0.1285 291 MET A CG 2070 S SD . MET A 291 ? 0.8441 0.6215 0.8032 -0.1039 0.0102 0.1153 291 MET A SD 2071 C CE . MET A 291 ? 0.7934 0.6323 0.7888 -0.1074 0.0224 0.0873 291 MET A CE 2072 N N . VAL A 292 ? 0.9970 0.7603 0.8441 -0.2344 0.1055 0.1198 292 VAL A N 2073 C CA . VAL A 292 ? 0.9769 0.7997 0.8368 -0.2451 0.1276 0.0996 292 VAL A CA 2074 C C . VAL A 292 ? 0.9627 0.8353 0.8666 -0.2697 0.1509 0.0768 292 VAL A C 2075 O O . VAL A 292 ? 0.9895 0.8369 0.8945 -0.2928 0.1553 0.0808 292 VAL A O 2076 C CB . VAL A 292 ? 1.0413 0.8410 0.8368 -0.2645 0.1417 0.1139 292 VAL A CB 2077 C CG1 . VAL A 292 ? 1.0406 0.8183 0.8039 -0.2379 0.1173 0.1275 292 VAL A CG1 2078 C CG2 . VAL A 292 ? 1.1238 0.8611 0.8669 -0.2988 0.1527 0.1375 292 VAL A CG2 2079 N N . TRP A 293 ? 0.9253 0.8691 0.8652 -0.2637 0.1649 0.0519 293 TRP A N 2080 C CA . TRP A 293 ? 0.9036 0.9166 0.8978 -0.2806 0.1840 0.0263 293 TRP A CA 2081 C C . TRP A 293 ? 0.8882 0.9735 0.9050 -0.2722 0.2043 0.0027 293 TRP A C 2082 O O . TRP A 293 ? 0.8877 0.9625 0.8779 -0.2502 0.2012 0.0042 293 TRP A O 2083 C CB . TRP A 293 ? 0.8485 0.8821 0.8967 -0.2603 0.1627 0.0143 293 TRP A CB 2084 C CG . TRP A 293 ? 0.7851 0.8379 0.8575 -0.2139 0.1410 0.0057 293 TRP A CG 2085 C CD1 . TRP A 293 ? 0.7663 0.7751 0.8085 -0.1882 0.1216 0.0205 293 TRP A CD1 2086 C CD2 . TRP A 293 ? 0.7304 0.8488 0.8587 -0.1903 0.1359 -0.0187 293 TRP A CD2 2087 N NE1 . TRP A 293 ? 0.7167 0.7538 0.7886 -0.1545 0.1076 0.0068 293 TRP A NE1 2088 C CE2 . TRP A 293 ? 0.6954 0.7953 0.8174 -0.1525 0.1151 -0.0161 293 TRP A CE2 2089 C CE3 . TRP A 293 ? 0.7133 0.9062 0.8955 -0.1978 0.1458 -0.0424 293 TRP A CE3 2090 C CZ2 . TRP A 293 ? 0.6565 0.7976 0.8164 -0.1207 0.1043 -0.0340 293 TRP A CZ2 2091 C CZ3 . TRP A 293 ? 0.6681 0.9102 0.8931 -0.1618 0.1322 -0.0606 293 TRP A CZ3 2092 C CH2 . TRP A 293 ? 0.6408 0.8507 0.8505 -0.1232 0.1119 -0.0551 293 TRP A CH2 2093 N N . ASN A 294 ? 0.8782 1.0383 0.9447 -0.2890 0.2248 -0.0206 294 ASN A N 2094 C CA . ASN A 294 ? 0.8728 1.1098 0.9655 -0.2810 0.2489 -0.0457 294 ASN A CA 2095 C C . ASN A 294 ? 0.8225 1.0955 0.9510 -0.2275 0.2330 -0.0642 294 ASN A C 2096 O O . ASN A 294 ? 0.8294 1.1501 0.9685 -0.2119 0.2512 -0.0837 294 ASN A O 2097 C CB . ASN A 294 ? 0.8825 1.1995 1.0224 -0.3169 0.2764 -0.0658 294 ASN A CB 2098 C CG . ASN A 294 ? 0.8367 1.1991 1.0422 -0.3104 0.2579 -0.0800 294 ASN A CG 2099 O OD1 . ASN A 294 ? 0.7975 1.1423 1.0183 -0.2721 0.2270 -0.0787 294 ASN A OD1 2100 N ND2 . ASN A 294 ? 0.8521 1.2746 1.0942 -0.3513 0.2773 -0.0941 294 ASN A ND2 2101 N N . HIS A 295 ? 0.7833 1.0296 0.9264 -0.1996 0.2006 -0.0586 295 HIS A N 2102 C CA . HIS A 295 ? 0.7494 1.0073 0.9113 -0.1506 0.1824 -0.0704 295 HIS A CA 2103 C C . HIS A 295 ? 0.7221 1.0663 0.9508 -0.1260 0.1843 -0.0988 295 HIS A C 2104 O O . HIS A 295 ? 0.7067 1.0555 0.9445 -0.0835 0.1715 -0.1088 295 HIS A O 2105 C CB . HIS A 295 ? 0.7740 0.9955 0.8859 -0.1345 0.1875 -0.0677 295 HIS A CB 2106 C CG . HIS A 295 ? 0.7866 0.9270 0.8465 -0.1337 0.1655 -0.0419 295 HIS A CG 2107 N ND1 . HIS A 295 ? 0.8289 0.9212 0.8425 -0.1646 0.1680 -0.0184 295 HIS A ND1 2108 C CD2 . HIS A 295 ? 0.7702 0.8728 0.8181 -0.1060 0.1400 -0.0360 295 HIS A CD2 2109 C CE1 . HIS A 295 ? 0.8248 0.8616 0.8060 -0.1525 0.1437 -0.0002 295 HIS A CE1 2110 N NE2 . HIS A 295 ? 0.7880 0.8322 0.7904 -0.1201 0.1278 -0.0112 295 HIS A NE2 2111 N N . ARG A 296 ? 0.7242 1.1349 0.9972 -0.1530 0.1988 -0.1114 296 ARG A N 2112 C CA . ARG A 296 ? 0.6980 1.1993 1.0415 -0.1311 0.1940 -0.1369 296 ARG A CA 2113 C C . ARG A 296 ? 0.6815 1.1870 1.0514 -0.1512 0.1747 -0.1331 296 ARG A C 2114 O O . ARG A 296 ? 0.7076 1.1862 1.0595 -0.1977 0.1841 -0.1220 296 ARG A O 2115 C CB . ARG A 296 ? 0.7175 1.3145 1.1001 -0.1472 0.2284 -0.1607 296 ARG A CB 2116 C CG . ARG A 296 ? 0.7625 1.3463 1.1126 -0.2068 0.2601 -0.1511 296 ARG A CG 2117 C CD . ARG A 296 ? 0.7714 1.4641 1.1781 -0.2407 0.2893 -0.1746 296 ARG A CD 2118 N NE . ARG A 296 ? 0.7501 1.4724 1.1976 -0.2684 0.2746 -0.1774 296 ARG A NE 2119 C CZ . ARG A 296 ? 0.7254 1.5594 1.2505 -0.2657 0.2731 -0.2038 296 ARG A CZ 2120 N NH1 . ARG A 296 ? 0.7124 1.6444 1.2881 -0.2325 0.2866 -0.2298 296 ARG A NH1 2121 N NH2 . ARG A 296 ? 0.7157 1.5649 1.2673 -0.2959 0.2578 -0.2056 296 ARG A NH2 2122 N N . HIS A 297 ? 0.6505 1.1805 1.0553 -0.1177 0.1474 -0.1416 297 HIS A N 2123 C CA . HIS A 297 ? 0.6361 1.1789 1.0511 -0.0608 0.1331 -0.1510 297 HIS A CA 2124 C C . HIS A 297 ? 0.6302 1.0773 0.9955 -0.0393 0.1085 -0.1298 297 HIS A C 2125 O O . HIS A 297 ? 0.6118 1.0319 0.9764 -0.0428 0.0865 -0.1208 297 HIS A O 2126 C CB . HIS A 297 ? 0.6123 1.2402 1.0915 -0.0369 0.1155 -0.1713 297 HIS A CB 2127 C CG . HIS A 297 ? 0.6091 1.3389 1.1461 -0.0712 0.1331 -0.1911 297 HIS A CG 2128 N ND1 . HIS A 297 ? 0.6123 1.3364 1.1478 -0.1287 0.1408 -0.1857 297 HIS A ND1 2129 C CD2 . HIS A 297 ? 0.6059 1.4482 1.2049 -0.0568 0.1444 -0.2175 297 HIS A CD2 2130 C CE1 . HIS A 297 ? 0.6197 1.4481 1.2122 -0.1542 0.1570 -0.2078 297 HIS A CE1 2131 N NE2 . HIS A 297 ? 0.6089 1.5177 1.2451 -0.1104 0.1594 -0.2278 297 HIS A NE2 2132 N N . HIS A 298 ? 0.6512 1.0488 0.9740 -0.0198 0.1135 -0.1235 298 HIS A N 2133 C CA . HIS A 298 ? 0.6511 0.9687 0.9311 0.0000 0.0911 -0.1064 298 HIS A CA 2134 C C . HIS A 298 ? 0.6470 0.9757 0.9432 0.0468 0.0704 -0.1163 298 HIS A C 2135 O O . HIS A 298 ? 0.6504 1.0470 0.9882 0.0698 0.0738 -0.1363 298 HIS A O 2136 C CB . HIS A 298 ? 0.6772 0.9355 0.9010 -0.0039 0.1023 -0.0959 298 HIS A CB 2137 C CG . HIS A 298 ? 0.7057 0.9865 0.9255 0.0193 0.1203 -0.1141 298 HIS A CG 2138 N ND1 . HIS A 298 ? 0.7337 1.0461 0.9502 -0.0011 0.1508 -0.1229 298 HIS A ND1 2139 C CD2 . HIS A 298 ? 0.7235 0.9941 0.9370 0.0620 0.1137 -0.1258 298 HIS A CD2 2140 C CE1 . HIS A 298 ? 0.7632 1.0892 0.9752 0.0297 0.1630 -0.1416 298 HIS A CE1 2141 N NE2 . HIS A 298 ? 0.7602 1.0577 0.9696 0.0695 0.1402 -0.1435 298 HIS A NE2 2142 N N . HIS A 299 ? 0.6476 0.9114 0.9105 0.0609 0.0489 -0.1019 299 HIS A N 2143 C CA . HIS A 299 ? 0.6591 0.9138 0.9215 0.1033 0.0285 -0.1066 299 HIS A CA 2144 C C . HIS A 299 ? 0.6984 0.9235 0.9307 0.1338 0.0366 -0.1140 299 HIS A C 2145 O O . HIS A 299 ? 0.7161 0.8891 0.9046 0.1203 0.0469 -0.1064 299 HIS A O 2146 C CB . HIS A 299 ? 0.6496 0.8455 0.8837 0.1014 0.0058 -0.0887 299 HIS A CB 2147 C CG . HIS A 299 ? 0.6260 0.8513 0.8896 0.0849 -0.0062 -0.0873 299 HIS A CG 2148 N ND1 . HIS A 299 ? 0.6267 0.8570 0.8971 0.1057 -0.0291 -0.0884 299 HIS A ND1 2149 C CD2 . HIS A 299 ? 0.6114 0.8565 0.8931 0.0486 0.0016 -0.0855 299 HIS A CD2 2150 C CE1 . HIS A 299 ? 0.6093 0.8646 0.9019 0.0822 -0.0348 -0.0893 299 HIS A CE1 2151 N NE2 . HIS A 299 ? 0.5986 0.8605 0.8985 0.0474 -0.0160 -0.0879 299 HIS A NE2 2152 N N . HIS A 300 ? 0.7194 0.9770 0.9735 0.1760 0.0308 -0.1298 300 HIS A N 2153 C CA . HIS A 300 ? 0.7692 0.9965 0.9951 0.2121 0.0389 -0.1408 300 HIS A CA 2154 C C . HIS A 300 ? 0.7983 0.9248 0.9605 0.2245 0.0228 -0.1265 300 HIS A C 2155 O O . HIS A 300 ? 0.8359 0.9060 0.9514 0.2279 0.0335 -0.1287 300 HIS A O 2156 C CB . HIS A 300 ? 0.7871 1.0822 1.0587 0.2594 0.0356 -0.1620 300 HIS A CB 2157 C CG . HIS A 300 ? 0.8559 1.0956 1.0896 0.3101 0.0314 -0.1693 300 HIS A CG 2158 N ND1 . HIS A 300 ? 0.9065 1.1201 1.1114 0.3210 0.0554 -0.1827 300 HIS A ND1 2159 C CD2 . HIS A 300 ? 0.8953 1.0914 1.1076 0.3526 0.0062 -0.1649 300 HIS A CD2 2160 C CE1 . HIS A 300 ? 0.9660 1.1196 1.1343 0.3687 0.0455 -0.1875 300 HIS A CE1 2161 N NE2 . HIS A 300 ? 0.9636 1.1036 1.1347 0.3888 0.0154 -0.1755 300 HIS A NE2 2162 N N . GLN B 2 ? 1.0530 1.3754 0.7880 0.4700 0.0230 0.1867 2 GLN B N 2163 C CA . GLN B 2 ? 0.9865 1.3408 0.7730 0.4408 0.0205 0.1541 2 GLN B CA 2164 C C . GLN B 2 ? 1.0013 1.2176 0.7628 0.4249 0.0418 0.1369 2 GLN B C 2165 O O . GLN B 2 ? 1.0661 1.2100 0.7952 0.4683 0.0644 0.1528 2 GLN B O 2166 C CB . GLN B 2 ? 0.9853 1.4495 0.8108 0.4871 0.0199 0.1729 2 GLN B CB 2167 N N . LYS B 3 ? 0.9503 1.1312 0.7231 0.3637 0.0346 0.1049 3 LYS B N 2168 C CA . LYS B 3 ? 0.9563 1.0222 0.7090 0.3378 0.0475 0.0877 3 LYS B CA 2169 C C . LYS B 3 ? 0.8952 0.9938 0.6914 0.3116 0.0434 0.0596 3 LYS B C 2170 O O . LYS B 3 ? 0.8272 1.0107 0.6708 0.2795 0.0270 0.0406 3 LYS B O 2171 C CB . LYS B 3 ? 0.9511 0.9578 0.6882 0.2921 0.0443 0.0787 3 LYS B CB 2172 C CG . LYS B 3 ? 1.0282 0.9724 0.7108 0.3132 0.0549 0.1090 3 LYS B CG 2173 C CD . LYS B 3 ? 1.0220 0.9340 0.7007 0.2650 0.0528 0.1020 3 LYS B CD 2174 N N . THR B 4 ? 0.9297 0.9503 0.7005 0.3244 0.0601 0.0573 4 THR B N 2175 C CA . THR B 4 ? 0.8895 0.9333 0.6896 0.3116 0.0621 0.0379 4 THR B CA 2176 C C . THR B 4 ? 0.8335 0.8542 0.6538 0.2503 0.0500 0.0096 4 THR B C 2177 O O . THR B 4 ? 0.8567 0.7906 0.6465 0.2258 0.0503 0.0056 4 THR B O 2178 C CB . THR B 4 ? 0.9664 0.9223 0.7166 0.3503 0.0875 0.0454 4 THR B CB 2179 O OG1 . THR B 4 ? 1.0222 0.9948 0.7520 0.4169 0.1028 0.0761 4 THR B OG1 2180 C CG2 . THR B 4 ? 0.9400 0.9294 0.7170 0.3430 0.0930 0.0292 4 THR B CG2 2181 N N . PRO B 5 ? 0.7669 0.8668 0.6387 0.2251 0.0400 -0.0072 5 PRO B N 2182 C CA . PRO B 5 ? 0.7177 0.8017 0.6109 0.1741 0.0301 -0.0302 5 PRO B CA 2183 C C . PRO B 5 ? 0.7339 0.7418 0.6047 0.1620 0.0375 -0.0384 5 PRO B C 2184 O O . PRO B 5 ? 0.7538 0.7629 0.6168 0.1824 0.0494 -0.0369 5 PRO B O 2185 C CB . PRO B 5 ? 0.6654 0.8503 0.6103 0.1569 0.0211 -0.0419 5 PRO B CB 2186 C CG . PRO B 5 ? 0.6856 0.9353 0.6394 0.1965 0.0290 -0.0259 5 PRO B CG 2187 C CD . PRO B 5 ? 0.7413 0.9575 0.6553 0.2421 0.0368 -0.0023 5 PRO B CD 2188 N N . GLN B 6 ? 0.7312 0.6801 0.5913 0.1290 0.0304 -0.0454 6 GLN B N 2189 C CA . GLN B 6 ? 0.7420 0.6342 0.5856 0.1070 0.0299 -0.0543 6 GLN B CA 2190 C C . GLN B 6 ? 0.6829 0.6250 0.5737 0.0778 0.0210 -0.0674 6 GLN B C 2191 O O . GLN B 6 ? 0.6430 0.6356 0.5708 0.0644 0.0139 -0.0725 6 GLN B O 2192 C CB . GLN B 6 ? 0.7749 0.5900 0.5864 0.0830 0.0238 -0.0510 6 GLN B CB 2193 N N . ILE B 7 ? 0.6878 0.6075 0.5690 0.0692 0.0235 -0.0727 7 ILE B N 2194 C CA . ILE B 7 ? 0.6440 0.5985 0.5612 0.0450 0.0186 -0.0810 7 ILE B CA 2195 C C . ILE B 7 ? 0.6607 0.5595 0.5571 0.0222 0.0110 -0.0813 7 ILE B C 2196 O O . ILE B 7 ? 0.7114 0.5551 0.5597 0.0276 0.0146 -0.0799 7 ILE B O 2197 C CB . ILE B 7 ? 0.6395 0.6454 0.5712 0.0579 0.0308 -0.0821 7 ILE B CB 2198 C CG1 . ILE B 7 ? 0.6269 0.7049 0.5823 0.0795 0.0341 -0.0780 7 ILE B CG1 2199 C CG2 . ILE B 7 ? 0.6058 0.6376 0.5697 0.0282 0.0279 -0.0891 7 ILE B CG2 2200 C CD1 . ILE B 7 ? 0.6453 0.7729 0.6052 0.1072 0.0501 -0.0700 7 ILE B CD1 2201 N N . GLN B 8 ? 0.6265 0.5384 0.5547 -0.0017 0.0008 -0.0825 8 GLN B N 2202 C CA . GLN B 8 ? 0.6348 0.5132 0.5526 -0.0223 -0.0098 -0.0778 8 GLN B CA 2203 C C . GLN B 8 ? 0.6090 0.5124 0.5579 -0.0335 -0.0091 -0.0782 8 GLN B C 2204 O O . GLN B 8 ? 0.5817 0.5155 0.5670 -0.0365 -0.0065 -0.0823 8 GLN B O 2205 C CB . GLN B 8 ? 0.6329 0.4988 0.5578 -0.0372 -0.0230 -0.0700 8 GLN B CB 2206 C CG . GLN B 8 ? 0.6843 0.5014 0.5638 -0.0383 -0.0256 -0.0668 8 GLN B CG 2207 C CD . GLN B 8 ? 0.6843 0.5105 0.5833 -0.0500 -0.0319 -0.0581 8 GLN B CD 2208 O OE1 . GLN B 8 ? 0.6723 0.5265 0.5912 -0.0361 -0.0234 -0.0585 8 GLN B OE1 2209 N NE2 . GLN B 8 ? 0.7082 0.5177 0.6011 -0.0778 -0.0471 -0.0485 8 GLN B NE2 2210 N N . VAL B 9 ? 0.6275 0.5093 0.5537 -0.0400 -0.0097 -0.0740 9 VAL B N 2211 C CA . VAL B 9 ? 0.6107 0.5038 0.5565 -0.0501 -0.0066 -0.0702 9 VAL B CA 2212 C C . VAL B 9 ? 0.6294 0.4977 0.5646 -0.0623 -0.0221 -0.0556 9 VAL B C 2213 O O . VAL B 9 ? 0.6685 0.5075 0.5603 -0.0673 -0.0304 -0.0516 9 VAL B O 2214 C CB . VAL B 9 ? 0.6252 0.5279 0.5558 -0.0460 0.0096 -0.0729 9 VAL B CB 2215 C CG1 . VAL B 9 ? 0.6180 0.5306 0.5714 -0.0610 0.0160 -0.0684 9 VAL B CG1 2216 C CG2 . VAL B 9 ? 0.6034 0.5440 0.5433 -0.0294 0.0222 -0.0817 9 VAL B CG2 2217 N N . TYR B 10 ? 0.6089 0.4886 0.5798 -0.0658 -0.0254 -0.0471 10 TYR B N 2218 C CA . TYR B 10 ? 0.6225 0.4951 0.5944 -0.0716 -0.0407 -0.0268 10 TYR B CA 2219 C C . TYR B 10 ? 0.6292 0.5010 0.6278 -0.0668 -0.0310 -0.0173 10 TYR B C 2220 O O . TYR B 10 ? 0.6195 0.4917 0.6346 -0.0651 -0.0138 -0.0305 10 TYR B O 2221 C CB . TYR B 10 ? 0.6065 0.4962 0.5974 -0.0744 -0.0563 -0.0186 10 TYR B CB 2222 C CG . TYR B 10 ? 0.5610 0.4714 0.5863 -0.0650 -0.0454 -0.0286 10 TYR B CG 2223 C CD1 . TYR B 10 ? 0.5375 0.4466 0.5517 -0.0605 -0.0346 -0.0474 10 TYR B CD1 2224 C CD2 . TYR B 10 ? 0.5349 0.4694 0.6010 -0.0573 -0.0446 -0.0170 10 TYR B CD2 2225 C CE1 . TYR B 10 ? 0.4995 0.4285 0.5368 -0.0529 -0.0262 -0.0556 10 TYR B CE1 2226 C CE2 . TYR B 10 ? 0.5049 0.4548 0.5928 -0.0483 -0.0320 -0.0275 10 TYR B CE2 2227 C CZ . TYR B 10 ? 0.4859 0.4317 0.5564 -0.0485 -0.0245 -0.0474 10 TYR B CZ 2228 O OH . TYR B 10 ? 0.4828 0.4450 0.5670 -0.0407 -0.0138 -0.0571 10 TYR B OH 2229 N N . SER B 11 ? 0.6583 0.5258 0.6564 -0.0656 -0.0422 0.0064 11 SER B N 2230 C CA . SER B 11 ? 0.6818 0.5348 0.6987 -0.0551 -0.0308 0.0210 11 SER B CA 2231 C C . SER B 11 ? 0.6789 0.5525 0.7346 -0.0372 -0.0362 0.0399 11 SER B C 2232 O O . SER B 11 ? 0.6645 0.5741 0.7328 -0.0391 -0.0556 0.0502 11 SER B O 2233 C CB . SER B 11 ? 0.7260 0.5570 0.7102 -0.0592 -0.0339 0.0407 11 SER B CB 2234 O OG . SER B 11 ? 0.7492 0.5989 0.7250 -0.0582 -0.0598 0.0656 11 SER B OG 2235 N N . ARG B 12 ? 0.7043 0.5537 0.7769 -0.0204 -0.0170 0.0456 12 ARG B N 2236 C CA . ARG B 12 ? 0.7145 0.5824 0.8252 0.0062 -0.0135 0.0639 12 ARG B CA 2237 C C . ARG B 12 ? 0.7410 0.6344 0.8623 0.0215 -0.0313 0.1054 12 ARG B C 2238 O O . ARG B 12 ? 0.7295 0.6760 0.8886 0.0361 -0.0419 0.1260 12 ARG B O 2239 C CB . ARG B 12 ? 0.7464 0.5654 0.8607 0.0224 0.0178 0.0523 12 ARG B CB 2240 C CG . ARG B 12 ? 0.7398 0.5788 0.8823 0.0390 0.0301 0.0408 12 ARG B CG 2241 C CD . ARG B 12 ? 0.7865 0.6337 0.9598 0.0798 0.0417 0.0707 12 ARG B CD 2242 N NE . ARG B 12 ? 0.7678 0.6824 0.9715 0.0889 0.0156 0.1092 12 ARG B NE 2243 C CZ . ARG B 12 ? 0.7906 0.7408 1.0326 0.1265 0.0202 0.1443 12 ARG B CZ 2244 N NH1 . ARG B 12 ? 0.8346 0.7469 1.0839 0.1647 0.0548 0.1444 12 ARG B NH1 2245 N NH2 . ARG B 12 ? 0.7770 0.8022 1.0478 0.1264 -0.0093 0.1800 12 ARG B NH2 2246 N N . HIS B 13 ? 0.7795 0.6431 0.8687 0.0173 -0.0349 0.1202 13 HIS B N 2247 C CA . HIS B 13 ? 0.8133 0.7056 0.9039 0.0295 -0.0565 0.1620 13 HIS B CA 2248 C C . HIS B 13 ? 0.8213 0.7188 0.8648 -0.0009 -0.0812 0.1611 13 HIS B C 2249 O O . HIS B 13 ? 0.8129 0.6801 0.8233 -0.0230 -0.0728 0.1310 13 HIS B O 2250 C CB . HIS B 13 ? 0.8760 0.7187 0.9611 0.0592 -0.0357 0.1880 13 HIS B CB 2251 C CG . HIS B 13 ? 0.8924 0.6967 1.0010 0.0862 -0.0021 0.1781 13 HIS B CG 2252 N ND1 . HIS B 13 ? 0.8891 0.7356 1.0450 0.1192 0.0020 0.1928 13 HIS B ND1 2253 C CD2 . HIS B 13 ? 0.9269 0.6531 1.0130 0.0824 0.0297 0.1531 13 HIS B CD2 2254 C CE1 . HIS B 13 ? 0.9228 0.7098 1.0776 0.1388 0.0375 0.1755 13 HIS B CE1 2255 N NE2 . HIS B 13 ? 0.9509 0.6618 1.0616 0.1137 0.0529 0.1501 13 HIS B NE2 2256 N N . PRO B 14 ? 0.8457 0.7850 0.8835 -0.0013 -0.1115 0.1946 14 PRO B N 2257 C CA . PRO B 14 ? 0.8733 0.8048 0.8506 -0.0294 -0.1331 0.1940 14 PRO B CA 2258 C C . PRO B 14 ? 0.9014 0.7664 0.8325 -0.0329 -0.1078 0.1824 14 PRO B C 2259 O O . PRO B 14 ? 0.9314 0.7622 0.8697 -0.0121 -0.0863 0.1991 14 PRO B O 2260 C CB . PRO B 14 ? 0.9148 0.8932 0.8953 -0.0185 -0.1623 0.2414 14 PRO B CB 2261 C CG . PRO B 14 ? 0.8890 0.9296 0.9424 0.0054 -0.1662 0.2619 14 PRO B CG 2262 C CD . PRO B 14 ? 0.8532 0.8571 0.9395 0.0236 -0.1279 0.2349 14 PRO B CD 2263 N N . PRO B 15 ? 0.9006 0.7447 0.7834 -0.0585 -0.1069 0.1549 15 PRO B N 2264 C CA . PRO B 15 ? 0.9272 0.7236 0.7708 -0.0635 -0.0815 0.1474 15 PRO B CA 2265 C C . PRO B 15 ? 0.9922 0.7763 0.7918 -0.0607 -0.0908 0.1827 15 PRO B C 2266 O O . PRO B 15 ? 1.0234 0.8293 0.7852 -0.0716 -0.1204 0.1942 15 PRO B O 2267 C CB . PRO B 15 ? 0.9173 0.7075 0.7216 -0.0842 -0.0798 0.1137 15 PRO B CB 2268 C CG . PRO B 15 ? 0.8818 0.7021 0.7091 -0.0901 -0.0997 0.0990 15 PRO B CG 2269 C CD . PRO B 15 ? 0.8862 0.7459 0.7461 -0.0823 -0.1256 0.1311 15 PRO B CD 2270 N N . GLU B 16 ? 1.0241 0.7698 0.8236 -0.0488 -0.0663 0.2006 16 GLU B N 2271 C CA . GLU B 16 ? 1.0933 0.8184 0.8447 -0.0449 -0.0693 0.2369 16 GLU B CA 2272 C C . GLU B 16 ? 1.1219 0.7932 0.8495 -0.0550 -0.0311 0.2311 16 GLU B C 2273 O O . GLU B 16 ? 1.1166 0.7552 0.8774 -0.0509 -0.0048 0.2256 16 GLU B O 2274 C CB . GLU B 16 ? 1.1242 0.8599 0.9030 -0.0131 -0.0814 0.2825 16 GLU B CB 2275 N N . ASN B 17 ? 1.1594 0.8221 0.8261 -0.0716 -0.0273 0.2312 17 ASN B N 2276 C CA . ASN B 17 ? 1.1858 0.8143 0.8317 -0.0873 0.0099 0.2251 17 ASN B CA 2277 C C . ASN B 17 ? 1.2377 0.8146 0.8928 -0.0805 0.0327 0.2553 17 ASN B C 2278 O O . ASN B 17 ? 1.2952 0.8542 0.9294 -0.0614 0.0214 0.2965 17 ASN B O 2279 C CB . ASN B 17 ? 1.2362 0.8647 0.8071 -0.0994 0.0114 0.2296 17 ASN B CB 2280 C CG . ASN B 17 ? 1.2067 0.8641 0.7547 -0.1066 -0.0023 0.1947 17 ASN B CG 2281 O OD1 . ASN B 17 ? 1.1667 0.8352 0.7348 -0.1127 0.0172 0.1620 17 ASN B OD1 2282 N ND2 . ASN B 17 ? 1.2378 0.9048 0.7384 -0.1068 -0.0359 0.2030 17 ASN B ND2 2283 N N . GLY B 18 ? 1.2261 0.7774 0.9097 -0.0968 0.0639 0.2358 18 GLY B N 2284 C CA . GLY B 18 ? 1.2903 0.7736 0.9729 -0.0989 0.0907 0.2587 18 GLY B CA 2285 C C . GLY B 18 ? 1.2944 0.7428 1.0159 -0.0742 0.0903 0.2635 18 GLY B C 2286 O O . GLY B 18 ? 1.3630 0.7370 1.0765 -0.0743 0.1158 0.2795 18 GLY B O 2287 N N . LYS B 19 ? 1.2315 0.7276 0.9901 -0.0530 0.0647 0.2505 19 LYS B N 2288 C CA . LYS B 19 ? 1.2336 0.7078 1.0317 -0.0242 0.0670 0.2533 19 LYS B CA 2289 C C . LYS B 19 ? 1.1695 0.6613 1.0086 -0.0387 0.0738 0.2050 19 LYS B C 2290 O O . LYS B 19 ? 1.0992 0.6548 0.9539 -0.0489 0.0556 0.1794 19 LYS B O 2291 C CB . LYS B 19 ? 1.2191 0.7443 1.0338 0.0132 0.0340 0.2833 19 LYS B CB 2292 N N . PRO B 20 ? 1.2072 0.6356 1.0559 -0.0399 0.1006 0.1926 20 PRO B N 2293 C CA . PRO B 20 ? 1.1603 0.5995 1.0381 -0.0575 0.1083 0.1468 20 PRO B CA 2294 C C . PRO B 20 ? 1.0893 0.5908 1.0077 -0.0324 0.0869 0.1341 20 PRO B C 2295 O O . PRO B 20 ? 1.1052 0.6056 1.0398 0.0064 0.0817 0.1578 20 PRO B O 2296 C CB . PRO B 20 ? 1.2461 0.5860 1.1094 -0.0581 0.1402 0.1443 20 PRO B CB 2297 C CG . PRO B 20 ? 1.3269 0.6118 1.1674 -0.0200 0.1460 0.1939 20 PRO B CG 2298 C CD . PRO B 20 ? 1.3122 0.6441 1.1340 -0.0260 0.1266 0.2216 20 PRO B CD 2299 N N . ASN B 21 ? 1.0176 0.5756 0.9528 -0.0535 0.0766 0.1003 21 ASN B N 2300 C CA . ASN B 21 ? 0.9526 0.5682 0.9220 -0.0379 0.0583 0.0861 21 ASN B CA 2301 C C . ASN B 21 ? 0.9214 0.5422 0.9060 -0.0562 0.0695 0.0447 21 ASN B C 2302 O O . ASN B 21 ? 0.9539 0.5372 0.9244 -0.0827 0.0889 0.0274 21 ASN B O 2303 C CB . ASN B 21 ? 0.9053 0.5834 0.8693 -0.0433 0.0305 0.0899 21 ASN B CB 2304 C CG . ASN B 21 ? 0.8700 0.5993 0.8633 -0.0236 0.0070 0.0964 21 ASN B CG 2305 O OD1 . ASN B 21 ? 0.8443 0.5906 0.8671 -0.0178 0.0104 0.0774 21 ASN B OD1 2306 N ND2 . ASN B 21 ? 0.8861 0.6440 0.8688 -0.0173 -0.0175 0.1240 21 ASN B ND2 2307 N N . ILE B 22 ? 0.8655 0.5351 0.8768 -0.0452 0.0564 0.0308 22 ILE B N 2308 C CA . ILE B 22 ? 0.8336 0.5198 0.8560 -0.0599 0.0623 -0.0054 22 ILE B CA 2309 C C . ILE B 22 ? 0.7689 0.5205 0.7993 -0.0666 0.0426 -0.0163 22 ILE B C 2310 O O . ILE B 22 ? 0.7399 0.5232 0.7818 -0.0511 0.0250 -0.0043 22 ILE B O 2311 C CB . ILE B 22 ? 0.8432 0.5138 0.8826 -0.0364 0.0727 -0.0128 22 ILE B CB 2312 C CG1 . ILE B 22 ? 0.9201 0.5185 0.9478 -0.0141 0.0933 0.0068 22 ILE B CG1 2313 C CG2 . ILE B 22 ? 0.8364 0.5065 0.8718 -0.0570 0.0825 -0.0511 22 ILE B CG2 2314 N N . LEU B 23 ? 0.7541 0.5255 0.7775 -0.0900 0.0465 -0.0370 23 LEU B N 2315 C CA . LEU B 23 ? 0.7102 0.5319 0.7340 -0.0904 0.0335 -0.0460 23 LEU B CA 2316 C C . LEU B 23 ? 0.6780 0.5277 0.7196 -0.0853 0.0307 -0.0661 23 LEU B C 2317 O O . LEU B 23 ? 0.6888 0.5330 0.7367 -0.0949 0.0413 -0.0840 23 LEU B O 2318 C CB . LEU B 23 ? 0.7143 0.5557 0.7253 -0.1091 0.0417 -0.0526 23 LEU B CB 2319 C CG . LEU B 23 ? 0.6908 0.5666 0.6878 -0.1007 0.0339 -0.0537 23 LEU B CG 2320 C CD1 . LEU B 23 ? 0.7057 0.5602 0.6745 -0.0901 0.0204 -0.0350 23 LEU B CD1 2321 C CD2 . LEU B 23 ? 0.6953 0.6001 0.6877 -0.1136 0.0488 -0.0578 23 LEU B CD2 2322 N N . ASN B 24 ? 0.6500 0.5248 0.6929 -0.0731 0.0165 -0.0630 24 ASN B N 2323 C CA . ASN B 24 ? 0.6233 0.5239 0.6783 -0.0670 0.0143 -0.0773 24 ASN B CA 2324 C C . ASN B 24 ? 0.6056 0.5360 0.6487 -0.0677 0.0111 -0.0862 24 ASN B C 2325 O O . ASN B 24 ? 0.6132 0.5390 0.6357 -0.0654 0.0065 -0.0780 24 ASN B O 2326 C CB . ASN B 24 ? 0.6104 0.5152 0.6774 -0.0531 0.0039 -0.0638 24 ASN B CB 2327 C CG . ASN B 24 ? 0.6392 0.5260 0.7252 -0.0416 0.0117 -0.0528 24 ASN B CG 2328 O OD1 . ASN B 24 ? 0.6734 0.5289 0.7562 -0.0437 0.0274 -0.0599 24 ASN B OD1 2329 N ND2 . ASN B 24 ? 0.6343 0.5399 0.7392 -0.0294 0.0024 -0.0339 24 ASN B ND2 2330 N N . CYS B 25 ? 0.5928 0.5519 0.6440 -0.0686 0.0150 -0.1022 25 CYS B N 2331 C CA . CYS B 25 ? 0.5809 0.5726 0.6237 -0.0588 0.0123 -0.1057 25 CYS B CA 2332 C C . CYS B 25 ? 0.5649 0.5718 0.6124 -0.0494 0.0087 -0.1114 25 CYS B C 2333 O O . CYS B 25 ? 0.5660 0.5882 0.6230 -0.0568 0.0123 -0.1244 25 CYS B O 2334 C CB . CYS B 25 ? 0.5841 0.6167 0.6327 -0.0675 0.0199 -0.1132 25 CYS B CB 2335 S SG . CYS B 25 ? 0.5945 0.6704 0.6342 -0.0415 0.0193 -0.1101 25 CYS B SG 2336 N N . TYR B 26 ? 0.5614 0.5586 0.5950 -0.0359 0.0026 -0.1021 26 TYR B N 2337 C CA . TYR B 26 ? 0.5556 0.5582 0.5914 -0.0288 0.0006 -0.1014 26 TYR B CA 2338 C C . TYR B 26 ? 0.5632 0.5790 0.5791 -0.0123 0.0002 -0.0987 26 TYR B C 2339 O O . TYR B 26 ? 0.5864 0.5711 0.5786 -0.0051 -0.0024 -0.0882 26 TYR B O 2340 C CB . TYR B 26 ? 0.5568 0.5334 0.5967 -0.0323 -0.0053 -0.0876 26 TYR B CB 2341 C CG . TYR B 26 ? 0.5569 0.5421 0.6027 -0.0282 -0.0047 -0.0822 26 TYR B CG 2342 C CD1 . TYR B 26 ? 0.5621 0.5676 0.6209 -0.0239 0.0048 -0.0915 26 TYR B CD1 2343 C CD2 . TYR B 26 ? 0.5712 0.5398 0.6039 -0.0320 -0.0121 -0.0680 26 TYR B CD2 2344 C CE1 . TYR B 26 ? 0.5689 0.5853 0.6307 -0.0190 0.0091 -0.0844 26 TYR B CE1 2345 C CE2 . TYR B 26 ? 0.5780 0.5575 0.6174 -0.0321 -0.0091 -0.0595 26 TYR B CE2 2346 C CZ . TYR B 26 ? 0.5710 0.5779 0.6268 -0.0233 0.0025 -0.0666 26 TYR B CZ 2347 O OH . TYR B 26 ? 0.5840 0.6047 0.6440 -0.0221 0.0090 -0.0566 26 TYR B OH 2348 N N . VAL B 27 ? 0.5553 0.6148 0.5770 -0.0074 0.0026 -0.1072 27 VAL B N 2349 C CA . VAL B 27 ? 0.5635 0.6471 0.5694 0.0151 0.0031 -0.1004 27 VAL B CA 2350 C C . VAL B 27 ? 0.5728 0.6503 0.5670 0.0231 0.0019 -0.0944 27 VAL B C 2351 O O . VAL B 27 ? 0.5702 0.6701 0.5738 0.0140 0.0015 -0.1036 27 VAL B O 2352 C CB . VAL B 27 ? 0.5561 0.7090 0.5782 0.0146 0.0023 -0.1080 27 VAL B CB 2353 C CG1 . VAL B 27 ? 0.5719 0.7555 0.5825 0.0471 0.0051 -0.0936 27 VAL B CG1 2354 C CG2 . VAL B 27 ? 0.5424 0.7065 0.5841 -0.0082 0.0049 -0.1174 27 VAL B CG2 2355 N N . THR B 28 ? 0.5976 0.6380 0.5644 0.0386 0.0036 -0.0794 28 THR B N 2356 C CA . THR B 28 ? 0.6125 0.6404 0.5655 0.0422 0.0048 -0.0695 28 THR B CA 2357 C C . THR B 28 ? 0.6508 0.6601 0.5677 0.0696 0.0093 -0.0527 28 THR B C 2358 O O . THR B 28 ? 0.6714 0.6753 0.5731 0.0914 0.0131 -0.0484 28 THR B O 2359 C CB . THR B 28 ? 0.6177 0.6032 0.5732 0.0215 0.0037 -0.0630 28 THR B CB 2360 O OG1 . THR B 28 ? 0.6589 0.5875 0.5843 0.0198 0.0020 -0.0540 28 THR B OG1 2361 C CG2 . THR B 28 ? 0.5872 0.5855 0.5764 0.0031 0.0012 -0.0732 28 THR B CG2 2362 N N . GLN B 29 ? 0.6695 0.6661 0.5709 0.0708 0.0121 -0.0410 29 GLN B N 2363 C CA . GLN B 29 ? 0.7203 0.6858 0.5804 0.0967 0.0188 -0.0203 29 GLN B CA 2364 C C . GLN B 29 ? 0.7290 0.7413 0.5829 0.1341 0.0194 -0.0141 29 GLN B C 2365 O O . GLN B 29 ? 0.7771 0.7527 0.6002 0.1643 0.0278 -0.0003 29 GLN B O 2366 C CB . GLN B 29 ? 0.7700 0.6444 0.5923 0.0914 0.0240 -0.0108 29 GLN B CB 2367 N N . PHE B 30 ? 0.6912 0.7851 0.5720 0.1318 0.0111 -0.0237 30 PHE B N 2368 C CA . PHE B 30 ? 0.6949 0.8595 0.5798 0.1616 0.0068 -0.0156 30 PHE B CA 2369 C C . PHE B 30 ? 0.7027 0.9292 0.5816 0.1655 -0.0018 -0.0108 30 PHE B C 2370 O O . PHE B 30 ? 0.6944 0.9178 0.5718 0.1399 -0.0034 -0.0226 30 PHE B O 2371 C CB . PHE B 30 ? 0.6543 0.8742 0.5776 0.1498 0.0013 -0.0326 30 PHE B CB 2372 C CG . PHE B 30 ? 0.6121 0.8703 0.5631 0.1094 -0.0083 -0.0581 30 PHE B CG 2373 C CD1 . PHE B 30 ? 0.5924 0.7996 0.5527 0.0795 -0.0050 -0.0740 30 PHE B CD1 2374 C CD2 . PHE B 30 ? 0.6051 0.9483 0.5691 0.1011 -0.0207 -0.0657 30 PHE B CD2 2375 C CE1 . PHE B 30 ? 0.5691 0.7961 0.5471 0.0482 -0.0089 -0.0968 30 PHE B CE1 2376 C CE2 . PHE B 30 ? 0.5902 0.9495 0.5667 0.0611 -0.0268 -0.0929 30 PHE B CE2 2377 C CZ . PHE B 30 ? 0.5752 0.8695 0.5568 0.0377 -0.0185 -0.1084 30 PHE B CZ 2378 N N . HIS B 31 ? 0.7252 1.0115 0.5987 0.2005 -0.0065 0.0081 31 HIS B N 2379 C CA . HIS B 31 ? 0.7451 1.0961 0.6040 0.2101 -0.0176 0.0187 31 HIS B CA 2380 C C . HIS B 31 ? 0.7585 1.1991 0.6309 0.2478 -0.0261 0.0394 31 HIS B C 2381 O O . HIS B 31 ? 0.7833 1.1979 0.6521 0.2869 -0.0132 0.0594 31 HIS B O 2382 C CB . HIS B 31 ? 0.7963 1.0805 0.6076 0.2286 -0.0063 0.0430 31 HIS B CB 2383 C CG . HIS B 31 ? 0.8310 1.1735 0.6176 0.2374 -0.0162 0.0555 31 HIS B CG 2384 N ND1 . HIS B 31 ? 0.8301 1.1746 0.6041 0.2054 -0.0176 0.0387 31 HIS B ND1 2385 C CD2 . HIS B 31 ? 0.8768 1.2799 0.6452 0.2773 -0.0245 0.0848 31 HIS B CD2 2386 C CE1 . HIS B 31 ? 0.8684 1.2683 0.6117 0.2212 -0.0272 0.0545 31 HIS B CE1 2387 N NE2 . HIS B 31 ? 0.8941 1.3339 0.6354 0.2644 -0.0336 0.0841 31 HIS B NE2 2388 N N . PRO B 32 ? 0.7514 1.3004 0.6376 0.2368 -0.0472 0.0353 32 PRO B N 2389 C CA . PRO B 32 ? 0.7400 1.3268 0.6212 0.1911 -0.0630 0.0080 32 PRO B CA 2390 C C . PRO B 32 ? 0.6963 1.2665 0.6069 0.1393 -0.0633 -0.0317 32 PRO B C 2391 O O . PRO B 32 ? 0.6697 1.2210 0.6104 0.1389 -0.0552 -0.0349 32 PRO B O 2392 C CB . PRO B 32 ? 0.7596 1.4784 0.6495 0.2005 -0.0876 0.0211 32 PRO B CB 2393 C CG . PRO B 32 ? 0.7888 1.5258 0.6770 0.2665 -0.0804 0.0664 32 PRO B CG 2394 C CD . PRO B 32 ? 0.7697 1.4201 0.6724 0.2788 -0.0565 0.0645 32 PRO B CD 2395 N N . PRO B 33 ? 0.7002 1.2706 0.5954 0.0983 -0.0699 -0.0610 33 PRO B N 2396 C CA . PRO B 33 ? 0.6771 1.2059 0.5888 0.0543 -0.0644 -0.0966 33 PRO B CA 2397 C C . PRO B 33 ? 0.6590 1.2436 0.6094 0.0259 -0.0749 -0.1118 33 PRO B C 2398 O O . PRO B 33 ? 0.6373 1.1717 0.6087 0.0076 -0.0641 -0.1259 33 PRO B O 2399 C CB . PRO B 33 ? 0.7086 1.2266 0.5811 0.0270 -0.0663 -0.1209 33 PRO B CB 2400 C CG . PRO B 33 ? 0.7463 1.3383 0.5898 0.0433 -0.0832 -0.1039 33 PRO B CG 2401 C CD . PRO B 33 ? 0.7413 1.3376 0.5927 0.0954 -0.0788 -0.0612 33 PRO B CD 2402 N N . HIS B 34 ? 0.6722 1.3641 0.6330 0.0204 -0.0960 -0.1062 34 HIS B N 2403 C CA . HIS B 34 ? 0.6610 1.4172 0.6613 -0.0151 -0.1061 -0.1193 34 HIS B CA 2404 C C . HIS B 34 ? 0.6236 1.3703 0.6655 0.0074 -0.0909 -0.1025 34 HIS B C 2405 O O . HIS B 34 ? 0.6183 1.3924 0.6705 0.0581 -0.0856 -0.0701 34 HIS B O 2406 C CB . HIS B 34 ? 0.6878 1.5813 0.6976 -0.0258 -0.1344 -0.1105 34 HIS B CB 2407 C CG . HIS B 34 ? 0.6806 1.6616 0.7433 -0.0548 -0.1430 -0.1114 34 HIS B CG 2408 N ND1 . HIS B 34 ? 0.6968 1.6588 0.7647 -0.1202 -0.1451 -0.1460 34 HIS B ND1 2409 C CD2 . HIS B 34 ? 0.6703 1.7564 0.7828 -0.0262 -0.1463 -0.0795 34 HIS B CD2 2410 C CE1 . HIS B 34 ? 0.6870 1.7431 0.8075 -0.1366 -0.1510 -0.1352 34 HIS B CE1 2411 N NE2 . HIS B 34 ? 0.6695 1.8084 0.8209 -0.0785 -0.1513 -0.0946 34 HIS B NE2 2412 N N . ILE B 35 ? 0.6089 1.3115 0.6675 -0.0288 -0.0821 -0.1244 35 ILE B N 2413 C CA . ILE B 35 ? 0.5813 1.2558 0.6685 -0.0136 -0.0649 -0.1134 35 ILE B CA 2414 C C . ILE B 35 ? 0.5776 1.2570 0.6891 -0.0658 -0.0635 -0.1345 35 ILE B C 2415 O O . ILE B 35 ? 0.6008 1.2520 0.6954 -0.1126 -0.0693 -0.1628 35 ILE B O 2416 C CB . ILE B 35 ? 0.5728 1.1271 0.6355 0.0119 -0.0464 -0.1100 35 ILE B CB 2417 C CG1 . ILE B 35 ? 0.5620 1.0957 0.6372 0.0452 -0.0307 -0.0902 35 ILE B CG1 2418 C CG2 . ILE B 35 ? 0.5732 1.0448 0.6239 -0.0260 -0.0405 -0.1375 35 ILE B CG2 2419 C CD1 . ILE B 35 ? 0.5674 0.9937 0.6121 0.0684 -0.0176 -0.0839 35 ILE B CD1 2420 N N . GLU B 36 ? 0.5598 1.2668 0.7044 -0.0567 -0.0527 -0.1201 36 GLU B N 2421 C CA . GLU B 36 ? 0.5611 1.2752 0.7292 -0.1054 -0.0484 -0.1338 36 GLU B CA 2422 C C . GLU B 36 ? 0.5459 1.1784 0.7137 -0.0917 -0.0260 -0.1283 36 GLU B C 2423 O O . GLU B 36 ? 0.5335 1.1808 0.7107 -0.0496 -0.0136 -0.1059 36 GLU B O 2424 C CB . GLU B 36 ? 0.5628 1.4196 0.7768 -0.1211 -0.0583 -0.1204 36 GLU B CB 2425 N N . ILE B 37 ? 0.5570 1.1015 0.7083 -0.1254 -0.0201 -0.1481 37 ILE B N 2426 C CA . ILE B 37 ? 0.5514 1.0113 0.6944 -0.1144 -0.0029 -0.1428 37 ILE B CA 2427 C C . ILE B 37 ? 0.5708 1.0218 0.7270 -0.1580 0.0059 -0.1488 37 ILE B C 2428 O O . ILE B 37 ? 0.6009 1.0426 0.7532 -0.2052 0.0011 -0.1682 37 ILE B O 2429 C CB . ILE B 37 ? 0.5506 0.9062 0.6617 -0.1050 -0.0012 -0.1517 37 ILE B CB 2430 C CG1 . ILE B 37 ? 0.5401 0.8990 0.6353 -0.0684 -0.0079 -0.1442 37 ILE B CG1 2431 C CG2 . ILE B 37 ? 0.5453 0.8290 0.6478 -0.0921 0.0109 -0.1418 37 ILE B CG2 2432 C CD1 . ILE B 37 ? 0.5559 0.8538 0.6283 -0.0740 -0.0093 -0.1575 37 ILE B CD1 2433 N N . GLN B 38 ? 0.5651 1.0100 0.7287 -0.1426 0.0209 -0.1323 38 GLN B N 2434 C CA . GLN B 38 ? 0.5863 1.0150 0.7575 -0.1796 0.0332 -0.1321 38 GLN B CA 2435 C C . GLN B 38 ? 0.5895 0.9271 0.7351 -0.1605 0.0461 -0.1230 38 GLN B C 2436 O O . GLN B 38 ? 0.5758 0.8957 0.7063 -0.1178 0.0496 -0.1115 38 GLN B O 2437 C CB . GLN B 38 ? 0.5851 1.1246 0.7947 -0.1872 0.0407 -0.1165 38 GLN B CB 2438 C CG . GLN B 38 ? 0.5921 1.2441 0.8337 -0.2131 0.0241 -0.1211 38 GLN B CG 2439 C CD . GLN B 38 ? 0.5848 1.3683 0.8706 -0.1895 0.0307 -0.0957 38 GLN B CD 2440 O OE1 . GLN B 38 ? 0.5933 1.4175 0.9032 -0.2042 0.0481 -0.0822 38 GLN B OE1 2441 N NE2 . GLN B 38 ? 0.5690 1.4227 0.8655 -0.1493 0.0193 -0.0856 38 GLN B NE2 2442 N N . MET B 39 ? 0.6159 0.8915 0.7510 -0.1938 0.0527 -0.1278 39 MET B N 2443 C CA . MET B 39 ? 0.6261 0.8320 0.7390 -0.1826 0.0639 -0.1146 39 MET B CA 2444 C C . MET B 39 ? 0.6481 0.8917 0.7734 -0.2062 0.0808 -0.1018 39 MET B C 2445 O O . MET B 39 ? 0.6708 0.9509 0.8161 -0.2507 0.0834 -0.1076 39 MET B O 2446 C CB . MET B 39 ? 0.6504 0.7615 0.7419 -0.1955 0.0624 -0.1215 39 MET B CB 2447 C CG . MET B 39 ? 0.6355 0.7172 0.7190 -0.1742 0.0499 -0.1325 39 MET B CG 2448 S SD . MET B 39 ? 0.6274 0.6465 0.6909 -0.1363 0.0448 -0.1177 39 MET B SD 2449 C CE . MET B 39 ? 0.6123 0.6673 0.6666 -0.1099 0.0457 -0.1038 39 MET B CE 2450 N N . LEU B 40 ? 0.6488 0.8842 0.7584 -0.1795 0.0929 -0.0848 40 LEU B N 2451 C CA . LEU B 40 ? 0.6692 0.9507 0.7891 -0.1939 0.1135 -0.0693 40 LEU B CA 2452 C C . LEU B 40 ? 0.7037 0.9089 0.7848 -0.1921 0.1255 -0.0552 40 LEU B C 2453 O O . LEU B 40 ? 0.7043 0.8577 0.7499 -0.1583 0.1211 -0.0516 40 LEU B O 2454 C CB . LEU B 40 ? 0.6504 1.0189 0.7861 -0.1562 0.1234 -0.0593 40 LEU B CB 2455 C CG . LEU B 40 ? 0.6193 1.0761 0.7907 -0.1429 0.1114 -0.0650 40 LEU B CG 2456 C CD1 . LEU B 40 ? 0.6157 1.1195 0.7840 -0.0853 0.1249 -0.0510 40 LEU B CD1 2457 C CD2 . LEU B 40 ? 0.6246 1.1773 0.8449 -0.1923 0.1090 -0.0662 40 LEU B CD2 2458 N N . LYS B 41 ? 0.7417 0.9394 0.8260 -0.2320 0.1397 -0.0461 41 LYS B N 2459 C CA . LYS B 41 ? 0.7820 0.9224 0.8284 -0.2309 0.1543 -0.0268 41 LYS B CA 2460 C C . LYS B 41 ? 0.7989 1.0137 0.8563 -0.2360 0.1809 -0.0100 41 LYS B C 2461 O O . LYS B 41 ? 0.8188 1.0801 0.9061 -0.2800 0.1939 -0.0040 41 LYS B O 2462 C CB . LYS B 41 ? 0.8271 0.8861 0.8589 -0.2669 0.1549 -0.0232 41 LYS B CB 2463 C CG . LYS B 41 ? 0.8735 0.8675 0.8610 -0.2613 0.1664 0.0010 41 LYS B CG 2464 C CD . LYS B 41 ? 0.9345 0.8420 0.9064 -0.2904 0.1693 0.0081 41 LYS B CD 2465 C CE . LYS B 41 ? 0.9983 0.8561 0.9285 -0.2927 0.1854 0.0388 41 LYS B CE 2466 N N . ASN B 42 ? 0.7984 1.0228 0.8287 -0.1918 0.1902 -0.0030 42 ASN B N 2467 C CA . ASN B 42 ? 0.8211 1.1138 0.8530 -0.1804 0.2210 0.0137 42 ASN B CA 2468 C C . ASN B 42 ? 0.7915 1.2129 0.8839 -0.1750 0.2307 0.0143 42 ASN B C 2469 O O . ASN B 42 ? 0.8107 1.3099 0.9206 -0.1723 0.2597 0.0320 42 ASN B O 2470 C CB . ASN B 42 ? 0.8747 1.1465 0.8907 -0.2172 0.2426 0.0343 42 ASN B CB 2471 C CG . ASN B 42 ? 0.9188 1.0817 0.8649 -0.2043 0.2381 0.0424 42 ASN B CG 2472 O OD1 . ASN B 42 ? 0.9641 1.1169 0.8640 -0.1826 0.2572 0.0554 42 ASN B OD1 2473 N ND2 . ASN B 42 ? 0.9171 1.0019 0.8529 -0.2151 0.2130 0.0357 42 ASN B ND2 2474 N N . GLY B 43 ? 0.7495 1.1994 0.8734 -0.1700 0.2071 -0.0019 43 GLY B N 2475 C CA . GLY B 43 ? 0.7232 1.3035 0.9072 -0.1644 0.2095 0.0011 43 GLY B CA 2476 C C . GLY B 43 ? 0.7114 1.3387 0.9432 -0.2241 0.1900 -0.0090 43 GLY B C 2477 O O . GLY B 43 ? 0.6796 1.3692 0.9432 -0.2183 0.1711 -0.0182 43 GLY B O 2478 N N . LYS B 44 ? 0.7488 1.3391 0.9775 -0.2826 0.1952 -0.0072 44 LYS B N 2479 C CA . LYS B 44 ? 0.7627 1.3670 1.0184 -0.3489 0.1791 -0.0211 44 LYS B CA 2480 C C . LYS B 44 ? 0.7531 1.2636 0.9804 -0.3449 0.1517 -0.0473 44 LYS B C 2481 O O . LYS B 44 ? 0.7602 1.1570 0.9416 -0.3224 0.1501 -0.0501 44 LYS B O 2482 C CB . LYS B 44 ? 0.8229 1.3821 1.0672 -0.4092 0.1969 -0.0109 44 LYS B CB 2483 N N . LYS B 45 ? 0.7423 1.3097 0.9975 -0.3673 0.1306 -0.0643 45 LYS B N 2484 C CA . LYS B 45 ? 0.7347 1.2341 0.9659 -0.3594 0.1069 -0.0894 45 LYS B CA 2485 C C . LYS B 45 ? 0.7903 1.1604 0.9815 -0.3976 0.1069 -0.1044 45 LYS B C 2486 O O . LYS B 45 ? 0.8430 1.2074 1.0361 -0.4608 0.1090 -0.1131 45 LYS B O 2487 C CB . LYS B 45 ? 0.7174 1.3213 0.9836 -0.3774 0.0855 -0.1019 45 LYS B CB 2488 C CG . LYS B 45 ? 0.6992 1.2579 0.9417 -0.3520 0.0636 -0.1228 45 LYS B CG 2489 N N . ILE B 46 ? 0.7888 1.0553 0.9426 -0.3587 0.1054 -0.1060 46 ILE B N 2490 C CA . ILE B 46 ? 0.8459 0.9874 0.9614 -0.3776 0.1081 -0.1155 46 ILE B CA 2491 C C . ILE B 46 ? 0.8782 1.0036 0.9871 -0.4123 0.0954 -0.1454 46 ILE B C 2492 O O . ILE B 46 ? 0.8409 0.9921 0.9534 -0.3865 0.0790 -0.1594 46 ILE B O 2493 C CB . ILE B 46 ? 0.8260 0.8863 0.9129 -0.3234 0.1049 -0.1084 46 ILE B CB 2494 C CG1 . ILE B 46 ? 0.8024 0.8798 0.8846 -0.2888 0.1131 -0.0837 46 ILE B CG1 2495 C CG2 . ILE B 46 ? 0.8941 0.8344 0.9463 -0.3352 0.1130 -0.1089 46 ILE B CG2 2496 N N . PRO B 47 ? 0.9590 1.0336 1.0501 -0.4726 0.1044 -0.1555 47 PRO B N 2497 C CA . PRO B 47 ? 1.0131 1.0701 1.0871 -0.5203 0.0944 -0.1877 47 PRO B CA 2498 C C . PRO B 47 ? 1.0284 0.9953 1.0643 -0.4896 0.0892 -0.2095 47 PRO B C 2499 O O . PRO B 47 ? 1.0211 1.0267 1.0547 -0.4957 0.0727 -0.2328 47 PRO B O 2500 C CB . PRO B 47 ? 1.1145 1.0965 1.1620 -0.5868 0.1128 -0.1888 47 PRO B CB 2501 C CG . PRO B 47 ? 1.1164 1.0327 1.1532 -0.5551 0.1333 -0.1576 47 PRO B CG 2502 C CD . PRO B 47 ? 1.0169 1.0362 1.0937 -0.5015 0.1269 -0.1359 47 PRO B CD 2503 N N . LYS B 48 ? 1.0539 0.9095 1.0609 -0.4555 0.1037 -0.1994 48 LYS B N 2504 C CA . LYS B 48 ? 1.0863 0.8507 1.0573 -0.4284 0.1061 -0.2170 48 LYS B CA 2505 C C . LYS B 48 ? 1.0010 0.8006 0.9915 -0.3616 0.0948 -0.2069 48 LYS B C 2506 O O . LYS B 48 ? 0.9808 0.7463 0.9738 -0.3199 0.1001 -0.1830 48 LYS B O 2507 C CB . LYS B 48 ? 1.1769 0.8006 1.1056 -0.4283 0.1305 -0.2093 48 LYS B CB 2508 C CG . LYS B 48 ? 1.2386 0.7595 1.1244 -0.4058 0.1409 -0.2296 48 LYS B CG 2509 N N . VAL B 49 ? 0.9583 0.8280 0.9601 -0.3553 0.0779 -0.2234 49 VAL B N 2510 C CA . VAL B 49 ? 0.8846 0.7865 0.9015 -0.2994 0.0678 -0.2144 49 VAL B CA 2511 C C . VAL B 49 ? 0.9068 0.7820 0.8988 -0.2908 0.0656 -0.2387 49 VAL B C 2512 O O . VAL B 49 ? 0.9078 0.8392 0.8964 -0.3115 0.0528 -0.2579 49 VAL B O 2513 C CB . VAL B 49 ? 0.8102 0.8277 0.8637 -0.2858 0.0524 -0.2022 49 VAL B CB 2514 C CG1 . VAL B 49 ? 0.7484 0.7796 0.8077 -0.2331 0.0441 -0.1929 49 VAL B CG1 2515 C CG2 . VAL B 49 ? 0.7982 0.8416 0.8706 -0.2900 0.0596 -0.1788 49 VAL B CG2 2516 N N . GLU B 50 ? 0.9301 0.7246 0.9040 -0.2586 0.0789 -0.2353 50 GLU B N 2517 C CA . GLU B 50 ? 0.9556 0.7209 0.9043 -0.2420 0.0833 -0.2549 50 GLU B CA 2518 C C . GLU B 50 ? 0.8765 0.7157 0.8511 -0.2041 0.0687 -0.2435 50 GLU B C 2519 O O . GLU B 50 ? 0.8187 0.6814 0.8217 -0.1743 0.0636 -0.2169 50 GLU B O 2520 C CB . GLU B 50 ? 1.0165 0.6751 0.9409 -0.2156 0.1078 -0.2509 50 GLU B CB 2521 C CG . GLU B 50 ? 1.1242 0.6811 1.0039 -0.2516 0.1279 -0.2676 50 GLU B CG 2522 N N . MET B 51 ? 0.8845 0.7550 0.8421 -0.2090 0.0619 -0.2638 51 MET B N 2523 C CA . MET B 51 ? 0.8230 0.7576 0.7968 -0.1774 0.0498 -0.2531 51 MET B CA 2524 C C . MET B 51 ? 0.8438 0.7366 0.7960 -0.1499 0.0640 -0.2594 51 MET B C 2525 O O . MET B 51 ? 0.9162 0.7473 0.8289 -0.1619 0.0797 -0.2836 51 MET B O 2526 C CB . MET B 51 ? 0.8185 0.8342 0.7885 -0.2000 0.0309 -0.2656 51 MET B CB 2527 C CG . MET B 51 ? 0.8019 0.8839 0.8004 -0.2237 0.0182 -0.2566 51 MET B CG 2528 S SD . MET B 51 ? 0.7494 0.8967 0.7858 -0.1792 0.0092 -0.2224 51 MET B SD 2529 C CE . MET B 51 ? 0.7387 1.0008 0.7981 -0.2031 -0.0069 -0.2205 51 MET B CE 2530 N N . SER B 52 ? 0.7868 0.7105 0.7612 -0.1143 0.0607 -0.2378 52 SER B N 2531 C CA . SER B 52 ? 0.7996 0.7083 0.7599 -0.0885 0.0740 -0.2397 52 SER B CA 2532 C C . SER B 52 ? 0.8047 0.7590 0.7377 -0.0976 0.0647 -0.2560 52 SER B C 2533 O O . SER B 52 ? 0.7847 0.7951 0.7214 -0.1163 0.0446 -0.2578 52 SER B O 2534 C CB . SER B 52 ? 0.7472 0.6757 0.7435 -0.0551 0.0732 -0.2073 52 SER B CB 2535 O OG . SER B 52 ? 0.7075 0.6944 0.7127 -0.0503 0.0566 -0.1953 52 SER B OG 2536 N N . ASP B 53 ? 0.8346 0.7700 0.7400 -0.0817 0.0804 -0.2651 53 ASP B N 2537 C CA . ASP B 53 ? 0.8428 0.8215 0.7167 -0.0854 0.0724 -0.2760 53 ASP B CA 2538 C C . ASP B 53 ? 0.7713 0.8131 0.6763 -0.0648 0.0572 -0.2449 53 ASP B C 2539 O O . ASP B 53 ? 0.7365 0.7720 0.6713 -0.0406 0.0646 -0.2200 53 ASP B O 2540 C CB . ASP B 53 ? 0.9021 0.8405 0.7365 -0.0677 0.0987 -0.2895 53 ASP B CB 2541 C CG . ASP B 53 ? 0.9969 0.8662 0.7725 -0.0924 0.1132 -0.3294 53 ASP B CG 2542 O OD1 . ASP B 53 ? 1.0172 0.8425 0.7943 -0.1156 0.1131 -0.3400 53 ASP B OD1 2543 O OD2 . ASP B 53 ? 1.0578 0.9101 0.7785 -0.0901 0.1266 -0.3506 53 ASP B OD2 2544 N N . MET B 54 ? 0.7572 0.8588 0.6536 -0.0751 0.0361 -0.2449 54 MET B N 2545 C CA . MET B 54 ? 0.7072 0.8559 0.6210 -0.0519 0.0248 -0.2153 54 MET B CA 2546 C C . MET B 54 ? 0.7183 0.8598 0.6142 -0.0293 0.0388 -0.2040 54 MET B C 2547 O O . MET B 54 ? 0.7705 0.8951 0.6303 -0.0322 0.0523 -0.2229 54 MET B O 2548 C CB . MET B 54 ? 0.7041 0.9230 0.6103 -0.0605 0.0020 -0.2144 54 MET B CB 2549 C CG . MET B 54 ? 0.6573 0.9098 0.5844 -0.0323 -0.0068 -0.1813 54 MET B CG 2550 S SD . MET B 54 ? 0.6459 0.9926 0.5727 -0.0283 -0.0305 -0.1709 54 MET B SD 2551 C CE . MET B 54 ? 0.6436 1.0171 0.5980 -0.0667 -0.0391 -0.1912 54 MET B CE 2552 N N . SER B 55 ? 0.6801 0.8293 0.5961 -0.0089 0.0379 -0.1737 55 SER B N 2553 C CA . SER B 55 ? 0.6898 0.8345 0.5953 0.0079 0.0527 -0.1572 55 SER B CA 2554 C C . SER B 55 ? 0.6714 0.8340 0.5774 0.0220 0.0430 -0.1267 55 SER B C 2555 O O . SER B 55 ? 0.6613 0.8454 0.5672 0.0245 0.0262 -0.1220 55 SER B O 2556 C CB . SER B 55 ? 0.6801 0.7912 0.6162 0.0133 0.0714 -0.1499 55 SER B CB 2557 O OG . SER B 55 ? 0.6946 0.8122 0.6264 0.0264 0.0891 -0.1331 55 SER B OG 2558 N N . PHE B 56 ? 0.6749 0.8272 0.5797 0.0316 0.0560 -0.1047 56 PHE B N 2559 C CA . PHE B 56 ? 0.6723 0.8183 0.5717 0.0414 0.0508 -0.0744 56 PHE B CA 2560 C C . PHE B 56 ? 0.6740 0.7987 0.5890 0.0376 0.0654 -0.0511 56 PHE B C 2561 O O . PHE B 56 ? 0.6805 0.8147 0.6031 0.0362 0.0835 -0.0526 56 PHE B O 2562 C CB . PHE B 56 ? 0.7065 0.8797 0.5631 0.0561 0.0451 -0.0652 56 PHE B CB 2563 C CG . PHE B 56 ? 0.7394 0.9346 0.5626 0.0563 0.0565 -0.0759 56 PHE B CG 2564 C CD1 . PHE B 56 ? 0.7606 0.9464 0.5698 0.0610 0.0770 -0.0571 56 PHE B CD1 2565 C CD2 . PHE B 56 ? 0.7497 0.9748 0.5501 0.0484 0.0474 -0.1048 56 PHE B CD2 2566 C CE1 . PHE B 56 ? 0.7922 0.9958 0.5628 0.0638 0.0911 -0.0673 56 PHE B CE1 2567 C CE2 . PHE B 56 ? 0.7926 1.0292 0.5487 0.0469 0.0584 -0.1182 56 PHE B CE2 2568 C CZ . PHE B 56 ? 0.8162 1.0410 0.5558 0.0577 0.0818 -0.0995 56 PHE B CZ 2569 N N . SER B 57 ? 0.6751 0.7713 0.5923 0.0349 0.0585 -0.0295 57 SER B N 2570 C CA . SER B 57 ? 0.6839 0.7607 0.6159 0.0203 0.0671 -0.0057 57 SER B CA 2571 C C . SER B 57 ? 0.7293 0.7978 0.6265 0.0239 0.0783 0.0195 57 SER B C 2572 O O . SER B 57 ? 0.7543 0.8308 0.6132 0.0427 0.0777 0.0204 57 SER B O 2573 C CB . SER B 57 ? 0.6765 0.7134 0.6178 0.0070 0.0532 0.0008 57 SER B CB 2574 O OG . SER B 57 ? 0.6993 0.7075 0.6044 0.0224 0.0446 0.0026 57 SER B OG 2575 N N . LYS B 58 ? 0.7459 0.8020 0.6565 0.0033 0.0873 0.0426 58 LYS B N 2576 C CA . LYS B 58 ? 0.7977 0.8422 0.6776 -0.0006 0.1021 0.0712 58 LYS B CA 2577 C C . LYS B 58 ? 0.8470 0.8402 0.6702 0.0146 0.0962 0.0851 58 LYS B C 2578 O O . LYS B 58 ? 0.8963 0.8772 0.6816 0.0201 0.1091 0.1088 58 LYS B O 2579 C CB . LYS B 58 ? 0.8085 0.8491 0.7185 -0.0358 0.1090 0.0946 58 LYS B CB 2580 N N . ASP B 59 ? 0.8375 0.8010 0.6535 0.0253 0.0795 0.0730 59 ASP B N 2581 C CA . ASP B 59 ? 0.8893 0.8074 0.6542 0.0510 0.0765 0.0866 59 ASP B CA 2582 C C . ASP B 59 ? 0.8750 0.8446 0.6291 0.0864 0.0684 0.0749 59 ASP B C 2583 O O . ASP B 59 ? 0.9119 0.8631 0.6338 0.1162 0.0641 0.0865 59 ASP B O 2584 C CB . ASP B 59 ? 0.9069 0.7568 0.6617 0.0448 0.0680 0.0847 59 ASP B CB 2585 C CG . ASP B 59 ? 0.8422 0.7208 0.6373 0.0420 0.0539 0.0558 59 ASP B CG 2586 O OD1 . ASP B 59 ? 0.8033 0.7398 0.6160 0.0609 0.0482 0.0386 59 ASP B OD1 2587 O OD2 . ASP B 59 ? 0.8375 0.6792 0.6423 0.0175 0.0478 0.0509 59 ASP B OD2 2588 N N . TRP B 60 ? 0.8336 0.8675 0.6128 0.0824 0.0669 0.0528 60 TRP B N 2589 C CA . TRP B 60 ? 0.8286 0.9208 0.5957 0.1031 0.0566 0.0383 60 TRP B CA 2590 C C . TRP B 60 ? 0.8006 0.9124 0.5858 0.1137 0.0389 0.0217 60 TRP B C 2591 O O . TRP B 60 ? 0.8013 0.9690 0.5779 0.1281 0.0269 0.0147 60 TRP B O 2592 C CB . TRP B 60 ? 0.8869 0.9886 0.6022 0.1288 0.0595 0.0650 60 TRP B CB 2593 C CG . TRP B 60 ? 0.9214 1.0099 0.6122 0.1199 0.0794 0.0846 60 TRP B CG 2594 C CD1 . TRP B 60 ? 0.9749 1.0058 0.6384 0.1189 0.0935 0.1191 60 TRP B CD1 2595 C CD2 . TRP B 60 ? 0.9199 1.0504 0.6060 0.1099 0.0909 0.0719 60 TRP B CD2 2596 N NE1 . TRP B 60 ? 1.0030 1.0472 0.6520 0.1072 0.1128 0.1315 60 TRP B NE1 2597 C CE2 . TRP B 60 ? 0.9665 1.0725 0.6282 0.1048 0.1128 0.1026 60 TRP B CE2 2598 C CE3 . TRP B 60 ? 0.8937 1.0720 0.5877 0.1038 0.0876 0.0369 60 TRP B CE3 2599 C CZ2 . TRP B 60 ? 0.9765 1.1138 0.6252 0.0985 0.1332 0.1006 60 TRP B CZ2 2600 C CZ3 . TRP B 60 ? 0.9154 1.1122 0.5887 0.0986 0.1079 0.0318 60 TRP B CZ3 2601 C CH2 . TRP B 60 ? 0.9522 1.1333 0.6050 0.0984 0.1313 0.0642 60 TRP B CH2 2602 N N . SER B 61 ? 0.7798 0.8523 0.5886 0.1043 0.0368 0.0169 61 SER B N 2603 C CA . SER B 61 ? 0.7510 0.8449 0.5804 0.1116 0.0244 0.0012 61 SER B CA 2604 C C . SER B 61 ? 0.6996 0.8201 0.5682 0.0853 0.0203 -0.0292 61 SER B C 2605 O O . SER B 61 ? 0.6845 0.7832 0.5706 0.0649 0.0279 -0.0343 61 SER B O 2606 C CB . SER B 61 ? 0.7717 0.8030 0.5919 0.1206 0.0266 0.0125 61 SER B CB 2607 O OG . SER B 61 ? 0.7735 0.7520 0.6038 0.0913 0.0309 0.0104 61 SER B OG 2608 N N . PHE B 62 ? 0.6801 0.8494 0.5623 0.0863 0.0092 -0.0465 62 PHE B N 2609 C CA . PHE B 62 ? 0.6517 0.8403 0.5594 0.0609 0.0069 -0.0758 62 PHE B CA 2610 C C . PHE B 62 ? 0.6243 0.7792 0.5613 0.0486 0.0074 -0.0823 62 PHE B C 2611 O O . PHE B 62 ? 0.6297 0.7570 0.5644 0.0596 0.0067 -0.0684 62 PHE B O 2612 C CB . PHE B 62 ? 0.6538 0.9090 0.5599 0.0572 -0.0065 -0.0913 62 PHE B CB 2613 C CG . PHE B 62 ? 0.6819 0.9792 0.5535 0.0674 -0.0114 -0.0851 62 PHE B CG 2614 C CD1 . PHE B 62 ? 0.6958 1.0236 0.5505 0.0985 -0.0185 -0.0576 62 PHE B CD1 2615 C CD2 . PHE B 62 ? 0.6991 1.0017 0.5488 0.0496 -0.0073 -0.1054 62 PHE B CD2 2616 C CE1 . PHE B 62 ? 0.7269 1.0971 0.5461 0.1097 -0.0248 -0.0477 62 PHE B CE1 2617 C CE2 . PHE B 62 ? 0.7374 1.0787 0.5461 0.0577 -0.0126 -0.0999 62 PHE B CE2 2618 C CZ . PHE B 62 ? 0.7505 1.1295 0.5454 0.0868 -0.0233 -0.0696 62 PHE B CZ 2619 N N . TYR B 63 ? 0.6086 0.7587 0.5656 0.0278 0.0105 -0.1025 63 TYR B N 2620 C CA . TYR B 63 ? 0.5872 0.7102 0.5697 0.0161 0.0100 -0.1073 63 TYR B CA 2621 C C . TYR B 63 ? 0.5856 0.7135 0.5807 -0.0031 0.0123 -0.1316 63 TYR B C 2622 O O . TYR B 63 ? 0.6081 0.7393 0.5914 -0.0087 0.0193 -0.1457 63 TYR B O 2623 C CB . TYR B 63 ? 0.5824 0.6637 0.5742 0.0133 0.0154 -0.0923 63 TYR B CB 2624 C CG . TYR B 63 ? 0.5882 0.6684 0.5917 0.0079 0.0272 -0.0947 63 TYR B CG 2625 C CD1 . TYR B 63 ? 0.5818 0.6549 0.6047 0.0004 0.0333 -0.1088 63 TYR B CD1 2626 C CD2 . TYR B 63 ? 0.6127 0.6963 0.6063 0.0132 0.0359 -0.0799 63 TYR B CD2 2627 C CE1 . TYR B 63 ? 0.6019 0.6732 0.6345 0.0045 0.0493 -0.1090 63 TYR B CE1 2628 C CE2 . TYR B 63 ? 0.6269 0.7178 0.6341 0.0130 0.0515 -0.0797 63 TYR B CE2 2629 C CZ . TYR B 63 ? 0.6205 0.7059 0.6477 0.0116 0.0590 -0.0945 63 TYR B CZ 2630 O OH . TYR B 63 ? 0.6347 0.7265 0.6743 0.0201 0.0795 -0.0922 63 TYR B OH 2631 N N . ILE B 64 ? 0.5729 0.6924 0.5847 -0.0133 0.0091 -0.1364 64 ILE B N 2632 C CA . ILE B 64 ? 0.5860 0.6979 0.6040 -0.0346 0.0129 -0.1576 64 ILE B CA 2633 C C . ILE B 64 ? 0.5754 0.6530 0.6120 -0.0412 0.0151 -0.1523 64 ILE B C 2634 O O . ILE B 64 ? 0.5599 0.6401 0.6018 -0.0357 0.0095 -0.1394 64 ILE B O 2635 C CB . ILE B 64 ? 0.5989 0.7605 0.6097 -0.0506 0.0038 -0.1729 64 ILE B CB 2636 C CG1 . ILE B 64 ? 0.6338 0.7742 0.6423 -0.0819 0.0086 -0.1967 64 ILE B CG1 2637 C CG2 . ILE B 64 ? 0.5788 0.7805 0.6033 -0.0406 -0.0047 -0.1578 64 ILE B CG2 2638 C CD1 . ILE B 64 ? 0.6757 0.8639 0.6684 -0.1092 -0.0015 -0.2174 64 ILE B CD1 2639 N N . LEU B 65 ? 0.5921 0.6331 0.6324 -0.0496 0.0253 -0.1609 65 LEU B N 2640 C CA . LEU B 65 ? 0.5912 0.5985 0.6455 -0.0533 0.0276 -0.1519 65 LEU B CA 2641 C C . LEU B 65 ? 0.6181 0.6100 0.6677 -0.0771 0.0321 -0.1673 65 LEU B C 2642 O O . LEU B 65 ? 0.6585 0.6240 0.6931 -0.0896 0.0423 -0.1862 65 LEU B O 2643 C CB . LEU B 65 ? 0.5987 0.5757 0.6648 -0.0390 0.0369 -0.1400 65 LEU B CB 2644 C CG . LEU B 65 ? 0.6075 0.5545 0.6876 -0.0375 0.0374 -0.1245 65 LEU B CG 2645 C CD1 . LEU B 65 ? 0.5855 0.5452 0.6714 -0.0364 0.0216 -0.1044 65 LEU B CD1 2646 C CD2 . LEU B 65 ? 0.6285 0.5549 0.7222 -0.0193 0.0510 -0.1146 65 LEU B CD2 2647 N N . ALA B 66 ? 0.6047 0.6080 0.6617 -0.0851 0.0267 -0.1591 66 ALA B N 2648 C CA . ALA B 66 ? 0.6303 0.6240 0.6856 -0.1124 0.0318 -0.1681 66 ALA B CA 2649 C C . ALA B 66 ? 0.6420 0.5868 0.6998 -0.1096 0.0382 -0.1520 66 ALA B C 2650 O O . ALA B 66 ? 0.6213 0.5672 0.6841 -0.0924 0.0319 -0.1328 66 ALA B O 2651 C CB . ALA B 66 ? 0.6111 0.6675 0.6754 -0.1220 0.0244 -0.1667 66 ALA B CB 2652 N N . HIS B 67 ? 0.6888 0.5856 0.7367 -0.1277 0.0503 -0.1591 67 HIS B N 2653 C CA . HIS B 67 ? 0.7094 0.5576 0.7561 -0.1215 0.0570 -0.1393 67 HIS B CA 2654 C C . HIS B 67 ? 0.7656 0.5702 0.7971 -0.1522 0.0704 -0.1451 67 HIS B C 2655 O O . HIS B 67 ? 0.8093 0.5923 0.8249 -0.1776 0.0785 -0.1685 67 HIS B O 2656 C CB . HIS B 67 ? 0.7215 0.5329 0.7715 -0.0920 0.0624 -0.1278 67 HIS B CB 2657 C CG . HIS B 67 ? 0.7785 0.5395 0.8111 -0.0929 0.0806 -0.1463 67 HIS B CG 2658 N ND1 . HIS B 67 ? 0.7872 0.5648 0.8095 -0.0971 0.0822 -0.1707 67 HIS B ND1 2659 C CD2 . HIS B 67 ? 0.8516 0.5373 0.8664 -0.0885 0.1002 -0.1444 67 HIS B CD2 2660 C CE1 . HIS B 67 ? 0.8617 0.5741 0.8570 -0.0973 0.1026 -0.1866 67 HIS B CE1 2661 N NE2 . HIS B 67 ? 0.9102 0.5619 0.9006 -0.0905 0.1152 -0.1709 67 HIS B NE2 2662 N N . THR B 68 ? 0.7734 0.5607 0.8036 -0.1527 0.0727 -0.1234 68 THR B N 2663 C CA . THR B 68 ? 0.8317 0.5773 0.8463 -0.1836 0.0867 -0.1218 68 THR B CA 2664 C C . THR B 68 ? 0.8599 0.5532 0.8641 -0.1650 0.0926 -0.0915 68 THR B C 2665 O O . THR B 68 ? 0.8210 0.5384 0.8333 -0.1375 0.0800 -0.0715 68 THR B O 2666 C CB . THR B 68 ? 0.8126 0.6233 0.8378 -0.2135 0.0838 -0.1242 68 THR B CB 2667 O OG1 . THR B 68 ? 0.8711 0.6422 0.8823 -0.2452 0.0991 -0.1156 68 THR B OG1 2668 C CG2 . THR B 68 ? 0.7570 0.6222 0.7936 -0.1870 0.0727 -0.1071 68 THR B CG2 2669 N N . GLU B 69 ? 0.9358 0.5544 0.9168 -0.1820 0.1111 -0.0876 69 GLU B N 2670 C CA . GLU B 69 ? 0.9785 0.5456 0.9444 -0.1659 0.1182 -0.0543 69 GLU B CA 2671 C C . GLU B 69 ? 0.9727 0.5706 0.9339 -0.1882 0.1174 -0.0390 69 GLU B C 2672 O O . GLU B 69 ? 0.9908 0.6022 0.9502 -0.2294 0.1267 -0.0519 69 GLU B O 2673 C CB . GLU B 69 ? 1.0810 0.5412 1.0160 -0.1707 0.1428 -0.0532 69 GLU B CB 2674 N N . PHE B 70 ? 0.9532 0.5666 0.9108 -0.1626 0.1067 -0.0112 70 PHE B N 2675 C CA . PHE B 70 ? 0.9511 0.5941 0.8961 -0.1767 0.1077 0.0034 70 PHE B CA 2676 C C . PHE B 70 ? 0.9861 0.5970 0.9048 -0.1548 0.1040 0.0403 70 PHE B C 2677 O O . PHE B 70 ? 0.9881 0.5821 0.9090 -0.1229 0.0921 0.0560 70 PHE B O 2678 C CB . PHE B 70 ? 0.8790 0.6032 0.8390 -0.1704 0.0931 -0.0097 70 PHE B CB 2679 C CG . PHE B 70 ? 0.8535 0.5907 0.8047 -0.1384 0.0728 0.0043 70 PHE B CG 2680 C CD1 . PHE B 70 ? 0.8335 0.5695 0.8010 -0.1152 0.0579 0.0025 70 PHE B CD1 2681 C CD2 . PHE B 70 ? 0.8628 0.6133 0.7856 -0.1350 0.0693 0.0194 70 PHE B CD2 2682 C CE1 . PHE B 70 ? 0.8191 0.5726 0.7798 -0.0952 0.0367 0.0163 70 PHE B CE1 2683 C CE2 . PHE B 70 ? 0.8577 0.6148 0.7636 -0.1144 0.0478 0.0296 70 PHE B CE2 2684 C CZ . PHE B 70 ? 0.8310 0.5921 0.7582 -0.0975 0.0299 0.0285 70 PHE B CZ 2685 N N . THR B 71 ? 1.0145 0.6273 0.9092 -0.1721 0.1139 0.0560 71 THR B N 2686 C CA . THR B 71 ? 1.0510 0.6419 0.9112 -0.1553 0.1091 0.0916 71 THR B CA 2687 C C . THR B 71 ? 1.0164 0.6651 0.8595 -0.1523 0.0983 0.0902 71 THR B C 2688 O O . THR B 71 ? 1.0126 0.6942 0.8542 -0.1731 0.1136 0.0796 71 THR B O 2689 C CB . THR B 71 ? 1.1357 0.6645 0.9668 -0.1770 0.1346 0.1151 71 THR B CB 2690 O OG1 . THR B 71 ? 1.1866 0.6405 1.0203 -0.1741 0.1464 0.1172 71 THR B OG1 2691 C CG2 . THR B 71 ? 1.1801 0.6929 0.9687 -0.1601 0.1294 0.1544 71 THR B CG2 2692 N N . PRO B 72 ? 1.0003 0.6618 0.8285 -0.1271 0.0730 0.1009 72 PRO B N 2693 C CA . PRO B 72 ? 0.9856 0.6823 0.7822 -0.1249 0.0637 0.0958 72 PRO B CA 2694 C C . PRO B 72 ? 1.0500 0.7265 0.7913 -0.1291 0.0714 0.1229 72 PRO B C 2695 O O . PRO B 72 ? 1.0981 0.7399 0.8201 -0.1215 0.0653 0.1542 72 PRO B O 2696 C CB . PRO B 72 ? 0.9570 0.6679 0.7563 -0.1057 0.0315 0.0954 72 PRO B CB 2697 C CG . PRO B 72 ? 0.9729 0.6605 0.7980 -0.0912 0.0240 0.1165 72 PRO B CG 2698 C CD . PRO B 72 ? 1.0051 0.6507 0.8435 -0.1011 0.0527 0.1188 72 PRO B CD 2699 N N . THR B 73 ? 1.0570 0.7571 0.7715 -0.1375 0.0870 0.1130 73 THR B N 2700 C CA . THR B 73 ? 1.1233 0.8084 0.7761 -0.1407 0.0977 0.1357 73 THR B CA 2701 C C . THR B 73 ? 1.1278 0.8337 0.7343 -0.1312 0.0951 0.1185 73 THR B C 2702 O O . THR B 73 ? 1.0794 0.8087 0.7058 -0.1229 0.0883 0.0907 73 THR B O 2703 C CB . THR B 73 ? 1.1570 0.8398 0.8145 -0.1639 0.1349 0.1470 73 THR B CB 2704 O OG1 . THR B 73 ? 1.1066 0.8390 0.8108 -0.1758 0.1523 0.1196 73 THR B OG1 2705 C CG2 . THR B 73 ? 1.1942 0.8259 0.8685 -0.1743 0.1398 0.1700 73 THR B CG2 2706 N N . GLU B 74 ? 1.1984 0.8874 0.7354 -0.1313 0.1026 0.1357 74 GLU B N 2707 C CA . GLU B 74 ? 1.2316 0.9212 0.7037 -0.1214 0.1044 0.1193 74 GLU B CA 2708 C C . GLU B 74 ? 1.2143 0.9403 0.7015 -0.1152 0.1400 0.0971 74 GLU B C 2709 O O . GLU B 74 ? 1.2253 0.9485 0.6757 -0.0988 0.1419 0.0747 74 GLU B O 2710 C CB . GLU B 74 ? 1.3219 0.9814 0.7070 -0.1237 0.1059 0.1444 74 GLU B CB 2711 N N . THR B 75 ? 1.1963 0.9563 0.7368 -0.1286 0.1682 0.1048 75 THR B N 2712 C CA . THR B 75 ? 1.1881 1.0033 0.7492 -0.1236 0.2046 0.0934 75 THR B CA 2713 C C . THR B 75 ? 1.1109 0.9805 0.7589 -0.1279 0.2057 0.0751 75 THR B C 2714 O O . THR B 75 ? 1.0912 1.0050 0.7526 -0.1078 0.2190 0.0582 75 THR B O 2715 C CB . THR B 75 ? 1.2398 1.0729 0.7896 -0.1417 0.2415 0.1195 75 THR B CB 2716 O OG1 . THR B 75 ? 1.2422 1.0558 0.8288 -0.1719 0.2367 0.1393 75 THR B OG1 2717 C CG2 . THR B 75 ? 1.3283 1.1203 0.7796 -0.1311 0.2493 0.1347 75 THR B CG2 2718 N N . ASP B 76 ? 1.0789 0.9422 0.7792 -0.1516 0.1931 0.0792 76 ASP B N 2719 C CA . ASP B 76 ? 1.0150 0.9267 0.7896 -0.1619 0.1915 0.0611 76 ASP B CA 2720 C C . ASP B 76 ? 0.9636 0.8826 0.7478 -0.1346 0.1694 0.0364 76 ASP B C 2721 O O . ASP B 76 ? 0.9673 0.8376 0.7206 -0.1217 0.1439 0.0338 76 ASP B O 2722 C CB . ASP B 76 ? 1.0142 0.8929 0.8227 -0.1915 0.1823 0.0672 76 ASP B CB 2723 C CG . ASP B 76 ? 1.0655 0.9495 0.8829 -0.2295 0.2106 0.0866 76 ASP B CG 2724 O OD1 . ASP B 76 ? 1.0665 1.0217 0.9087 -0.2431 0.2349 0.0861 76 ASP B OD1 2725 O OD2 . ASP B 76 ? 1.1136 0.9316 0.9143 -0.2459 0.2097 0.1048 76 ASP B OD2 2726 N N . THR B 77 ? 0.9223 0.9069 0.7498 -0.1273 0.1789 0.0216 77 THR B N 2727 C CA . THR B 77 ? 0.8850 0.8763 0.7172 -0.0986 0.1632 0.0014 77 THR B CA 2728 C C . THR B 77 ? 0.8275 0.8475 0.7210 -0.1103 0.1468 -0.0122 77 THR B C 2729 O O . THR B 77 ? 0.8122 0.8872 0.7534 -0.1337 0.1568 -0.0124 77 THR B O 2730 C CB . THR B 77 ? 0.8971 0.9364 0.7184 -0.0664 0.1878 -0.0027 77 THR B CB 2731 O OG1 . THR B 77 ? 0.8666 0.9995 0.7531 -0.0764 0.2051 0.0002 77 THR B OG1 2732 C CG2 . THR B 77 ? 0.9684 0.9798 0.7216 -0.0537 0.2111 0.0085 77 THR B CG2 2733 N N . TYR B 78 ? 0.8032 0.7880 0.6914 -0.0970 0.1219 -0.0236 78 TYR B N 2734 C CA . TYR B 78 ? 0.7571 0.7600 0.6922 -0.1053 0.1067 -0.0369 78 TYR B CA 2735 C C . TYR B 78 ? 0.7321 0.7584 0.6710 -0.0767 0.0999 -0.0498 78 TYR B C 2736 O O . TYR B 78 ? 0.7531 0.7385 0.6502 -0.0546 0.0931 -0.0514 78 TYR B O 2737 C CB . TYR B 78 ? 0.7546 0.6983 0.6865 -0.1145 0.0865 -0.0347 78 TYR B CB 2738 C CG . TYR B 78 ? 0.7862 0.6995 0.7193 -0.1405 0.0944 -0.0208 78 TYR B CG 2739 C CD1 . TYR B 78 ? 0.8255 0.6971 0.7178 -0.1397 0.0967 0.0000 78 TYR B CD1 2740 C CD2 . TYR B 78 ? 0.7833 0.7019 0.7502 -0.1668 0.0999 -0.0281 78 TYR B CD2 2741 C CE1 . TYR B 78 ? 0.8639 0.6995 0.7525 -0.1602 0.1062 0.0170 78 TYR B CE1 2742 C CE2 . TYR B 78 ? 0.8316 0.7047 0.7909 -0.1909 0.1105 -0.0150 78 TYR B CE2 2743 C CZ . TYR B 78 ? 0.8699 0.7013 0.7918 -0.1853 0.1146 0.0094 78 TYR B CZ 2744 O OH . TYR B 78 ? 0.9268 0.7052 0.8371 -0.2063 0.1273 0.0264 78 TYR B OH 2745 N N . ALA B 79 ? 0.7004 0.7892 0.6842 -0.0795 0.1009 -0.0581 79 ALA B N 2746 C CA . ALA B 79 ? 0.6818 0.7964 0.6694 -0.0492 0.0961 -0.0657 79 ALA B CA 2747 C C . ALA B 79 ? 0.6476 0.8042 0.6779 -0.0606 0.0828 -0.0764 79 ALA B C 2748 O O . ALA B 79 ? 0.6411 0.8306 0.7034 -0.0935 0.0829 -0.0802 79 ALA B O 2749 C CB . ALA B 79 ? 0.6992 0.8664 0.6828 -0.0205 0.1190 -0.0581 79 ALA B CB 2750 N N . CYS B 80 ? 0.6375 0.7863 0.6601 -0.0355 0.0723 -0.0815 80 CYS B N 2751 C CA . CYS B 80 ? 0.6106 0.7981 0.6625 -0.0396 0.0598 -0.0906 80 CYS B CA 2752 C C . CYS B 80 ? 0.6030 0.8627 0.6676 -0.0085 0.0659 -0.0843 80 CYS B C 2753 O O . CYS B 80 ? 0.6212 0.8541 0.6553 0.0293 0.0720 -0.0777 80 CYS B O 2754 C CB . CYS B 80 ? 0.6045 0.7309 0.6382 -0.0339 0.0445 -0.0962 80 CYS B CB 2755 S SG . CYS B 80 ? 0.6018 0.7557 0.6622 -0.0496 0.0313 -0.1100 80 CYS B SG 2756 N N . ARG B 81 ? 0.5847 0.9339 0.6912 -0.0253 0.0643 -0.0850 81 ARG B N 2757 C CA . ARG B 81 ? 0.5796 1.0210 0.7086 0.0054 0.0687 -0.0731 81 ARG B CA 2758 C C . ARG B 81 ? 0.5617 1.0402 0.7037 0.0048 0.0487 -0.0791 81 ARG B C 2759 O O . ARG B 81 ? 0.5530 1.0550 0.7136 -0.0374 0.0348 -0.0931 81 ARG B O 2760 C CB . ARG B 81 ? 0.5805 1.1236 0.7531 -0.0141 0.0802 -0.0637 81 ARG B CB 2761 C CG . ARG B 81 ? 0.5960 1.2261 0.7861 0.0353 0.0969 -0.0417 81 ARG B CG 2762 C CD . ARG B 81 ? 0.5924 1.3730 0.8464 0.0159 0.0913 -0.0313 81 ARG B CD 2763 N NE . ARG B 81 ? 0.6046 1.4295 0.8905 -0.0395 0.0979 -0.0324 81 ARG B NE 2764 C CZ . ARG B 81 ? 0.6225 1.4841 0.9211 -0.0325 0.1253 -0.0159 81 ARG B CZ 2765 N NH1 . ARG B 81 ? 0.6429 1.4974 0.9203 0.0314 0.1506 0.0002 81 ARG B NH1 2766 N NH2 . ARG B 81 ? 0.6315 1.5295 0.9577 -0.0906 0.1303 -0.0159 81 ARG B NH2 2767 N N . VAL B 82 ? 0.5666 1.0440 0.6911 0.0518 0.0492 -0.0681 82 VAL B N 2768 C CA . VAL B 82 ? 0.5555 1.0529 0.6795 0.0572 0.0315 -0.0705 82 VAL B CA 2769 C C . VAL B 82 ? 0.5622 1.1647 0.7084 0.0944 0.0308 -0.0498 82 VAL B C 2770 O O . VAL B 82 ? 0.5882 1.1854 0.7190 0.1474 0.0475 -0.0303 82 VAL B O 2771 C CB . VAL B 82 ? 0.5641 0.9549 0.6426 0.0749 0.0296 -0.0732 82 VAL B CB 2772 C CG1 . VAL B 82 ? 0.5736 0.9866 0.6431 0.0983 0.0193 -0.0656 82 VAL B CG1 2773 C CG2 . VAL B 82 ? 0.5479 0.8711 0.6199 0.0341 0.0222 -0.0918 82 VAL B CG2 2774 N N . LYS B 83 ? 0.5481 1.2439 0.7261 0.0670 0.0117 -0.0536 83 LYS B N 2775 C CA . LYS B 83 ? 0.5544 1.3674 0.7574 0.0992 0.0044 -0.0309 83 LYS B CA 2776 C C . LYS B 83 ? 0.5629 1.3587 0.7376 0.1110 -0.0132 -0.0315 83 LYS B C 2777 O O . LYS B 83 ? 0.5568 1.3373 0.7225 0.0667 -0.0305 -0.0540 83 LYS B O 2778 C CB . LYS B 83 ? 0.5433 1.4925 0.8017 0.0556 -0.0081 -0.0313 83 LYS B CB 2779 C CG . LYS B 83 ? 0.5472 1.6462 0.8460 0.0942 -0.0127 0.0007 83 LYS B CG 2780 N N . HIS B 84 ? 0.5892 1.3792 0.7434 0.1730 -0.0052 -0.0059 84 HIS B N 2781 C CA . HIS B 84 ? 0.6088 1.3755 0.7298 0.1906 -0.0177 0.0000 84 HIS B CA 2782 C C . HIS B 84 ? 0.6450 1.4835 0.7687 0.2572 -0.0137 0.0383 84 HIS B C 2783 O O . HIS B 84 ? 0.6633 1.5190 0.7979 0.3024 0.0077 0.0589 84 HIS B O 2784 C CB . HIS B 84 ? 0.6197 1.2362 0.6894 0.1947 -0.0066 -0.0098 84 HIS B CB 2785 C CG . HIS B 84 ? 0.6402 1.2258 0.6752 0.2026 -0.0166 -0.0054 84 HIS B CG 2786 N ND1 . HIS B 84 ? 0.6847 1.2298 0.6831 0.2557 -0.0065 0.0217 84 HIS B ND1 2787 C CD2 . HIS B 84 ? 0.6334 1.2163 0.6589 0.1651 -0.0322 -0.0238 84 HIS B CD2 2788 C CE1 . HIS B 84 ? 0.6957 1.2211 0.6672 0.2479 -0.0167 0.0219 84 HIS B CE1 2789 N NE2 . HIS B 84 ? 0.6623 1.2127 0.6497 0.1947 -0.0318 -0.0062 84 HIS B NE2 2790 N N . ALA B 85 ? 0.6643 1.5432 0.7741 0.2667 -0.0323 0.0494 85 ALA B N 2791 C CA . ALA B 85 ? 0.7039 1.6657 0.8174 0.3311 -0.0329 0.0907 85 ALA B CA 2792 C C . ALA B 85 ? 0.7599 1.6161 0.8274 0.4029 -0.0025 0.1165 85 ALA B C 2793 O O . ALA B 85 ? 0.7992 1.7130 0.8732 0.4694 0.0087 0.1540 85 ALA B O 2794 C CB . ALA B 85 ? 0.7158 1.7344 0.8140 0.3196 -0.0615 0.0956 85 ALA B CB 2795 N N . SER B 86 ? 0.7730 1.4747 0.7923 0.3889 0.0111 0.0972 86 SER B N 2796 C CA . SER B 86 ? 0.8439 1.4204 0.8055 0.4431 0.0391 0.1154 86 SER B CA 2797 C C . SER B 86 ? 0.8720 1.4195 0.8335 0.4771 0.0685 0.1194 86 SER B C 2798 O O . SER B 86 ? 0.9475 1.4011 0.8567 0.5322 0.0954 0.1374 86 SER B O 2799 C CB . SER B 86 ? 0.8509 1.2832 0.7618 0.4080 0.0402 0.0948 86 SER B CB 2800 O OG . SER B 86 ? 0.7996 1.2016 0.7290 0.3493 0.0357 0.0597 86 SER B OG 2801 N N . MET B 87 ? 0.8242 1.4448 0.8370 0.4437 0.0660 0.1025 87 MET B N 2802 C CA . MET B 87 ? 0.8526 1.4615 0.8676 0.4736 0.0956 0.1063 87 MET B CA 2803 C C . MET B 87 ? 0.8316 1.6154 0.9186 0.4940 0.0967 0.1276 87 MET B C 2804 O O . MET B 87 ? 0.7758 1.6803 0.9204 0.4448 0.0693 0.1201 87 MET B O 2805 C CB . MET B 87 ? 0.8229 1.3523 0.8292 0.4167 0.0981 0.0711 87 MET B CB 2806 C CG . MET B 87 ? 0.8479 1.2270 0.7957 0.3876 0.0931 0.0510 87 MET B CG 2807 S SD . MET B 87 ? 0.8220 1.1459 0.7759 0.3152 0.0855 0.0146 87 MET B SD 2808 C CE . MET B 87 ? 0.7399 1.1951 0.7671 0.2594 0.0572 0.0020 87 MET B CE 2809 N N . ALA B 88 ? 0.8872 1.6831 0.9680 0.5654 0.1300 0.1543 88 ALA B N 2810 C CA . ALA B 88 ? 0.8721 1.8446 1.0270 0.5921 0.1370 0.1805 88 ALA B CA 2811 C C . ALA B 88 ? 0.8147 1.8352 1.0149 0.5280 0.1362 0.1558 88 ALA B C 2812 O O . ALA B 88 ? 0.7621 1.9288 1.0332 0.4812 0.1126 0.1559 88 ALA B O 2813 C CB . ALA B 88 ? 0.9566 1.9154 1.0870 0.6927 0.1809 0.2156 88 ALA B CB 2814 N N . GLU B 89 ? 0.8339 1.7258 0.9869 0.5224 0.1614 0.1349 89 GLU B N 2815 C CA . GLU B 89 ? 0.7896 1.7007 0.9713 0.4627 0.1632 0.1127 89 GLU B CA 2816 C C . GLU B 89 ? 0.7469 1.5572 0.9036 0.3858 0.1360 0.0750 89 GLU B C 2817 O O . GLU B 89 ? 0.7685 1.4589 0.8691 0.3891 0.1284 0.0646 89 GLU B O 2818 C CB . GLU B 89 ? 0.8460 1.6838 0.9868 0.5035 0.2072 0.1144 89 GLU B CB 2819 C CG . GLU B 89 ? 0.8929 1.8390 1.0636 0.5836 0.2421 0.1527 89 GLU B CG 2820 N N . PRO B 90 ? 0.6931 1.5528 0.8916 0.3171 0.1231 0.0571 90 PRO B N 2821 C CA . PRO B 90 ? 0.6618 1.4197 0.8345 0.2535 0.1038 0.0245 90 PRO B CA 2822 C C . PRO B 90 ? 0.6950 1.3000 0.7999 0.2655 0.1229 0.0125 90 PRO B C 2823 O O . PRO B 90 ? 0.7370 1.3248 0.8207 0.3047 0.1530 0.0228 90 PRO B O 2824 C CB . PRO B 90 ? 0.6244 1.4627 0.8500 0.1899 0.0968 0.0145 90 PRO B CB 2825 C CG . PRO B 90 ? 0.6212 1.6303 0.9116 0.2053 0.0976 0.0401 90 PRO B CG 2826 C CD . PRO B 90 ? 0.6668 1.6807 0.9390 0.2933 0.1255 0.0687 90 PRO B CD 2827 N N . LYS B 91 ? 0.6821 1.1819 0.7518 0.2324 0.1058 -0.0082 91 LYS B N 2828 C CA . LYS B 91 ? 0.7139 1.0760 0.7198 0.2336 0.1163 -0.0198 91 LYS B CA 2829 C C . LYS B 91 ? 0.6855 1.0249 0.7001 0.1790 0.1108 -0.0366 91 LYS B C 2830 O O . LYS B 91 ? 0.6437 0.9892 0.6827 0.1328 0.0894 -0.0494 91 LYS B O 2831 C CB . LYS B 91 ? 0.7277 0.9955 0.6910 0.2345 0.1021 -0.0258 91 LYS B CB 2832 C CG . LYS B 91 ? 0.7942 0.9295 0.6811 0.2553 0.1168 -0.0289 91 LYS B CG 2833 N N . THR B 92 ? 0.7185 1.0276 0.7073 0.1882 0.1330 -0.0351 92 THR B N 2834 C CA . THR B 92 ? 0.7033 0.9906 0.6942 0.1430 0.1315 -0.0449 92 THR B CA 2835 C C . THR B 92 ? 0.7417 0.9015 0.6633 0.1388 0.1304 -0.0550 92 THR B C 2836 O O . THR B 92 ? 0.8019 0.9086 0.6687 0.1703 0.1514 -0.0526 92 THR B O 2837 C CB . THR B 92 ? 0.7140 1.0786 0.7301 0.1482 0.1572 -0.0327 92 THR B CB 2838 O OG1 . THR B 92 ? 0.6857 1.1832 0.7673 0.1553 0.1575 -0.0194 92 THR B OG1 2839 C CG2 . THR B 92 ? 0.6994 1.0523 0.7251 0.0950 0.1538 -0.0391 92 THR B CG2 2840 N N . VAL B 93 ? 0.7141 0.8285 0.6368 0.0998 0.1062 -0.0657 93 VAL B N 2841 C CA . VAL B 93 ? 0.7467 0.7593 0.6144 0.0865 0.0977 -0.0726 93 VAL B CA 2842 C C . VAL B 93 ? 0.7371 0.7420 0.6121 0.0488 0.0922 -0.0734 93 VAL B C 2843 O O . VAL B 93 ? 0.6956 0.7375 0.6175 0.0203 0.0816 -0.0746 93 VAL B O 2844 C CB . VAL B 93 ? 0.7321 0.7013 0.5943 0.0774 0.0754 -0.0778 93 VAL B CB 2845 C CG1 . VAL B 93 ? 0.7584 0.6479 0.5807 0.0523 0.0605 -0.0820 93 VAL B CG1 2846 C CG2 . VAL B 93 ? 0.7669 0.7161 0.6013 0.1163 0.0839 -0.0737 93 VAL B CG2 2847 N N . TYR B 94 ? 0.7880 0.7374 0.6085 0.0499 0.1005 -0.0723 94 TYR B N 2848 C CA . TYR B 94 ? 0.7919 0.7303 0.6090 0.0201 0.0976 -0.0676 94 TYR B CA 2849 C C . TYR B 94 ? 0.7978 0.6759 0.5942 -0.0039 0.0707 -0.0684 94 TYR B C 2850 O O . TYR B 94 ? 0.8242 0.6513 0.5833 0.0006 0.0582 -0.0738 94 TYR B O 2851 C CB . TYR B 94 ? 0.8498 0.7707 0.6155 0.0346 0.1225 -0.0629 94 TYR B CB 2852 C CG . TYR B 94 ? 0.8421 0.8438 0.6412 0.0539 0.1525 -0.0551 94 TYR B CG 2853 C CD1 . TYR B 94 ? 0.8666 0.8859 0.6523 0.0992 0.1740 -0.0548 94 TYR B CD1 2854 C CD2 . TYR B 94 ? 0.8125 0.8748 0.6567 0.0271 0.1609 -0.0452 94 TYR B CD2 2855 C CE1 . TYR B 94 ? 0.8580 0.9705 0.6836 0.1201 0.2018 -0.0426 94 TYR B CE1 2856 C CE2 . TYR B 94 ? 0.8075 0.9599 0.6900 0.0387 0.1875 -0.0351 94 TYR B CE2 2857 C CZ . TYR B 94 ? 0.8254 1.0108 0.7026 0.0867 0.2072 -0.0328 94 TYR B CZ 2858 O OH . TYR B 94 ? 0.8233 1.1156 0.7470 0.1013 0.2336 -0.0181 94 TYR B OH 2859 N N . TRP B 95 ? 0.7815 0.6668 0.6014 -0.0297 0.0630 -0.0605 95 TRP B N 2860 C CA . TRP B 95 ? 0.7889 0.6336 0.5974 -0.0476 0.0386 -0.0544 95 TRP B CA 2861 C C . TRP B 95 ? 0.8559 0.6487 0.5931 -0.0499 0.0335 -0.0500 95 TRP B C 2862 O O . TRP B 95 ? 0.8916 0.6808 0.5999 -0.0503 0.0487 -0.0432 95 TRP B O 2863 C CB . TRP B 95 ? 0.7657 0.6262 0.6150 -0.0667 0.0364 -0.0438 95 TRP B CB 2864 C CG . TRP B 95 ? 0.7797 0.6103 0.6239 -0.0767 0.0135 -0.0309 95 TRP B CG 2865 C CD1 . TRP B 95 ? 0.7765 0.5979 0.6247 -0.0766 -0.0082 -0.0311 95 TRP B CD1 2866 C CD2 . TRP B 95 ? 0.8101 0.6247 0.6482 -0.0866 0.0110 -0.0112 95 TRP B CD2 2867 N NE1 . TRP B 95 ? 0.7868 0.5991 0.6376 -0.0843 -0.0252 -0.0120 95 TRP B NE1 2868 C CE2 . TRP B 95 ? 0.8115 0.6158 0.6539 -0.0876 -0.0139 0.0009 95 TRP B CE2 2869 C CE3 . TRP B 95 ? 0.8461 0.6565 0.6758 -0.0945 0.0286 0.0004 95 TRP B CE3 2870 C CZ2 . TRP B 95 ? 0.8471 0.6394 0.6862 -0.0901 -0.0229 0.0260 95 TRP B CZ2 2871 C CZ3 . TRP B 95 ? 0.8809 0.6662 0.7003 -0.0995 0.0210 0.0243 95 TRP B CZ3 2872 C CH2 . TRP B 95 ? 0.8810 0.6585 0.7054 -0.0941 -0.0050 0.0376 95 TRP B CH2 2873 N N . ASP B 96 ? 0.8795 0.6336 0.5856 -0.0557 0.0117 -0.0537 96 ASP B N 2874 C CA . ASP B 96 ? 0.9582 0.6577 0.5860 -0.0653 0.0010 -0.0537 96 ASP B CA 2875 C C . ASP B 96 ? 0.9593 0.6580 0.5952 -0.0907 -0.0334 -0.0397 96 ASP B C 2876 O O . ASP B 96 ? 0.9729 0.6540 0.5970 -0.1043 -0.0549 -0.0434 96 ASP B O 2877 C CB . ASP B 96 ? 1.0105 0.6578 0.5804 -0.0540 0.0068 -0.0716 96 ASP B CB 2878 C CG . ASP B 96 ? 1.1181 0.6938 0.5861 -0.0649 0.0022 -0.0786 96 ASP B CG 2879 O OD1 . ASP B 96 ? 1.1517 0.7251 0.5973 -0.0877 -0.0171 -0.0675 96 ASP B OD1 2880 O OD2 . ASP B 96 ? 1.1886 0.7051 0.5919 -0.0494 0.0184 -0.0951 96 ASP B OD2 2881 N N . ARG B 97 ? 0.9560 0.6762 0.6118 -0.0968 -0.0374 -0.0205 97 ARG B N 2882 C CA . ARG B 97 ? 0.9546 0.6913 0.6327 -0.1115 -0.0671 0.0008 97 ARG B CA 2883 C C . ARG B 97 ? 1.0056 0.7237 0.6376 -0.1341 -0.0999 0.0023 97 ARG B C 2884 O O . ARG B 97 ? 0.9904 0.7416 0.6581 -0.1453 -0.1265 0.0205 97 ARG B O 2885 C CB . ARG B 97 ? 0.9712 0.7142 0.6480 -0.1105 -0.0630 0.0243 97 ARG B CB 2886 C CG . ARG B 97 ? 1.0480 0.7589 0.6413 -0.1186 -0.0653 0.0292 97 ARG B CG 2887 C CD . ARG B 97 ? 1.0684 0.7848 0.6617 -0.1163 -0.0592 0.0572 97 ARG B CD 2888 N NE . ARG B 97 ? 1.0460 0.7672 0.6666 -0.1070 -0.0224 0.0540 97 ARG B NE 2889 C CZ . ARG B 97 ? 1.0631 0.7809 0.6871 -0.1075 -0.0079 0.0764 97 ARG B CZ 2890 N NH1 . ARG B 97 ? 1.1001 0.8083 0.7007 -0.1095 -0.0262 0.1065 97 ARG B NH1 2891 N NH2 . ARG B 97 ? 1.0517 0.7782 0.7023 -0.1078 0.0245 0.0712 97 ARG B NH2 2892 N N . ASP B 98 ? 1.0758 0.7421 0.6275 -0.1414 -0.0970 -0.0161 98 ASP B N 2893 C CA . ASP B 98 ? 1.1443 0.7815 0.6394 -0.1723 -0.1284 -0.0195 98 ASP B CA 2894 C C . ASP B 98 ? 1.1343 0.7585 0.6440 -0.1823 -0.1344 -0.0339 98 ASP B C 2895 O O . ASP B 98 ? 1.1413 0.7855 0.6640 -0.2117 -0.1659 -0.0243 98 ASP B O 2896 C CB . ASP B 98 ? 1.2498 0.8208 0.6323 -0.1809 -0.1237 -0.0335 98 ASP B CB 2897 C CG . ASP B 98 ? 1.2903 0.8785 0.6457 -0.1869 -0.1351 -0.0109 98 ASP B CG 2898 O OD1 . ASP B 98 ? 1.2451 0.8913 0.6710 -0.1797 -0.1429 0.0166 98 ASP B OD1 2899 O OD2 . ASP B 98 ? 1.3853 0.9231 0.6421 -0.1971 -0.1347 -0.0199 98 ASP B OD2 2900 N N . MET B 99 ? 1.1221 0.7202 0.6329 -0.1580 -0.1044 -0.0528 99 MET B N 2901 C CA . MET B 99 ? 1.1272 0.6996 0.6387 -0.1645 -0.1060 -0.0647 99 MET B CA 2902 C C . MET B 99 ? 1.0423 0.6822 0.6492 -0.1656 -0.1161 -0.0501 99 MET B C 2903 O O . MET B 99 ? 0.9844 0.6838 0.6560 -0.1550 -0.1168 -0.0341 99 MET B O 2904 C CB . MET B 99 ? 1.1454 0.6722 0.6265 -0.1308 -0.0700 -0.0841 99 MET B CB 2905 N N . THR C 1 ? 1.7534 1.1740 0.9170 -0.4857 0.3199 -0.0918 1 THR C N 2906 C CA . THR C 1 ? 1.5661 1.1128 0.8814 -0.4055 0.2900 -0.1177 1 THR C CA 2907 C C . THR C 1 ? 1.5604 1.0211 0.8435 -0.3285 0.2304 -0.1042 1 THR C C 2908 O O . THR C 1 ? 1.6430 0.9710 0.8458 -0.3116 0.1931 -0.0813 1 THR C O 2909 C CB . THR C 1 ? 1.4490 1.0753 0.8883 -0.4026 0.2800 -0.1333 1 THR C CB 2910 N N . GLN C 2 ? 1.4727 1.0124 0.8167 -0.2806 0.2188 -0.1226 2 GLN C N 2911 C CA . GLN C 2 ? 1.4649 0.9526 0.7878 -0.2196 0.1646 -0.1164 2 GLN C CA 2912 C C . GLN C 2 ? 1.3821 0.8741 0.7777 -0.1784 0.1171 -0.1137 2 GLN C C 2913 O O . GLN C 2 ? 1.4240 0.8502 0.7735 -0.1391 0.0710 -0.1028 2 GLN C O 2914 C CB . GLN C 2 ? 1.4074 0.9743 0.7767 -0.1906 0.1649 -0.1415 2 GLN C CB 2915 N N . VAL C 3 ? 1.2706 0.8524 0.7785 -0.1844 0.1281 -0.1267 3 VAL C N 2916 C CA . VAL C 3 ? 1.1884 0.7963 0.7709 -0.1499 0.0917 -0.1274 3 VAL C CA 2917 C C . VAL C 3 ? 1.1662 0.7892 0.7857 -0.1770 0.1092 -0.1296 3 VAL C C 2918 O O . VAL C 3 ? 1.1153 0.8191 0.7945 -0.2080 0.1427 -0.1435 3 VAL C O 2919 C CB . VAL C 3 ? 1.0723 0.7772 0.7554 -0.1216 0.0748 -0.1426 3 VAL C CB 2920 C CG1 . VAL C 3 ? 0.9844 0.7428 0.7517 -0.1045 0.0549 -0.1444 3 VAL C CG1 2921 C CG2 . VAL C 3 ? 1.1029 0.7804 0.7468 -0.0950 0.0417 -0.1420 3 VAL C CG2 2922 N N . GLU C 4 ? 1.2129 0.7615 0.7944 -0.1592 0.0824 -0.1207 4 GLU C N 2923 C CA . GLU C 4 ? 1.2271 0.7570 0.8148 -0.1864 0.0936 -0.1246 4 GLU C CA 2924 C C . GLU C 4 ? 1.1391 0.7256 0.8075 -0.1431 0.0655 -0.1358 4 GLU C C 2925 O O . GLU C 4 ? 1.1281 0.7164 0.8016 -0.0891 0.0294 -0.1353 4 GLU C O 2926 C CB . GLU C 4 ? 1.4050 0.7641 0.8447 -0.2094 0.0901 -0.1073 4 GLU C CB 2927 N N . GLN C 5 ? 1.0806 0.7272 0.8118 -0.1686 0.0827 -0.1487 5 GLN C N 2928 C CA . GLN C 5 ? 1.0080 0.7104 0.8056 -0.1343 0.0624 -0.1603 5 GLN C CA 2929 C C . GLN C 5 ? 1.0815 0.7134 0.8352 -0.1511 0.0612 -0.1695 5 GLN C C 2930 O O . GLN C 5 ? 1.1345 0.7345 0.8578 -0.2116 0.0866 -0.1723 5 GLN C O 2931 C CB . GLN C 5 ? 0.8754 0.7147 0.7850 -0.1360 0.0732 -0.1693 5 GLN C CB 2932 C CG . GLN C 5 ? 0.8105 0.7076 0.7661 -0.0981 0.0521 -0.1643 5 GLN C CG 2933 C CD . GLN C 5 ? 0.7254 0.7070 0.7495 -0.1052 0.0617 -0.1669 5 GLN C CD 2934 O OE1 . GLN C 5 ? 0.6628 0.7030 0.7375 -0.0933 0.0518 -0.1673 5 GLN C OE1 2935 N NE2 . GLN C 5 ? 0.7338 0.7144 0.7472 -0.1212 0.0798 -0.1694 5 GLN C NE2 2936 N N . SER C 6 ? 1.0932 0.7061 0.8409 -0.0986 0.0313 -0.1780 6 SER C N 2937 C CA . SER C 6 ? 1.1748 0.7103 0.8729 -0.1001 0.0224 -0.1929 6 SER C CA 2938 C C . SER C 6 ? 1.0798 0.7232 0.8609 -0.0593 0.0111 -0.2125 6 SER C C 2939 O O . SER C 6 ? 1.0042 0.7354 0.8408 -0.0122 -0.0020 -0.2123 6 SER C O 2940 C CB . SER C 6 ? 1.3467 0.7077 0.9090 -0.0622 -0.0082 -0.1888 6 SER C CB 2941 N N . PRO C 7 ? 1.0912 0.7344 0.8775 -0.0849 0.0175 -0.2304 7 PRO C N 2942 C CA . PRO C 7 ? 1.1747 0.7416 0.9096 -0.1581 0.0349 -0.2348 7 PRO C CA 2943 C C . PRO C 7 ? 1.0676 0.7651 0.8938 -0.2124 0.0659 -0.2332 7 PRO C C 2944 O O . PRO C 7 ? 0.9506 0.7587 0.8568 -0.1870 0.0698 -0.2249 7 PRO C O 2945 C CB . PRO C 7 ? 1.2253 0.7598 0.9381 -0.1477 0.0194 -0.2626 7 PRO C CB 2946 C CG . PRO C 7 ? 1.1605 0.7682 0.9166 -0.0615 -0.0018 -0.2724 7 PRO C CG 2947 C CD . PRO C 7 ? 1.0363 0.7593 0.8730 -0.0456 0.0065 -0.2512 7 PRO C CD 2948 N N . GLN C 8 ? 1.1210 0.8055 0.9302 -0.2859 0.0853 -0.2438 8 GLN C N 2949 C CA . GLN C 8 ? 1.0293 0.8614 0.9316 -0.3277 0.1110 -0.2524 8 GLN C CA 2950 C C . GLN C 8 ? 0.9191 0.8740 0.9126 -0.2917 0.0970 -0.2684 8 GLN C C 2951 O O . GLN C 8 ? 0.8137 0.8830 0.8860 -0.2660 0.1001 -0.2648 8 GLN C O 2952 C CB . GLN C 8 ? 1.1235 0.9364 0.9911 -0.4220 0.1343 -0.2665 8 GLN C CB 2953 C CG . GLN C 8 ? 1.0711 1.0184 1.0050 -0.4653 0.1692 -0.2711 8 GLN C CG 2954 C CD . GLN C 8 ? 1.1671 1.0292 1.0178 -0.5043 0.1953 -0.2495 8 GLN C CD 2955 O OE1 . GLN C 8 ? 1.1179 0.9793 0.9691 -0.4575 0.1959 -0.2313 8 GLN C OE1 2956 N NE2 . GLN C 8 ? 1.3168 1.0972 1.0830 -0.5971 0.2162 -0.2510 8 GLN C NE2 2957 N N . SER C 9 ? 0.9641 0.8762 0.9288 -0.2878 0.0790 -0.2861 9 SER C N 2958 C CA . SER C 9 ? 0.8864 0.8951 0.9123 -0.2547 0.0641 -0.3011 9 SER C CA 2959 C C . SER C 9 ? 0.9407 0.8707 0.9105 -0.2094 0.0414 -0.3111 9 SER C C 2960 O O . SER C 9 ? 1.0640 0.8740 0.9506 -0.2302 0.0322 -0.3275 9 SER C O 2961 C CB . SER C 9 ? 0.8870 0.9787 0.9533 -0.3090 0.0683 -0.3280 9 SER C CB 2962 O OG . SER C 9 ? 1.0007 1.0116 1.0062 -0.3862 0.0803 -0.3398 9 SER C OG 2963 N N . LEU C 10 ? 0.8626 0.8566 0.8697 -0.1488 0.0328 -0.3031 10 LEU C N 2964 C CA . LEU C 10 ? 0.8983 0.8656 0.8695 -0.0974 0.0155 -0.3196 10 LEU C CA 2965 C C . LEU C 10 ? 0.8497 0.9132 0.8598 -0.0932 0.0114 -0.3358 10 LEU C C 2966 O O . LEU C 10 ? 0.7613 0.9283 0.8354 -0.0994 0.0175 -0.3217 10 LEU C O 2967 C CB . LEU C 10 ? 0.8609 0.8533 0.8431 -0.0388 0.0116 -0.3041 10 LEU C CB 2968 N N . VAL C 11 ? 0.9262 0.9403 0.8827 -0.0788 -0.0025 -0.3665 11 VAL C N 2969 C CA . VAL C 11 ? 0.9031 0.9952 0.8770 -0.0743 -0.0093 -0.3861 11 VAL C CA 2970 C C . VAL C 11 ? 0.9314 1.0331 0.8727 -0.0089 -0.0154 -0.4025 11 VAL C C 2971 O O . VAL C 11 ? 1.0330 1.0332 0.9047 0.0240 -0.0269 -0.4251 11 VAL C O 2972 C CB . VAL C 11 ? 0.9861 1.0274 0.9240 -0.1276 -0.0212 -0.4186 11 VAL C CB 2973 C CG1 . VAL C 11 ? 0.9409 1.0936 0.9164 -0.1312 -0.0303 -0.4328 11 VAL C CG1 2974 C CG2 . VAL C 11 ? 0.9940 1.0080 0.9458 -0.1979 -0.0101 -0.4094 11 VAL C CG2 2975 N N . VAL C 12 ? 0.8575 1.0783 0.8398 0.0119 -0.0079 -0.3922 12 VAL C N 2976 C CA . VAL C 12 ? 0.8778 1.1469 0.8388 0.0691 -0.0050 -0.4086 12 VAL C CA 2977 C C . VAL C 12 ? 0.8803 1.2259 0.8307 0.0726 -0.0051 -0.4226 12 VAL C C 2978 O O . VAL C 12 ? 0.8334 1.2297 0.8117 0.0391 -0.0059 -0.4032 12 VAL C O 2979 C CB . VAL C 12 ? 0.8078 1.1595 0.8151 0.0923 0.0113 -0.3802 12 VAL C CB 2980 C CG1 . VAL C 12 ? 0.8387 1.1140 0.8339 0.1148 0.0042 -0.3797 12 VAL C CG1 2981 C CG2 . VAL C 12 ? 0.7134 1.1320 0.7758 0.0502 0.0225 -0.3372 12 VAL C CG2 2982 N N . ARG C 13 ? 0.9487 1.3003 0.8500 0.1208 -0.0070 -0.4589 13 ARG C N 2983 C CA . ARG C 13 ? 0.9634 1.3951 0.8420 0.1306 -0.0034 -0.4729 13 ARG C CA 2984 C C . ARG C 13 ? 0.8899 1.4522 0.8083 0.1308 0.0234 -0.4362 13 ARG C C 2985 O O . ARG C 13 ? 0.8755 1.4926 0.8141 0.1604 0.0400 -0.4353 13 ARG C O 2986 C CB . ARG C 13 ? 1.0759 1.4722 0.8809 0.1876 -0.0118 -0.5294 13 ARG C CB 2987 N N . GLN C 14 ? 0.8590 1.4678 0.7816 0.0960 0.0245 -0.4072 14 GLN C N 2988 C CA . GLN C 14 ? 0.8208 1.5211 0.7570 0.0787 0.0478 -0.3647 14 GLN C CA 2989 C C . GLN C 14 ? 0.8420 1.6425 0.7710 0.1081 0.0768 -0.3794 14 GLN C C 2990 O O . GLN C 14 ? 0.9056 1.7353 0.7908 0.1466 0.0800 -0.4215 14 GLN C O 2991 C CB . GLN C 14 ? 0.8458 1.5638 0.7404 0.0564 0.0389 -0.3449 14 GLN C CB 2992 C CG . GLN C 14 ? 0.8356 1.5963 0.7228 0.0235 0.0561 -0.2896 14 GLN C CG 2993 C CD . GLN C 14 ? 0.9125 1.7225 0.7207 0.0167 0.0653 -0.2782 14 GLN C CD 2994 O OE1 . GLN C 14 ? 0.9652 1.8004 0.7297 0.0433 0.0635 -0.3164 14 GLN C OE1 2995 N NE2 . GLN C 14 ? 0.9351 1.7452 0.7095 -0.0213 0.0742 -0.2250 14 GLN C NE2 2996 N N . GLY C 15 ? 0.7962 1.6587 0.7691 0.0895 0.0974 -0.3491 15 GLY C N 2997 C CA . GLY C 15 ? 0.8100 1.8072 0.7943 0.1076 0.1282 -0.3633 15 GLY C CA 2998 C C . GLY C 15 ? 0.8186 1.8293 0.8318 0.1724 0.1223 -0.4092 15 GLY C C 2999 O O . GLY C 15 ? 0.8622 1.9766 0.8673 0.2215 0.1380 -0.4502 15 GLY C O 3000 N N . GLU C 16 ? 0.7924 1.6972 0.8305 0.1780 0.0983 -0.4041 16 GLU C N 3001 C CA . GLU C 16 ? 0.8198 1.7091 0.8696 0.2423 0.0847 -0.4401 16 GLU C CA 3002 C C . GLU C 16 ? 0.7612 1.6249 0.8624 0.2181 0.0773 -0.4074 16 GLU C C 3003 O O . GLU C 16 ? 0.7015 1.5641 0.8296 0.1528 0.0851 -0.3609 16 GLU C O 3004 C CB . GLU C 16 ? 0.9064 1.6421 0.8895 0.2871 0.0545 -0.4801 16 GLU C CB 3005 C CG . GLU C 16 ? 0.9946 1.7579 0.9175 0.3371 0.0563 -0.5311 16 GLU C CG 3006 C CD . GLU C 16 ? 1.1061 1.6893 0.9463 0.3645 0.0224 -0.5697 16 GLU C CD 3007 O OE1 . GLU C 16 ? 1.1135 1.5544 0.9431 0.3350 0.0011 -0.5534 16 GLU C OE1 3008 O OE2 . GLU C 16 ? 1.1979 1.7798 0.9756 0.4105 0.0182 -0.6179 16 GLU C OE2 3009 N N . ASN C 17 ? 0.7961 1.6312 0.8989 0.2771 0.0584 -0.4340 17 ASN C N 3010 C CA . ASN C 17 ? 0.7569 1.5649 0.8969 0.2643 0.0467 -0.4092 17 ASN C CA 3011 C C . ASN C 17 ? 0.7630 1.3904 0.8706 0.2320 0.0282 -0.3857 17 ASN C C 3012 O O . ASN C 17 ? 0.8176 1.3321 0.8706 0.2325 0.0178 -0.3996 17 ASN C O 3013 C CB . ASN C 17 ? 0.8071 1.6583 0.9513 0.3494 0.0280 -0.4483 17 ASN C CB 3014 C CG . ASN C 17 ? 0.7921 1.8709 0.9912 0.3769 0.0505 -0.4751 17 ASN C CG 3015 O OD1 . ASN C 17 ? 0.7890 1.9628 0.9880 0.3568 0.0791 -0.4810 17 ASN C OD1 3016 N ND2 . ASN C 17 ? 0.7920 1.9699 1.0362 0.4223 0.0376 -0.4936 17 ASN C ND2 3017 N N . SER C 18 ? 0.7146 1.3253 0.8550 0.1985 0.0255 -0.3529 18 SER C N 3018 C CA . SER C 18 ? 0.7199 1.1858 0.8349 0.1656 0.0141 -0.3313 18 SER C CA 3019 C C . SER C 18 ? 0.7018 1.1572 0.8365 0.1655 0.0044 -0.3133 18 SER C C 3020 O O . SER C 18 ? 0.6386 1.1871 0.8258 0.1348 0.0143 -0.2916 18 SER C O 3021 C CB . SER C 18 ? 0.6654 1.1268 0.7975 0.1003 0.0280 -0.3023 18 SER C CB 3022 O OG . SER C 18 ? 0.6088 1.1797 0.7835 0.0699 0.0442 -0.2776 18 SER C OG 3023 N N . VAL C 19 ? 0.7761 1.1067 0.8549 0.1969 -0.0173 -0.3226 19 VAL C N 3024 C CA . VAL C 19 ? 0.7798 1.0798 0.8573 0.2023 -0.0315 -0.3071 19 VAL C CA 3025 C C . VAL C 19 ? 0.7898 0.9608 0.8325 0.1495 -0.0273 -0.2805 19 VAL C C 3026 O O . VAL C 19 ? 0.8577 0.9113 0.8403 0.1372 -0.0283 -0.2868 19 VAL C O 3027 C CB . VAL C 19 ? 0.8840 1.1333 0.9056 0.2868 -0.0641 -0.3361 19 VAL C CB 3028 N N . LEU C 20 ? 0.7318 0.9311 0.8097 0.1142 -0.0214 -0.2541 20 LEU C N 3029 C CA . LEU C 20 ? 0.7433 0.8429 0.7903 0.0714 -0.0148 -0.2332 20 LEU C CA 3030 C C . LEU C 20 ? 0.7817 0.8378 0.7977 0.0891 -0.0323 -0.2238 20 LEU C C 3031 O O . LEU C 20 ? 0.7493 0.8936 0.8036 0.1119 -0.0455 -0.2260 20 LEU C O 3032 C CB . LEU C 20 ? 0.6596 0.8141 0.7602 0.0185 0.0063 -0.2141 20 LEU C CB 3033 C CG . LEU C 20 ? 0.6161 0.8325 0.7498 0.0035 0.0183 -0.2189 20 LEU C CG 3034 C CD1 . LEU C 20 ? 0.5569 0.8009 0.7236 -0.0343 0.0293 -0.1993 20 LEU C CD1 3035 C CD2 . LEU C 20 ? 0.6674 0.8198 0.7617 0.0028 0.0187 -0.2388 20 LEU C CD2 3036 N N . GLN C 21 ? 0.8579 0.7835 0.8004 0.0724 -0.0321 -0.2143 21 GLN C N 3037 C CA . GLN C 21 ? 0.9276 0.7803 0.8094 0.0937 -0.0524 -0.2051 21 GLN C CA 3038 C C . GLN C 21 ? 0.8986 0.7371 0.7819 0.0436 -0.0344 -0.1835 21 GLN C C 3039 O O . GLN C 21 ? 0.8479 0.7064 0.7631 -0.0050 -0.0059 -0.1779 21 GLN C O 3040 C CB . GLN C 21 ? 1.0851 0.7683 0.8440 0.1185 -0.0698 -0.2092 21 GLN C CB 3041 C CG . GLN C 21 ? 1.1481 0.8142 0.8814 0.1808 -0.0924 -0.2376 21 GLN C CG 3042 C CD . GLN C 21 ? 1.1218 0.9071 0.9030 0.2586 -0.1214 -0.2576 21 GLN C CD 3043 O OE1 . GLN C 21 ? 1.1374 0.9385 0.9118 0.2843 -0.1433 -0.2514 21 GLN C OE1 3044 N NE2 . GLN C 21 ? 1.0867 0.9706 0.9176 0.2948 -0.1214 -0.2853 21 GLN C NE2 3045 N N . CYS C 22 ? 0.9400 0.7500 0.7857 0.0637 -0.0545 -0.1762 22 CYS C N 3046 C CA . CYS C 22 ? 0.9374 0.7220 0.7646 0.0270 -0.0415 -0.1603 22 CYS C CA 3047 C C . CYS C 22 ? 1.0438 0.7408 0.7789 0.0593 -0.0707 -0.1539 22 CYS C C 3048 O O . CYS C 22 ? 1.0538 0.7955 0.7991 0.1110 -0.1074 -0.1641 22 CYS C O 3049 C CB . CYS C 22 ? 0.8305 0.7320 0.7472 0.0087 -0.0367 -0.1602 22 CYS C CB 3050 S SG . CYS C 22 ? 0.8445 0.7135 0.7327 -0.0232 -0.0256 -0.1499 22 CYS C SG 3051 N N . ASN C 23 ? 1.1327 0.7136 0.7749 0.0283 -0.0548 -0.1385 23 ASN C N 3052 C CA . ASN C 23 ? 1.2554 0.7349 0.7878 0.0529 -0.0808 -0.1273 23 ASN C CA 3053 C C . ASN C 23 ? 1.2562 0.7268 0.7641 0.0076 -0.0551 -0.1159 23 ASN C C 3054 O O . ASN C 23 ? 1.2505 0.7099 0.7549 -0.0480 -0.0113 -0.1111 23 ASN C O 3055 C CB . ASN C 23 ? 1.4293 0.7316 0.8208 0.0638 -0.0913 -0.1167 23 ASN C CB 3056 C CG . ASN C 23 ? 1.4995 0.7721 0.8589 0.1511 -0.1445 -0.1309 23 ASN C CG 3057 O OD1 . ASN C 23 ? 1.4622 0.7715 0.8686 0.1753 -0.1483 -0.1491 23 ASN C OD1 3058 N ND2 . ASN C 23 ? 1.6045 0.8153 0.8791 0.2060 -0.1884 -0.1266 23 ASN C ND2 3059 N N . TYR C 24 ? 1.2682 0.7565 0.7611 0.0336 -0.0836 -0.1169 24 TYR C N 3060 C CA . TYR C 24 ? 1.2793 0.7594 0.7416 0.0002 -0.0635 -0.1121 24 TYR C CA 3061 C C . TYR C 24 ? 1.4302 0.7986 0.7553 0.0237 -0.0916 -0.0997 24 TYR C C 3062 O O . TYR C 24 ? 1.4948 0.8326 0.7798 0.0811 -0.1419 -0.1010 24 TYR C O 3063 C CB . TYR C 24 ? 1.1570 0.7617 0.7269 -0.0042 -0.0683 -0.1282 24 TYR C CB 3064 C CG . TYR C 24 ? 1.1300 0.8037 0.7409 0.0354 -0.1193 -0.1398 24 TYR C CG 3065 C CD1 . TYR C 24 ? 1.1941 0.8510 0.7507 0.0525 -0.1536 -0.1439 24 TYR C CD1 3066 C CD2 . TYR C 24 ? 1.0430 0.8148 0.7481 0.0523 -0.1323 -0.1503 24 TYR C CD2 3067 C CE1 . TYR C 24 ? 1.1712 0.9179 0.7754 0.0828 -0.2022 -0.1602 24 TYR C CE1 3068 C CE2 . TYR C 24 ? 1.0240 0.8919 0.7768 0.0810 -0.1746 -0.1659 24 TYR C CE2 3069 C CZ . TYR C 24 ? 1.0853 0.9457 0.7921 0.0946 -0.2106 -0.1718 24 TYR C CZ 3070 O OH . TYR C 24 ? 1.0678 1.0474 0.8307 0.1174 -0.2546 -0.1925 24 TYR C OH 3071 N N . SER C 25 ? 1.4954 0.8088 0.7442 -0.0160 -0.0594 -0.0902 25 SER C N 3072 C CA . SER C 25 ? 1.6451 0.8545 0.7530 -0.0003 -0.0819 -0.0774 25 SER C CA 3073 C C . SER C 25 ? 1.6087 0.8786 0.7342 -0.0166 -0.0700 -0.0914 25 SER C C 3074 O O . SER C 25 ? 1.6912 0.9086 0.7281 -0.0503 -0.0347 -0.0846 25 SER C O 3075 C CB . SER C 25 ? 1.8149 0.8656 0.7672 -0.0373 -0.0532 -0.0495 25 SER C CB 3076 O OG . SER C 25 ? 1.7809 0.8689 0.7601 -0.1104 0.0151 -0.0503 25 SER C OG 3077 N N . VAL C 26 ? 1.4994 0.8781 0.7329 0.0044 -0.0991 -0.1132 26 VAL C N 3078 C CA . VAL C 26 ? 1.4679 0.8955 0.7245 -0.0098 -0.0942 -0.1323 26 VAL C CA 3079 C C . VAL C 26 ? 1.5065 0.9496 0.7447 0.0239 -0.1570 -0.1445 26 VAL C C 3080 O O . VAL C 26 ? 1.4644 0.9699 0.7664 0.0523 -0.1993 -0.1506 26 VAL C O 3081 C CB . VAL C 26 ? 1.3237 0.8528 0.7156 -0.0317 -0.0699 -0.1486 26 VAL C CB 3082 C CG1 . VAL C 26 ? 1.3098 0.8718 0.7230 -0.0351 -0.0868 -0.1714 26 VAL C CG1 3083 C CG2 . VAL C 26 ? 1.3023 0.8328 0.7030 -0.0639 -0.0088 -0.1459 26 VAL C CG2 3084 N N . THR C 27 ? 1.5949 0.9933 0.7455 0.0205 -0.1624 -0.1521 27 THR C N 3085 C CA . THR C 27 ? 1.6435 1.0607 0.7707 0.0449 -0.2238 -0.1693 27 THR C CA 3086 C C . THR C 27 ? 1.6533 1.0758 0.7694 0.0196 -0.2156 -0.1944 27 THR C C 3087 O O . THR C 27 ? 1.7027 1.0718 0.7513 0.0040 -0.1693 -0.1944 27 THR C O 3088 C CB . THR C 27 ? 1.8042 1.1221 0.7822 0.0841 -0.2603 -0.1535 27 THR C CB 3089 O OG1 . THR C 27 ? 1.8523 1.1017 0.7890 0.1016 -0.2502 -0.1257 27 THR C OG1 3090 C CG2 . THR C 27 ? 1.8273 1.2069 0.8202 0.1250 -0.3395 -0.1737 27 THR C CG2 3091 N N . PRO C 28 ? 1.6180 1.1076 0.7980 0.0127 -0.2595 -0.2194 28 PRO C N 3092 C CA . PRO C 28 ? 1.5494 1.1420 0.8314 0.0192 -0.3050 -0.2254 28 PRO C CA 3093 C C . PRO C 28 ? 1.4196 1.0816 0.8284 -0.0078 -0.2730 -0.2213 28 PRO C C 3094 O O . PRO C 28 ? 1.3874 1.0208 0.8097 -0.0328 -0.2300 -0.2217 28 PRO C O 3095 C CB . PRO C 28 ? 1.5890 1.2168 0.8690 0.0002 -0.3551 -0.2562 28 PRO C CB 3096 C CG . PRO C 28 ? 1.6327 1.1786 0.8516 -0.0245 -0.3240 -0.2688 28 PRO C CG 3097 C CD . PRO C 28 ? 1.6639 1.1302 0.8080 -0.0074 -0.2662 -0.2478 28 PRO C CD 3098 N N . ASP C 29 ? 1.3566 1.1134 0.8515 0.0040 -0.2956 -0.2197 29 ASP C N 3099 C CA . ASP C 29 ? 1.2428 1.0667 0.8466 -0.0181 -0.2661 -0.2134 29 ASP C CA 3100 C C . ASP C 29 ? 1.1911 1.1319 0.8890 -0.0558 -0.2947 -0.2310 29 ASP C C 3101 O O . ASP C 29 ? 1.1711 1.2238 0.9265 -0.0394 -0.3271 -0.2405 29 ASP C O 3102 C CB . ASP C 29 ? 1.2193 1.0537 0.8385 0.0221 -0.2567 -0.1974 29 ASP C CB 3103 C CG . ASP C 29 ? 1.2801 1.1523 0.8762 0.0782 -0.3116 -0.2055 29 ASP C CG 3104 O OD1 . ASP C 29 ? 1.3581 1.2228 0.8981 0.0911 -0.3536 -0.2178 29 ASP C OD1 3105 O OD2 . ASP C 29 ? 1.2633 1.1718 0.8920 0.1168 -0.3166 -0.2030 29 ASP C OD2 3106 N N . ASN C 30 ? 1.1858 1.0993 0.8915 -0.1068 -0.2833 -0.2375 30 ASN C N 3107 C CA . ASN C 30 ? 1.1660 1.1648 0.9393 -0.1637 -0.3066 -0.2505 30 ASN C CA 3108 C C . ASN C 30 ? 1.0708 1.1700 0.9438 -0.1794 -0.2855 -0.2385 30 ASN C C 3109 O O . ASN C 30 ? 1.0444 1.2821 0.9881 -0.1923 -0.3090 -0.2496 30 ASN C O 3110 C CB . ASN C 30 ? 1.2267 1.1268 0.9517 -0.2128 -0.3036 -0.2588 30 ASN C CB 3111 C CG . ASN C 30 ? 1.2486 1.2091 1.0162 -0.2892 -0.3315 -0.2705 30 ASN C CG 3112 O OD1 . ASN C 30 ? 1.2150 1.1851 1.0236 -0.3313 -0.3112 -0.2571 30 ASN C OD1 3113 N ND2 . ASN C 30 ? 1.3161 1.3184 1.0673 -0.3136 -0.3792 -0.2953 30 ASN C ND2 3114 N N . HIS C 31 ? 1.0240 1.0673 0.9027 -0.1764 -0.2417 -0.2196 31 HIS C N 3115 C CA . HIS C 31 ? 0.9480 1.0703 0.9057 -0.1943 -0.2198 -0.2078 31 HIS C CA 3116 C C . HIS C 31 ? 0.8974 0.9733 0.8554 -0.1583 -0.1788 -0.1906 31 HIS C C 3117 O O . HIS C 31 ? 0.9218 0.9106 0.8227 -0.1271 -0.1635 -0.1876 31 HIS C O 3118 C CB . HIS C 31 ? 0.9736 1.0828 0.9398 -0.2672 -0.2191 -0.2047 31 HIS C CB 3119 C CG . HIS C 31 ? 1.0346 0.9919 0.9275 -0.2711 -0.2055 -0.2001 31 HIS C CG 3120 N ND1 . HIS C 31 ? 1.1391 1.0041 0.9596 -0.2930 -0.2300 -0.2158 31 HIS C ND1 3121 C CD2 . HIS C 31 ? 1.0183 0.9076 0.8983 -0.2481 -0.1733 -0.1874 31 HIS C CD2 3122 C CE1 . HIS C 31 ? 1.1837 0.9276 0.9474 -0.2761 -0.2125 -0.2142 31 HIS C CE1 3123 N NE2 . HIS C 31 ? 1.1119 0.8773 0.9154 -0.2481 -0.1788 -0.1972 31 HIS C NE2 3124 N N . LEU C 32 ? 0.8345 0.9778 0.8550 -0.1693 -0.1603 -0.1813 32 LEU C N 3125 C CA . LEU C 32 ? 0.7862 0.9014 0.8149 -0.1429 -0.1257 -0.1688 32 LEU C CA 3126 C C . LEU C 32 ? 0.7479 0.8964 0.8183 -0.1769 -0.1078 -0.1573 32 LEU C C 3127 O O . LEU C 32 ? 0.7197 0.9711 0.8414 -0.1982 -0.1115 -0.1579 32 LEU C O 3128 C CB . LEU C 32 ? 0.7672 0.9223 0.8080 -0.0927 -0.1270 -0.1722 32 LEU C CB 3129 C CG . LEU C 32 ? 0.7532 0.8517 0.7779 -0.0681 -0.0960 -0.1633 32 LEU C CG 3130 C CD1 . LEU C 32 ? 0.8115 0.8694 0.7875 -0.0213 -0.1073 -0.1662 32 LEU C CD1 3131 C CD2 . LEU C 32 ? 0.6958 0.8583 0.7792 -0.0759 -0.0778 -0.1596 32 LEU C CD2 3132 N N . ARG C 33 ? 0.7569 0.8236 0.7995 -0.1783 -0.0888 -0.1488 33 ARG C N 3133 C CA . ARG C 33 ? 0.7448 0.8136 0.8030 -0.2007 -0.0755 -0.1351 33 ARG C CA 3134 C C . ARG C 33 ? 0.6859 0.7782 0.7713 -0.1654 -0.0507 -0.1325 33 ARG C C 3135 O O . ARG C 33 ? 0.6790 0.7374 0.7495 -0.1337 -0.0390 -0.1395 33 ARG C O 3136 C CB . ARG C 33 ? 0.8131 0.7690 0.8128 -0.2093 -0.0794 -0.1324 33 ARG C CB 3137 C CG . ARG C 33 ? 0.8759 0.7968 0.8492 -0.2617 -0.0915 -0.1174 33 ARG C CG 3138 C CD . ARG C 33 ? 0.9745 0.8147 0.8880 -0.2988 -0.1193 -0.1252 33 ARG C CD 3139 N NE . ARG C 33 ? 1.0736 0.8564 0.9414 -0.3651 -0.1326 -0.1080 33 ARG C NE 3140 C CZ . ARG C 33 ? 1.1926 0.8814 0.9914 -0.4161 -0.1599 -0.1122 33 ARG C CZ 3141 N NH1 . ARG C 33 ? 1.2189 0.8702 0.9918 -0.4013 -0.1782 -0.1362 33 ARG C NH1 3142 N NH2 . ARG C 33 ? 1.2976 0.9184 1.0400 -0.4874 -0.1698 -0.0917 33 ARG C NH2 3143 N N . TRP C 34 ? 0.6555 0.8063 0.7740 -0.1783 -0.0419 -0.1235 34 TRP C N 3144 C CA . TRP C 34 ? 0.6153 0.7781 0.7511 -0.1524 -0.0223 -0.1227 34 TRP C CA 3145 C C . TRP C 34 ? 0.6450 0.7601 0.7574 -0.1630 -0.0199 -0.1102 34 TRP C C 3146 O O . TRP C 34 ? 0.6883 0.7928 0.7804 -0.2003 -0.0285 -0.0951 34 TRP C O 3147 C CB . TRP C 34 ? 0.5762 0.8357 0.7535 -0.1478 -0.0165 -0.1260 34 TRP C CB 3148 C CG . TRP C 34 ? 0.5606 0.8446 0.7476 -0.1094 -0.0206 -0.1426 34 TRP C CG 3149 C CD1 . TRP C 34 ? 0.5686 0.9076 0.7682 -0.0982 -0.0389 -0.1536 34 TRP C CD1 3150 C CD2 . TRP C 34 ? 0.5557 0.8003 0.7282 -0.0762 -0.0110 -0.1510 34 TRP C CD2 3151 N NE1 . TRP C 34 ? 0.5800 0.8987 0.7626 -0.0493 -0.0446 -0.1667 34 TRP C NE1 3152 C CE2 . TRP C 34 ? 0.5828 0.8331 0.7429 -0.0420 -0.0262 -0.1636 34 TRP C CE2 3153 C CE3 . TRP C 34 ? 0.5491 0.7539 0.7131 -0.0747 0.0058 -0.1511 34 TRP C CE3 3154 C CZ2 . TRP C 34 ? 0.6179 0.8039 0.7390 -0.0110 -0.0246 -0.1719 34 TRP C CZ2 3155 C CZ3 . TRP C 34 ? 0.5728 0.7371 0.7130 -0.0552 0.0111 -0.1619 34 TRP C CZ3 3156 C CH2 . TRP C 34 ? 0.6143 0.7542 0.7244 -0.0259 -0.0038 -0.1699 34 TRP C CH2 3157 N N . PHE C 35 ? 0.6365 0.7223 0.7447 -0.1322 -0.0104 -0.1172 35 PHE C N 3158 C CA . PHE C 35 ? 0.6752 0.7201 0.7582 -0.1237 -0.0156 -0.1101 35 PHE C CA 3159 C C . PHE C 35 ? 0.6378 0.7361 0.7483 -0.1090 -0.0058 -0.1108 35 PHE C C 3160 O O . PHE C 35 ? 0.5842 0.7371 0.7310 -0.1019 0.0078 -0.1223 35 PHE C O 3161 C CB . PHE C 35 ? 0.7139 0.6980 0.7688 -0.0924 -0.0195 -0.1249 35 PHE C CB 3162 C CG . PHE C 35 ? 0.7994 0.6957 0.7977 -0.1053 -0.0389 -0.1225 35 PHE C CG 3163 C CD1 . PHE C 35 ? 0.8969 0.7065 0.8339 -0.1166 -0.0612 -0.1075 35 PHE C CD1 3164 C CD2 . PHE C 35 ? 0.8046 0.6882 0.7947 -0.1085 -0.0382 -0.1349 35 PHE C CD2 3165 C CE1 . PHE C 35 ? 0.9928 0.6991 0.8625 -0.1351 -0.0829 -0.1078 35 PHE C CE1 3166 C CE2 . PHE C 35 ? 0.8852 0.6834 0.8169 -0.1228 -0.0595 -0.1373 35 PHE C CE2 3167 C CZ . PHE C 35 ? 0.9825 0.6893 0.8545 -0.1383 -0.0822 -0.1252 35 PHE C CZ 3168 N N . LYS C 36 ? 0.6845 0.7523 0.7636 -0.1036 -0.0172 -0.0988 36 LYS C N 3169 C CA . LYS C 36 ? 0.6656 0.7806 0.7603 -0.0871 -0.0142 -0.1007 36 LYS C CA 3170 C C . LYS C 36 ? 0.7082 0.7923 0.7821 -0.0444 -0.0302 -0.1097 36 LYS C C 3171 O O . LYS C 36 ? 0.7991 0.7989 0.8089 -0.0341 -0.0527 -0.0951 36 LYS C O 3172 C CB . LYS C 36 ? 0.6942 0.8218 0.7627 -0.1185 -0.0151 -0.0768 36 LYS C CB 3173 N N . GLN C 37 ? 0.6583 0.8095 0.7805 -0.0195 -0.0214 -0.1359 37 GLN C N 3174 C CA . GLN C 37 ? 0.6927 0.8540 0.8133 0.0283 -0.0373 -0.1545 37 GLN C CA 3175 C C . GLN C 37 ? 0.6876 0.9091 0.8221 0.0446 -0.0483 -0.1606 37 GLN C C 3176 O O . GLN C 37 ? 0.6259 0.9304 0.8137 0.0311 -0.0331 -0.1804 37 GLN C O 3177 C CB . GLN C 37 ? 0.6598 0.8723 0.8253 0.0418 -0.0196 -0.1866 37 GLN C CB 3178 C CG . GLN C 37 ? 0.7140 0.9301 0.8689 0.1014 -0.0375 -0.2100 37 GLN C CG 3179 C CD . GLN C 37 ? 0.6781 0.9821 0.8853 0.1083 -0.0117 -0.2466 37 GLN C CD 3180 O OE1 . GLN C 37 ? 0.6294 0.9666 0.8659 0.0612 0.0190 -0.2488 37 GLN C OE1 3181 N NE2 . GLN C 37 ? 0.7196 1.0603 0.9298 0.1690 -0.0246 -0.2768 37 GLN C NE2 3182 N N . ASP C 38 ? 0.7719 0.9360 0.8437 0.0713 -0.0780 -0.1430 38 ASP C N 3183 C CA . ASP C 38 ? 0.7931 1.0056 0.8622 0.1005 -0.0985 -0.1504 38 ASP C CA 3184 C C . ASP C 38 ? 0.7771 1.0812 0.9037 0.1503 -0.1079 -0.1937 38 ASP C C 3185 O O . ASP C 38 ? 0.8196 1.0983 0.9358 0.1928 -0.1188 -0.2074 38 ASP C O 3186 C CB . ASP C 38 ? 0.9196 1.0214 0.8820 0.1214 -0.1328 -0.1172 38 ASP C CB 3187 N N . THR C 39 ? 0.7233 1.1416 0.9103 0.1429 -0.1032 -0.2197 39 THR C N 3188 C CA . THR C 39 ? 0.7000 1.2457 0.9596 0.1720 -0.1062 -0.2668 39 THR C CA 3189 C C . THR C 39 ? 0.7840 1.3268 1.0152 0.2586 -0.1468 -0.2815 39 THR C C 3190 O O . THR C 39 ? 0.8585 1.3685 1.0342 0.3036 -0.1877 -0.2714 39 THR C O 3191 C CB . THR C 39 ? 0.6591 1.3187 0.9707 0.1470 -0.1066 -0.2923 39 THR C CB 3192 O OG1 . THR C 39 ? 0.7071 1.3240 0.9595 0.1610 -0.1348 -0.2703 39 THR C OG1 3193 C CG2 . THR C 39 ? 0.5965 1.2658 0.9419 0.0712 -0.0658 -0.2949 39 THR C CG2 3194 N N . GLY C 40 ? 0.7874 1.3559 1.0448 0.2869 -0.1368 -0.3063 40 GLY C N 3195 C CA . GLY C 40 ? 0.8804 1.4413 1.1067 0.3838 -0.1755 -0.3289 40 GLY C CA 3196 C C . GLY C 40 ? 0.9973 1.3522 1.1002 0.4149 -0.2015 -0.2914 40 GLY C C 3197 O O . GLY C 40 ? 1.1238 1.4066 1.1509 0.4969 -0.2513 -0.2929 40 GLY C O 3198 N N . LYS C 41 ? 0.9718 1.2263 1.0465 0.3492 -0.1719 -0.2594 41 LYS C N 3199 C CA . LYS C 41 ? 1.0863 1.1424 1.0420 0.3524 -0.1931 -0.2225 41 LYS C CA 3200 C C . LYS C 41 ? 1.0500 1.0554 1.0087 0.3006 -0.1600 -0.2156 41 LYS C C 3201 O O . LYS C 41 ? 0.9375 1.0504 0.9814 0.2641 -0.1202 -0.2344 41 LYS C O 3202 C CB . LYS C 41 ? 1.1346 1.0944 1.0148 0.3093 -0.2067 -0.1721 41 LYS C CB 3203 N N . GLY C 42 ? 1.1620 0.9935 1.0154 0.2942 -0.1800 -0.1883 42 GLY C N 3204 C CA . GLY C 42 ? 1.1524 0.9238 0.9940 0.2491 -0.1590 -0.1836 42 GLY C CA 3205 C C . GLY C 42 ? 1.0450 0.8577 0.9330 0.1570 -0.1243 -0.1572 42 GLY C C 3206 O O . GLY C 42 ? 0.9696 0.8658 0.9061 0.1297 -0.1109 -0.1472 42 GLY C O 3207 N N . LEU C 43 ? 1.0495 0.8057 0.9188 0.1157 -0.1135 -0.1505 43 LEU C N 3208 C CA . LEU C 43 ? 0.9608 0.7631 0.8729 0.0416 -0.0868 -0.1316 43 LEU C CA 3209 C C . LEU C 43 ? 1.0391 0.7430 0.8812 -0.0159 -0.1013 -0.0950 43 LEU C C 3210 O O . LEU C 43 ? 1.1667 0.7358 0.9194 -0.0165 -0.1270 -0.0880 43 LEU C O 3211 C CB . LEU C 43 ? 0.9098 0.7428 0.8559 0.0313 -0.0651 -0.1517 43 LEU C CB 3212 C CG . LEU C 43 ? 0.8286 0.7723 0.8440 0.0568 -0.0373 -0.1836 43 LEU C CG 3213 C CD1 . LEU C 43 ? 0.8837 0.8304 0.8851 0.1250 -0.0459 -0.2175 43 LEU C CD1 3214 C CD2 . LEU C 43 ? 0.7850 0.7413 0.8142 0.0219 -0.0150 -0.1860 43 LEU C CD2 3215 N N . VAL C 44 ? 0.9757 0.7491 0.8540 -0.0669 -0.0843 -0.0750 44 VAL C N 3216 C CA . VAL C 44 ? 1.0413 0.7648 0.8681 -0.1357 -0.0891 -0.0427 44 VAL C CA 3217 C C . VAL C 44 ? 0.9591 0.7723 0.8483 -0.1869 -0.0681 -0.0455 44 VAL C C 3218 O O . VAL C 44 ? 0.8489 0.7782 0.8153 -0.1788 -0.0465 -0.0570 44 VAL C O 3219 C CB . VAL C 44 ? 1.0689 0.8049 0.8678 -0.1500 -0.0892 -0.0172 44 VAL C CB 3220 N N . SER C 45 ? 1.0292 0.7817 0.8770 -0.2362 -0.0795 -0.0380 45 SER C N 3221 C CA . SER C 45 ? 0.9690 0.8110 0.8727 -0.2775 -0.0690 -0.0459 45 SER C CA 3222 C C . SER C 45 ? 0.9324 0.8894 0.8750 -0.3278 -0.0516 -0.0320 45 SER C C 3223 O O . SER C 45 ? 1.0192 0.9456 0.9096 -0.3913 -0.0543 -0.0079 45 SER C O 3224 C CB . SER C 45 ? 1.0673 0.8167 0.9133 -0.3186 -0.0914 -0.0475 45 SER C CB 3225 O OG . SER C 45 ? 1.0178 0.8694 0.9198 -0.3568 -0.0877 -0.0580 45 SER C OG 3226 N N . LEU C 46 ? 0.8199 0.9041 0.8446 -0.2995 -0.0333 -0.0488 46 LEU C N 3227 C CA . LEU C 46 ? 0.7790 0.9957 0.8495 -0.3284 -0.0153 -0.0468 46 LEU C CA 3228 C C . LEU C 46 ? 0.7849 1.0852 0.8861 -0.3790 -0.0192 -0.0545 46 LEU C C 3229 O O . LEU C 46 ? 0.8359 1.1880 0.9263 -0.4484 -0.0119 -0.0408 46 LEU C O 3230 C CB . LEU C 46 ? 0.6813 0.9830 0.8128 -0.2692 -0.0006 -0.0676 46 LEU C CB 3231 C CG . LEU C 46 ? 0.6611 0.9142 0.7800 -0.2226 0.0027 -0.0687 46 LEU C CG 3232 C CD1 . LEU C 46 ? 0.5819 0.9143 0.7505 -0.1831 0.0156 -0.0910 46 LEU C CD1 3233 C CD2 . LEU C 46 ? 0.7256 0.9395 0.7899 -0.2437 0.0019 -0.0441 46 LEU C CD2 3234 N N . THR C 47 ? 0.7444 1.0639 0.8797 -0.3481 -0.0311 -0.0771 47 THR C N 3235 C CA . THR C 47 ? 0.7522 1.1635 0.9219 -0.3854 -0.0434 -0.0912 47 THR C CA 3236 C C . THR C 47 ? 0.7514 1.1092 0.9133 -0.3541 -0.0669 -0.1088 47 THR C C 3237 O O . THR C 47 ? 0.7334 1.0058 0.8736 -0.2992 -0.0661 -0.1121 47 THR C O 3238 C CB . THR C 47 ? 0.6909 1.2934 0.9399 -0.3733 -0.0299 -0.1100 47 THR C CB 3239 O OG1 . THR C 47 ? 0.7017 1.4186 0.9917 -0.4091 -0.0459 -0.1284 47 THR C OG1 3240 C CG2 . THR C 47 ? 0.6206 1.2379 0.8986 -0.2816 -0.0271 -0.1293 47 THR C CG2 3241 N N . VAL C 48 ? 0.7801 1.1970 0.9565 -0.3950 -0.0870 -0.1212 48 VAL C N 3242 C CA . VAL C 48 ? 0.7943 1.1690 0.9544 -0.3699 -0.1136 -0.1391 48 VAL C CA 3243 C C . VAL C 48 ? 0.7629 1.2985 0.9885 -0.3569 -0.1315 -0.1651 48 VAL C C 3244 O O . VAL C 48 ? 0.7579 1.4414 1.0381 -0.4017 -0.1283 -0.1720 48 VAL C O 3245 C CB . VAL C 48 ? 0.8970 1.1577 0.9881 -0.4313 -0.1354 -0.1352 48 VAL C CB 3246 C CG1 . VAL C 48 ? 0.9182 1.0711 0.9607 -0.3824 -0.1522 -0.1486 48 VAL C CG1 3247 C CG2 . VAL C 48 ? 0.9667 1.1064 0.9930 -0.4722 -0.1245 -0.1086 48 VAL C CG2 3248 N N . LEU C 49 ? 0.7553 1.2674 0.9699 -0.2944 -0.1511 -0.1807 49 LEU C N 3249 C CA . LEU C 49 ? 0.7452 1.3948 1.0075 -0.2621 -0.1791 -0.2082 49 LEU C CA 3250 C C . LEU C 49 ? 0.8015 1.3913 1.0166 -0.2513 -0.2161 -0.2212 49 LEU C C 3251 O O . LEU C 49 ? 0.8199 1.2833 0.9721 -0.2019 -0.2168 -0.2154 49 LEU C O 3252 C CB . LEU C 49 ? 0.7002 1.3885 0.9836 -0.1735 -0.1727 -0.2167 49 LEU C CB 3253 C CG . LEU C 49 ? 0.6498 1.3837 0.9675 -0.1649 -0.1380 -0.2092 49 LEU C CG 3254 C CD1 . LEU C 49 ? 0.6343 1.2117 0.8985 -0.1402 -0.1140 -0.1884 49 LEU C CD1 3255 C CD2 . LEU C 49 ? 0.6328 1.5037 0.9997 -0.0955 -0.1486 -0.2376 49 LEU C CD2 3256 N N . VAL C 50 ? 0.8368 1.5265 1.0796 -0.3026 -0.2461 -0.2403 50 VAL C N 3257 C CA . VAL C 50 ? 0.9043 1.5389 1.0958 -0.3042 -0.2859 -0.2555 50 VAL C CA 3258 C C . VAL C 50 ? 0.9092 1.6699 1.1315 -0.2402 -0.3286 -0.2854 50 VAL C C 3259 O O . VAL C 50 ? 0.9596 1.6327 1.1137 -0.1925 -0.3562 -0.2907 50 VAL C O 3260 C CB . VAL C 50 ? 0.9765 1.5975 1.1513 -0.4123 -0.3003 -0.2597 50 VAL C CB 3261 C CG1 . VAL C 50 ? 1.0602 1.5800 1.1583 -0.4101 -0.3388 -0.2755 50 VAL C CG1 3262 C CG2 . VAL C 50 ? 0.9961 1.4858 1.1278 -0.4669 -0.2652 -0.2300 50 VAL C CG2 3263 N N . ASP C 51 ? 0.8683 1.8356 1.1858 -0.2335 -0.3350 -0.3064 51 ASP C N 3264 C CA . ASP C 51 ? 0.8854 2.0034 1.2414 -0.1663 -0.3842 -0.3428 51 ASP C CA 3265 C C . ASP C 51 ? 0.9070 1.9295 1.2005 -0.0419 -0.4000 -0.3404 51 ASP C C 3266 O O . ASP C 51 ? 0.8878 1.7684 1.1327 -0.0114 -0.3647 -0.3133 51 ASP C O 3267 C CB . ASP C 51 ? 0.8389 2.2250 1.3190 -0.1823 -0.3824 -0.3722 51 ASP C CB 3268 C CG . ASP C 51 ? 0.8577 2.3736 1.3924 -0.3117 -0.3861 -0.3852 51 ASP C CG 3269 N N . GLN C 52 ? 0.9628 2.0610 1.2499 0.0252 -0.4569 -0.3696 52 GLN C N 3270 C CA . GLN C 52 ? 1.0273 2.0238 1.2317 0.1454 -0.4845 -0.3683 52 GLN C CA 3271 C C . GLN C 52 ? 0.9952 2.0066 1.2225 0.2126 -0.4594 -0.3667 52 GLN C C 3272 O O . GLN C 52 ? 1.0334 1.8592 1.1684 0.2609 -0.4440 -0.3418 52 GLN C O 3273 C CB . GLN C 52 ? 1.1008 2.2193 1.3082 0.2110 -0.5591 -0.4071 52 GLN C CB 3274 C CG . GLN C 52 ? 1.2190 2.1653 1.2877 0.3202 -0.5999 -0.3978 52 GLN C CG 3275 C CD . GLN C 52 ? 1.2832 2.0130 1.2249 0.2811 -0.5945 -0.3672 52 GLN C CD 3276 O OE1 . GLN C 52 ? 1.2529 1.9843 1.2132 0.1867 -0.5798 -0.3653 52 GLN C OE1 3277 N NE2 . GLN C 52 ? 1.3882 1.9237 1.1886 0.3531 -0.6063 -0.3446 52 GLN C NE2 3278 N N . LYS C 53 ? 0.9370 2.1740 1.2831 0.2097 -0.4545 -0.3962 53 LYS C N 3279 C CA . LYS C 53 ? 0.9030 2.1767 1.2808 0.2612 -0.4252 -0.4006 53 LYS C CA 3280 C C . LYS C 53 ? 0.8095 2.2381 1.2944 0.1618 -0.3755 -0.4006 53 LYS C C 3281 O O . LYS C 53 ? 0.7849 2.4575 1.3731 0.1321 -0.3857 -0.4345 53 LYS C O 3282 C CB . LYS C 53 ? 0.9592 2.3671 1.3582 0.3906 -0.4759 -0.4464 53 LYS C CB 3283 C CG . LYS C 53 ? 1.0878 2.2971 1.3472 0.5011 -0.5254 -0.4400 53 LYS C CG 3284 N N . ASP C 54 ? 0.7702 2.0606 1.2247 0.1074 -0.3227 -0.3629 54 ASP C N 3285 C CA . ASP C 54 ? 0.7107 2.0897 1.2300 0.0000 -0.2772 -0.3510 54 ASP C CA 3286 C C . ASP C 54 ? 0.6664 2.0708 1.2089 0.0180 -0.2334 -0.3462 54 ASP C C 3287 O O . ASP C 54 ? 0.6778 1.9536 1.1642 0.0925 -0.2288 -0.3394 54 ASP C O 3288 C CB . ASP C 54 ? 0.7203 1.9232 1.1790 -0.0932 -0.2590 -0.3124 54 ASP C CB 3289 C CG . ASP C 54 ? 0.7207 2.0267 1.2277 -0.2174 -0.2460 -0.3101 54 ASP C CG 3290 O OD1 . ASP C 54 ? 0.7083 2.2440 1.3046 -0.2448 -0.2482 -0.3383 54 ASP C OD1 3291 O OD2 . ASP C 54 ? 0.7467 1.9010 1.1951 -0.2894 -0.2342 -0.2818 54 ASP C OD2 3292 N N . LYS C 55 ? 0.6317 2.2011 1.2483 -0.0578 -0.2021 -0.3507 55 LYS C N 3293 C CA . LYS C 55 ? 0.5984 2.2110 1.2353 -0.0578 -0.1572 -0.3461 55 LYS C CA 3294 C C . LYS C 55 ? 0.5907 2.2228 1.2378 -0.1903 -0.1175 -0.3164 55 LYS C C 3295 O O . LYS C 55 ? 0.6116 2.3593 1.2979 -0.2771 -0.1231 -0.3221 55 LYS C O 3296 C CB . LYS C 55 ? 0.5905 2.4448 1.3075 0.0153 -0.1628 -0.3970 55 LYS C CB 3297 N N . THR C 56 ? 0.5809 2.0916 1.1825 -0.2077 -0.0812 -0.2851 56 THR C N 3298 C CA . THR C 56 ? 0.6044 2.0738 1.1803 -0.3234 -0.0494 -0.2489 56 THR C CA 3299 C C . THR C 56 ? 0.5896 2.0322 1.1433 -0.3176 -0.0097 -0.2320 56 THR C C 3300 O O . THR C 56 ? 0.5630 1.9476 1.1023 -0.2288 -0.0091 -0.2410 56 THR C O 3301 C CB . THR C 56 ? 0.6438 1.8890 1.1402 -0.3674 -0.0642 -0.2152 56 THR C CB 3302 O OG1 . THR C 56 ? 0.6998 1.8825 1.1516 -0.4710 -0.0408 -0.1809 56 THR C OG1 3303 C CG2 . THR C 56 ? 0.6234 1.6785 1.0622 -0.2876 -0.0672 -0.2025 56 THR C CG2 3304 N N . SER C 57 ? 0.6266 2.0998 1.1647 -0.4173 0.0207 -0.2071 57 SER C N 3305 C CA . SER C 57 ? 0.6300 2.0889 1.1375 -0.4212 0.0572 -0.1897 57 SER C CA 3306 C C . SER C 57 ? 0.7054 2.0173 1.1266 -0.5199 0.0717 -0.1394 57 SER C C 3307 O O . SER C 57 ? 0.7722 2.0777 1.1730 -0.6176 0.0674 -0.1235 57 SER C O 3308 C CB . SER C 57 ? 0.6193 2.3350 1.1965 -0.4244 0.0862 -0.2215 57 SER C CB 3309 O OG . SER C 57 ? 0.6403 2.3451 1.1753 -0.4420 0.1234 -0.2027 57 SER C OG 3310 N N . ASN C 58 ? 0.7119 1.8983 1.0739 -0.4918 0.0841 -0.1165 58 ASN C N 3311 C CA . ASN C 58 ? 0.8034 1.8344 1.0667 -0.5625 0.0918 -0.0694 58 ASN C CA 3312 C C . ASN C 58 ? 0.8025 1.7966 1.0247 -0.5262 0.1115 -0.0570 58 ASN C C 3313 O O . ASN C 58 ? 0.7580 1.6529 0.9706 -0.4477 0.0985 -0.0620 58 ASN C O 3314 C CB . ASN C 58 ? 0.8377 1.6545 1.0418 -0.5564 0.0590 -0.0507 58 ASN C CB 3315 C CG . ASN C 58 ? 0.9667 1.6079 1.0542 -0.6214 0.0569 -0.0054 58 ASN C CG 3316 O OD1 . ASN C 58 ? 1.0591 1.7311 1.1001 -0.7071 0.0774 0.0184 58 ASN C OD1 3317 N ND2 . ASN C 58 ? 0.9932 1.4472 1.0240 -0.5790 0.0314 0.0052 58 ASN C ND2 3318 N N . GLY C 59 ? 0.8624 1.9414 1.0557 -0.5907 0.1434 -0.0416 59 GLY C N 3319 C CA . GLY C 59 ? 0.8722 1.9419 1.0233 -0.5590 0.1628 -0.0338 59 GLY C CA 3320 C C . GLY C 59 ? 0.7759 1.9924 1.0089 -0.4660 0.1723 -0.0833 59 GLY C C 3321 O O . GLY C 59 ? 0.7487 2.1644 1.0543 -0.4671 0.1896 -0.1166 59 GLY C O 3322 N N . ARG C 60 ? 0.7378 1.8562 0.9554 -0.3845 0.1582 -0.0920 60 ARG C N 3323 C CA . ARG C 60 ? 0.6734 1.8770 0.9453 -0.2915 0.1585 -0.1398 60 ARG C CA 3324 C C . ARG C 60 ? 0.6166 1.7650 0.9334 -0.2304 0.1271 -0.1622 60 ARG C C 3325 O O . ARG C 60 ? 0.5861 1.7949 0.9414 -0.1552 0.1201 -0.2030 60 ARG C O 3326 C CB . ARG C 60 ? 0.6843 1.8135 0.9046 -0.2486 0.1603 -0.1401 60 ARG C CB 3327 C CG . ARG C 60 ? 0.7601 1.9264 0.9147 -0.3037 0.1886 -0.1150 60 ARG C CG 3328 C CD . ARG C 60 ? 0.7844 1.8678 0.8822 -0.2589 0.1816 -0.1164 60 ARG C CD 3329 N NE . ARG C 60 ? 0.7655 1.6829 0.8486 -0.2274 0.1465 -0.1061 60 ARG C NE 3330 C CZ . ARG C 60 ? 0.8112 1.5992 0.8399 -0.2621 0.1290 -0.0655 60 ARG C CZ 3331 N NH1 . ARG C 60 ? 0.9002 1.6688 0.8661 -0.3360 0.1397 -0.0250 60 ARG C NH1 3332 N NH2 . ARG C 60 ? 0.7833 1.4586 0.8136 -0.2231 0.1002 -0.0675 60 ARG C NH2 3333 N N . TYR C 61 ? 0.6226 1.6446 0.9192 -0.2614 0.1069 -0.1356 62 TYR C N 3334 C CA . TYR C 61 ? 0.5857 1.5425 0.9075 -0.2174 0.0794 -0.1498 62 TYR C CA 3335 C C . TYR C 61 ? 0.5747 1.6632 0.9566 -0.2212 0.0715 -0.1728 62 TYR C C 3336 O O . TYR C 61 ? 0.6020 1.7779 0.9981 -0.2954 0.0809 -0.1624 62 TYR C O 3337 C CB . TYR C 61 ? 0.6067 1.3987 0.8823 -0.2476 0.0630 -0.1183 62 TYR C CB 3338 C CG . TYR C 61 ? 0.6303 1.3085 0.8496 -0.2441 0.0646 -0.0969 62 TYR C CG 3339 C CD1 . TYR C 61 ? 0.7029 1.3299 0.8611 -0.3013 0.0692 -0.0623 62 TYR C CD1 3340 C CD2 . TYR C 61 ? 0.5973 1.2146 0.8162 -0.1854 0.0577 -0.1120 62 TYR C CD2 3341 C CE1 . TYR C 61 ? 0.7331 1.2596 0.8356 -0.2844 0.0622 -0.0458 62 TYR C CE1 3342 C CE2 . TYR C 61 ? 0.6102 1.1499 0.7884 -0.1792 0.0545 -0.0989 62 TYR C CE2 3343 C CZ . TYR C 61 ? 0.6771 1.1756 0.7995 -0.2210 0.0544 -0.0671 62 TYR C CZ 3344 O OH . TYR C 61 ? 0.7060 1.1326 0.7850 -0.2016 0.0435 -0.0575 62 TYR C OH 3345 N N . SER C 62 ? 0.5487 1.6464 0.9576 -0.1435 0.0511 -0.2047 63 SER C N 3346 C CA . SER C 62 ? 0.5429 1.7593 1.0050 -0.1255 0.0322 -0.2318 63 SER C CA 3347 C C . SER C 62 ? 0.5440 1.6410 0.9839 -0.0578 -0.0009 -0.2417 63 SER C C 3348 O O . SER C 62 ? 0.5532 1.5828 0.9656 0.0138 -0.0075 -0.2576 63 SER C O 3349 C CB . SER C 62 ? 0.5411 1.9595 1.0572 -0.0798 0.0432 -0.2738 63 SER C CB 3350 O OG . SER C 62 ? 0.5519 1.9135 1.0421 0.0152 0.0360 -0.2990 63 SER C OG 3351 N N . ALA C 63 ? 0.5522 1.6128 0.9909 -0.0864 -0.0220 -0.2321 64 ALA C N 3352 C CA . ALA C 63 ? 0.5696 1.4986 0.9680 -0.0365 -0.0503 -0.2338 64 ALA C CA 3353 C C . ALA C 63 ? 0.5905 1.6086 1.0160 0.0043 -0.0857 -0.2617 64 ALA C C 3354 O O . ALA C 63 ? 0.5829 1.7595 1.0667 -0.0340 -0.0903 -0.2744 64 ALA C O 3355 C CB . ALA C 63 ? 0.5763 1.3547 0.9285 -0.0891 -0.0486 -0.2010 64 ALA C CB 3356 N N . THR C 64 ? 0.6302 1.5443 1.0059 0.0787 -0.1122 -0.2711 65 THR C N 3357 C CA . THR C 64 ? 0.6746 1.6407 1.0527 0.1353 -0.1556 -0.2963 65 THR C CA 3358 C C . THR C 64 ? 0.7223 1.5102 1.0196 0.1415 -0.1773 -0.2769 65 THR C C 3359 O O . THR C 64 ? 0.7283 1.3558 0.9671 0.1215 -0.1569 -0.2509 65 THR C O 3360 C CB . THR C 64 ? 0.7229 1.7355 1.0940 0.2452 -0.1772 -0.3335 65 THR C CB 3361 O OG1 . THR C 64 ? 0.7698 1.5923 1.0559 0.2813 -0.1695 -0.3215 65 THR C OG1 3362 C CG2 . THR C 64 ? 0.6830 1.9136 1.1403 0.2495 -0.1568 -0.3634 65 THR C CG2 3363 N N . LEU C 65 ? 0.7622 1.5938 1.0568 0.1687 -0.2184 -0.2926 66 LEU C N 3364 C CA . LEU C 65 ? 0.8222 1.4982 1.0303 0.1775 -0.2418 -0.2770 66 LEU C CA 3365 C C . LEU C 65 ? 0.8998 1.6200 1.0846 0.2581 -0.2989 -0.3040 66 LEU C C 3366 O O . LEU C 65 ? 0.8827 1.7993 1.1483 0.2693 -0.3234 -0.3353 66 LEU C O 3367 C CB . LEU C 65 ? 0.7924 1.4470 1.0079 0.0863 -0.2304 -0.2577 66 LEU C CB 3368 C CG . LEU C 65 ? 0.8582 1.4047 0.9993 0.0843 -0.2571 -0.2506 66 LEU C CG 3369 C CD1 . LEU C 65 ? 0.9108 1.2578 0.9474 0.1087 -0.2420 -0.2276 66 LEU C CD1 3370 C CD2 . LEU C 65 ? 0.8390 1.3945 0.9987 -0.0037 -0.2498 -0.2429 66 LEU C CD2 3371 N N . ASP C 66 ? 0.9972 1.5383 1.0662 0.3124 -0.3207 -0.2923 67 ASP C N 3372 C CA . ASP C 66 ? 1.1007 1.6368 1.1133 0.3926 -0.3820 -0.3109 67 ASP C CA 3373 C C . ASP C 66 ? 1.1866 1.5224 1.0728 0.3783 -0.3906 -0.2811 67 ASP C C 3374 O O . ASP C 66 ? 1.2649 1.4074 1.0408 0.3936 -0.3768 -0.2570 67 ASP C O 3375 C CB . ASP C 66 ? 1.1914 1.7043 1.1588 0.5083 -0.4128 -0.3340 67 ASP C CB 3376 C CG . ASP C 66 ? 1.3242 1.8190 1.2175 0.6075 -0.4853 -0.3539 67 ASP C CG 3377 N N . LYS C 67 ? 1.1822 1.5676 1.0794 0.3425 -0.4121 -0.2846 68 LYS C N 3378 C CA . LYS C 67 ? 1.2646 1.4800 1.0424 0.3248 -0.4176 -0.2604 68 LYS C CA 3379 C C . LYS C 67 ? 1.4282 1.5224 1.0710 0.4183 -0.4705 -0.2598 68 LYS C C 3380 O O . LYS C 67 ? 1.5273 1.4420 1.0388 0.4092 -0.4665 -0.2328 68 LYS C O 3381 C CB . LYS C 67 ? 1.2272 1.5214 1.0465 0.2589 -0.4276 -0.2689 68 LYS C CB 3382 C CG . LYS C 67 ? 1.1202 1.4254 1.0033 0.1615 -0.3730 -0.2556 68 LYS C CG 3383 C CD . LYS C 67 ? 1.1092 1.4681 1.0152 0.0973 -0.3898 -0.2676 68 LYS C CD 3384 C CE . LYS C 67 ? 1.0285 1.3813 0.9836 0.0107 -0.3431 -0.2556 68 LYS C CE 3385 N NZ . LYS C 67 ? 1.0478 1.4320 1.0118 -0.0566 -0.3633 -0.2695 68 LYS C NZ 3386 N N . ASP C 68 ? 1.4707 1.6622 1.1376 0.5110 -0.5200 -0.2905 69 ASP C N 3387 C CA . ASP C 68 ? 1.6533 1.7112 1.1769 0.6200 -0.5786 -0.2915 69 ASP C CA 3388 C C . ASP C 68 ? 1.7523 1.5753 1.1480 0.6370 -0.5511 -0.2608 69 ASP C C 3389 O O . ASP C 68 ? 1.9376 1.5950 1.1824 0.7216 -0.5956 -0.2546 69 ASP C O 3390 C CB . ASP C 68 ? 1.6735 1.9217 1.2691 0.7267 -0.6413 -0.3417 69 ASP C CB 3391 N N . ALA C 69 ? 1.6425 1.4471 1.0916 0.5539 -0.4815 -0.2427 70 ALA C N 3392 C CA . ALA C 69 ? 1.7192 1.3190 1.0632 0.5394 -0.4464 -0.2148 70 ALA C CA 3393 C C . ALA C 69 ? 1.6167 1.1826 0.9906 0.4218 -0.3733 -0.1865 70 ALA C C 3394 O O . ALA C 69 ? 1.6688 1.0860 0.9672 0.3862 -0.3366 -0.1636 70 ALA C O 3395 C CB . ALA C 69 ? 1.7076 1.3499 1.0969 0.5955 -0.4486 -0.2393 70 ALA C CB 3396 N N . LYS C 70 ? 1.4854 1.1897 0.9645 0.3635 -0.3564 -0.1918 71 LYS C N 3397 C CA . LYS C 70 ? 1.3893 1.0855 0.9073 0.2683 -0.2953 -0.1736 71 LYS C CA 3398 C C . LYS C 70 ? 1.3133 1.0148 0.8875 0.2381 -0.2491 -0.1699 71 LYS C C 3399 O O . LYS C 70 ? 1.3289 0.9284 0.8562 0.1895 -0.2064 -0.1501 71 LYS C O 3400 C CB . LYS C 70 ? 1.4969 1.0287 0.8798 0.2362 -0.2786 -0.1467 71 LYS C CB 3401 N N . HIS C 71 ? 1.2340 1.0717 0.9112 0.2651 -0.2577 -0.1925 72 HIS C N 3402 C CA . HIS C 71 ? 1.1887 1.0295 0.9036 0.2569 -0.2265 -0.1948 72 HIS C CA 3403 C C . HIS C 71 ? 1.0418 1.0687 0.9005 0.2292 -0.2082 -0.2100 72 HIS C C 3404 O O . HIS C 71 ? 0.9993 1.1724 0.9297 0.2423 -0.2321 -0.2286 72 HIS C O 3405 C CB . HIS C 71 ? 1.3100 1.0725 0.9492 0.3410 -0.2604 -0.2085 72 HIS C CB 3406 C CG . HIS C 71 ? 1.2896 1.0429 0.9518 0.3389 -0.2347 -0.2166 72 HIS C CG 3407 N ND1 . HIS C 71 ? 1.2884 0.9412 0.9197 0.2732 -0.1914 -0.1972 72 HIS C ND1 3408 C CD2 . HIS C 71 ? 1.2774 1.1193 0.9893 0.3954 -0.2472 -0.2465 72 HIS C CD2 3409 C CE1 . HIS C 71 ? 1.2749 0.9439 0.9320 0.2868 -0.1818 -0.2134 72 HIS C CE1 3410 N NE2 . HIS C 71 ? 1.2697 1.0475 0.9715 0.3624 -0.2136 -0.2431 72 HIS C NE2 3411 N N . SER C 72 ? 0.9777 0.9997 0.8713 0.1859 -0.1664 -0.2020 73 SER C N 3412 C CA . SER C 72 ? 0.8644 1.0340 0.8690 0.1543 -0.1457 -0.2099 73 SER C CA 3413 C C . SER C 72 ? 0.8528 1.0232 0.8694 0.1691 -0.1269 -0.2184 73 SER C C 3414 O O . SER C 72 ? 0.9262 0.9660 0.8667 0.1846 -0.1236 -0.2153 73 SER C O 3415 C CB . SER C 72 ? 0.7970 0.9687 0.8326 0.0798 -0.1168 -0.1909 73 SER C CB 3416 O OG . SER C 72 ? 0.7172 1.0005 0.8338 0.0465 -0.0991 -0.1927 73 SER C OG 3417 N N . THR C 73 ? 0.7764 1.0897 0.8789 0.1577 -0.1146 -0.2296 74 THR C N 3418 C CA . THR C 73 ? 0.7641 1.0981 0.8811 0.1709 -0.0967 -0.2413 74 THR C CA 3419 C C . THR C 73 ? 0.6726 1.1393 0.8712 0.1205 -0.0703 -0.2369 74 THR C C 3420 O O . THR C 73 ? 0.6405 1.2369 0.8959 0.1034 -0.0750 -0.2415 74 THR C O 3421 C CB . THR C 73 ? 0.8334 1.1969 0.9306 0.2595 -0.1245 -0.2754 74 THR C CB 3422 O OG1 . THR C 73 ? 0.9546 1.1616 0.9489 0.3077 -0.1549 -0.2748 74 THR C OG1 3423 C CG2 . THR C 73 ? 0.8393 1.2001 0.9330 0.2749 -0.1069 -0.2911 74 THR C CG2 3424 N N . LEU C 74 ? 0.6479 1.0783 0.8437 0.0920 -0.0443 -0.2277 75 LEU C N 3425 C CA . LEU C 74 ? 0.5896 1.1148 0.8356 0.0468 -0.0215 -0.2187 75 LEU C CA 3426 C C . LEU C 74 ? 0.5976 1.1762 0.8494 0.0764 -0.0108 -0.2393 75 LEU C C 3427 O O . LEU C 74 ? 0.6273 1.1164 0.8384 0.0933 -0.0083 -0.2459 75 LEU C O 3428 C CB . LEU C 74 ? 0.5651 1.0113 0.7976 -0.0050 -0.0054 -0.1920 75 LEU C CB 3429 C CG . LEU C 74 ? 0.5315 1.0372 0.7883 -0.0508 0.0113 -0.1758 75 LEU C CG 3430 C CD1 . LEU C 74 ? 0.5295 1.1133 0.8125 -0.0901 0.0072 -0.1667 75 LEU C CD1 3431 C CD2 . LEU C 74 ? 0.5220 0.9411 0.7556 -0.0763 0.0186 -0.1573 75 LEU C CD2 3432 N N . HIS C 75 ? 0.5812 1.3119 0.8806 0.0767 -0.0033 -0.2520 76 HIS C N 3433 C CA . HIS C 75 ? 0.5922 1.3952 0.8960 0.1032 0.0112 -0.2742 76 HIS C CA 3434 C C . HIS C 75 ? 0.5605 1.4194 0.8786 0.0375 0.0396 -0.2507 76 HIS C C 3435 O O . HIS C 75 ? 0.5433 1.4753 0.8894 -0.0191 0.0486 -0.2311 76 HIS C O 3436 C CB . HIS C 75 ? 0.6128 1.5696 0.9542 0.1604 0.0029 -0.3128 76 HIS C CB 3437 C CG . HIS C 75 ? 0.6749 1.5753 0.9894 0.2376 -0.0339 -0.3366 76 HIS C CG 3438 N ND1 . HIS C 75 ? 0.7602 1.5609 1.0108 0.3162 -0.0526 -0.3645 76 HIS C ND1 3439 C CD2 . HIS C 75 ? 0.6887 1.6050 1.0165 0.2500 -0.0602 -0.3365 76 HIS C CD2 3440 C CE1 . HIS C 75 ? 0.8264 1.5725 1.0439 0.3766 -0.0894 -0.3772 76 HIS C CE1 3441 N NE2 . HIS C 75 ? 0.7792 1.6028 1.0467 0.3399 -0.0949 -0.3612 76 HIS C NE2 3442 N N . ILE C 76 ? 0.5721 1.3838 0.8583 0.0421 0.0501 -0.2523 77 ILE C N 3443 C CA . ILE C 76 ? 0.5681 1.4379 0.8497 -0.0033 0.0736 -0.2352 77 ILE C CA 3444 C C . ILE C 76 ? 0.5970 1.5569 0.8720 0.0397 0.0862 -0.2701 77 ILE C C 3445 O O . ILE C 76 ? 0.6263 1.5129 0.8667 0.0852 0.0764 -0.2938 77 ILE C O 3446 C CB . ILE C 76 ? 0.5648 1.3157 0.8087 -0.0339 0.0717 -0.2081 77 ILE C CB 3447 C CG1 . ILE C 76 ? 0.5456 1.1938 0.7896 -0.0509 0.0569 -0.1884 77 ILE C CG1 3448 C CG2 . ILE C 76 ? 0.5834 1.3735 0.8060 -0.0864 0.0883 -0.1793 77 ILE C CG2 3449 N N . THR C 77 ? 0.6005 1.7217 0.9043 0.0210 0.1087 -0.2760 78 THR C N 3450 C CA . THR C 77 ? 0.6339 1.8674 0.9315 0.0636 0.1262 -0.3136 78 THR C CA 3451 C C . THR C 77 ? 0.6571 1.8789 0.9055 0.0191 0.1478 -0.2912 78 THR C C 3452 O O . THR C 77 ? 0.6607 1.8764 0.8948 -0.0572 0.1605 -0.2469 78 THR C O 3453 C CB . THR C 77 ? 0.6332 2.0855 0.9909 0.0688 0.1449 -0.3397 78 THR C CB 3454 O OG1 . THR C 77 ? 0.6138 2.0828 1.0187 0.0942 0.1195 -0.3505 78 THR C OG1 3455 C CG2 . THR C 77 ? 0.6747 2.2354 1.0272 0.1496 0.1547 -0.3962 78 THR C CG2 3456 N N . ALA C 78 ? 0.6932 1.8977 0.9023 0.0697 0.1474 -0.3229 79 ALA C N 3457 C CA . ALA C 78 ? 0.7284 1.9221 0.8797 0.0420 0.1620 -0.3096 79 ALA C CA 3458 C C . ALA C 78 ? 0.7177 1.7718 0.8369 -0.0091 0.1464 -0.2616 79 ALA C C 3459 O O . ALA C 78 ? 0.7343 1.7940 0.8309 -0.0728 0.1584 -0.2181 79 ALA C O 3460 C CB . ALA C 78 ? 0.7575 2.1218 0.9057 0.0007 0.2027 -0.3034 79 ALA C CB 3461 N N . THR C 79 ? 0.7062 1.6342 0.8167 0.0198 0.1183 -0.2724 80 THR C N 3462 C CA . THR C 79 ? 0.6897 1.5050 0.7872 -0.0132 0.0998 -0.2385 80 THR C CA 3463 C C . THR C 79 ? 0.7314 1.5317 0.7711 -0.0326 0.0980 -0.2214 80 THR C C 3464 O O . THR C 79 ? 0.7700 1.5946 0.7754 -0.0070 0.0989 -0.2491 80 THR C O 3465 C CB . THR C 79 ? 0.6756 1.3865 0.7832 0.0148 0.0753 -0.2602 80 THR C CB 3466 O OG1 . THR C 79 ? 0.6782 1.3920 0.8077 0.0534 0.0729 -0.2880 80 THR C OG1 3467 C CG2 . THR C 79 ? 0.6447 1.2789 0.7680 -0.0165 0.0626 -0.2283 80 THR C CG2 3468 N N . LEU C 80 ? 0.7411 1.4912 0.7591 -0.0724 0.0910 -0.1773 81 LEU C N 3469 C CA . LEU C 80 ? 0.7985 1.5102 0.7494 -0.0813 0.0780 -0.1574 81 LEU C CA 3470 C C . LEU C 80 ? 0.7758 1.4108 0.7407 -0.0572 0.0445 -0.1689 81 LEU C C 3471 O O . LEU C 80 ? 0.7211 1.3263 0.7411 -0.0477 0.0380 -0.1836 81 LEU C O 3472 C CB . LEU C 80 ? 0.8590 1.5393 0.7552 -0.1320 0.0831 -0.1037 81 LEU C CB 3473 C CG . LEU C 80 ? 0.9031 1.6771 0.7713 -0.1769 0.1209 -0.0891 81 LEU C CG 3474 N N . LEU C 81 ? 0.8258 1.4396 0.7386 -0.0486 0.0233 -0.1641 82 LEU C N 3475 C CA . LEU C 81 ? 0.8102 1.3844 0.7439 -0.0277 -0.0100 -0.1789 82 LEU C CA 3476 C C . LEU C 81 ? 0.7991 1.3151 0.7484 -0.0321 -0.0235 -0.1503 82 LEU C C 3477 O O . LEU C 81 ? 0.7537 1.2601 0.7570 -0.0200 -0.0362 -0.1694 82 LEU C O 3478 C CB . LEU C 81 ? 0.8778 1.4588 0.7504 -0.0101 -0.0363 -0.1840 82 LEU C CB 3479 C CG . LEU C 81 ? 0.8921 1.5172 0.7548 0.0050 -0.0410 -0.2303 82 LEU C CG 3480 C CD1 . LEU C 81 ? 0.9512 1.5780 0.7697 0.0244 -0.0811 -0.2358 82 LEU C CD1 3481 C CD2 . LEU C 81 ? 0.8308 1.4545 0.7614 0.0064 -0.0392 -0.2747 82 LEU C CD2 3482 N N . ASP C 82 ? 0.8549 1.3291 0.7482 -0.0533 -0.0194 -0.1065 83 ASP C N 3483 C CA . ASP C 82 ? 0.8763 1.2712 0.7594 -0.0527 -0.0369 -0.0800 83 ASP C CA 3484 C C . ASP C 82 ? 0.8032 1.1945 0.7533 -0.0693 -0.0187 -0.0845 83 ASP C C 3485 O O . ASP C 82 ? 0.8335 1.1563 0.7647 -0.0797 -0.0258 -0.0607 83 ASP C O 3486 C CB . ASP C 82 ? 0.9998 1.3177 0.7729 -0.0774 -0.0431 -0.0301 83 ASP C CB 3487 C CG . ASP C 82 ? 1.0936 1.4081 0.7796 -0.0621 -0.0606 -0.0214 83 ASP C CG 3488 O OD1 . ASP C 82 ? 1.0902 1.4773 0.7652 -0.0789 -0.0362 -0.0308 83 ASP C OD1 3489 O OD2 . ASP C 82 ? 1.1807 1.4204 0.8026 -0.0266 -0.1013 -0.0075 83 ASP C OD2 3490 N N . ASP C 83 ? 0.7257 1.1769 0.7397 -0.0682 0.0003 -0.1160 84 ASP C N 3491 C CA . ASP C 83 ? 0.6652 1.1105 0.7351 -0.0754 0.0121 -0.1240 84 ASP C CA 3492 C C . ASP C 83 ? 0.6212 1.0547 0.7374 -0.0549 0.0020 -0.1518 84 ASP C C 3493 O O . ASP C 83 ? 0.5878 1.0010 0.7370 -0.0594 0.0090 -0.1562 84 ASP C O 3494 C CB . ASP C 83 ? 0.6361 1.1427 0.7316 -0.0804 0.0354 -0.1409 84 ASP C CB 3495 C CG . ASP C 83 ? 0.6773 1.2308 0.7445 -0.1116 0.0536 -0.1180 84 ASP C CG 3496 O OD1 . ASP C 83 ? 0.7532 1.2823 0.7592 -0.1341 0.0503 -0.0880 84 ASP C OD1 3497 O OD2 . ASP C 83 ? 0.6574 1.2756 0.7586 -0.1145 0.0706 -0.1309 84 ASP C OD2 3498 N N . THR C 84 ? 0.6299 1.0838 0.7453 -0.0379 -0.0137 -0.1717 85 THR C N 3499 C CA . THR C 84 ? 0.5965 1.0633 0.7586 -0.0330 -0.0196 -0.2021 85 THR C CA 3500 C C . THR C 84 ? 0.5894 1.0330 0.7692 -0.0235 -0.0265 -0.1929 85 THR C C 3501 O O . THR C 84 ? 0.6247 1.0678 0.7875 0.0028 -0.0496 -0.1874 85 THR C O 3502 C CB . THR C 84 ? 0.6156 1.1301 0.7779 -0.0239 -0.0383 -0.2306 85 THR C CB 3503 O OG1 . THR C 84 ? 0.6264 1.1488 0.7701 -0.0322 -0.0292 -0.2489 85 THR C OG1 3504 C CG2 . THR C 84 ? 0.5881 1.1377 0.8041 -0.0321 -0.0432 -0.2620 85 THR C CG2 3505 N N . ALA C 85 ? 0.5562 0.9751 0.7603 -0.0381 -0.0089 -0.1933 86 ALA C N 3506 C CA . ALA C 85 ? 0.5557 0.9457 0.7683 -0.0299 -0.0100 -0.1862 86 ALA C CA 3507 C C . ALA C 85 ? 0.5250 0.9069 0.7655 -0.0503 0.0110 -0.1998 86 ALA C C 3508 O O . ALA C 85 ? 0.5180 0.9006 0.7619 -0.0685 0.0218 -0.2123 86 ALA C O 3509 C CB . ALA C 85 ? 0.5903 0.9192 0.7586 -0.0322 -0.0144 -0.1518 86 ALA C CB 3510 N N . THR C 86 ? 0.5258 0.8866 0.7713 -0.0444 0.0145 -0.1981 87 THR C N 3511 C CA . THR C 86 ? 0.5134 0.8482 0.7633 -0.0649 0.0343 -0.2028 87 THR C CA 3512 C C . THR C 86 ? 0.5215 0.7982 0.7439 -0.0654 0.0326 -0.1792 87 THR C C 3513 O O . THR C 86 ? 0.5435 0.7913 0.7464 -0.0524 0.0201 -0.1658 87 THR C O 3514 C CB . THR C 86 ? 0.5149 0.8855 0.7891 -0.0656 0.0459 -0.2249 87 THR C CB 3515 O OG1 . THR C 86 ? 0.5102 0.9510 0.8164 -0.0827 0.0501 -0.2510 87 THR C OG1 3516 C CG2 . THR C 86 ? 0.5246 0.8510 0.7805 -0.0897 0.0671 -0.2229 87 THR C CG2 3517 N N . TYR C 87 ? 0.5167 0.7713 0.7304 -0.0793 0.0407 -0.1768 88 TYR C N 3518 C CA . TYR C 87 ? 0.5242 0.7473 0.7208 -0.0819 0.0360 -0.1608 88 TYR C CA 3519 C C . TYR C 87 ? 0.5419 0.7235 0.7216 -0.0860 0.0436 -0.1655 88 TYR C C 3520 O O . TYR C 87 ? 0.5590 0.7210 0.7254 -0.0924 0.0529 -0.1747 88 TYR C O 3521 C CB . TYR C 87 ? 0.5178 0.7658 0.7158 -0.0811 0.0334 -0.1585 88 TYR C CB 3522 C CG . TYR C 87 ? 0.5143 0.8069 0.7171 -0.0827 0.0302 -0.1512 88 TYR C CG 3523 C CD1 . TYR C 87 ? 0.5128 0.8362 0.7195 -0.0739 0.0332 -0.1656 88 TYR C CD1 3524 C CD2 . TYR C 87 ? 0.5312 0.8210 0.7190 -0.0978 0.0233 -0.1294 88 TYR C CD2 3525 C CE1 . TYR C 87 ? 0.5220 0.8854 0.7208 -0.0752 0.0311 -0.1583 88 TYR C CE1 3526 C CE2 . TYR C 87 ? 0.5524 0.8701 0.7246 -0.1059 0.0222 -0.1177 88 TYR C CE2 3527 C CZ . TYR C 87 ? 0.5406 0.9013 0.7200 -0.0922 0.0271 -0.1321 88 TYR C CZ 3528 O OH . TYR C 87 ? 0.5725 0.9600 0.7247 -0.1001 0.0269 -0.1197 88 TYR C OH 3529 N N . ILE C 88 ? 0.5587 0.7122 0.7237 -0.0840 0.0380 -0.1588 89 ILE C N 3530 C CA . ILE C 88 ? 0.5837 0.6981 0.7225 -0.0860 0.0456 -0.1641 89 ILE C CA 3531 C C . ILE C 88 ? 0.6044 0.6869 0.7188 -0.0890 0.0299 -0.1538 89 ILE C C 3532 O O . ILE C 88 ? 0.6072 0.6915 0.7234 -0.0957 0.0141 -0.1443 89 ILE C O 3533 C CB . ILE C 88 ? 0.6009 0.7165 0.7375 -0.0735 0.0521 -0.1763 89 ILE C CB 3534 C CG1 . ILE C 88 ? 0.5773 0.7565 0.7507 -0.0691 0.0637 -0.1927 89 ILE C CG1 3535 C CG2 . ILE C 88 ? 0.6395 0.7240 0.7418 -0.0776 0.0660 -0.1844 89 ILE C CG2 3536 C CD1 . ILE C 88 ? 0.5983 0.8118 0.7821 -0.0416 0.0666 -0.2134 89 ILE C CD1 3537 N N . CYS C 89 ? 0.6334 0.6840 0.7172 -0.0883 0.0325 -0.1561 90 CYS C N 3538 C CA . CYS C 89 ? 0.6619 0.6923 0.7208 -0.0843 0.0125 -0.1515 90 CYS C CA 3539 C C . CYS C 89 ? 0.7042 0.6862 0.7210 -0.0870 0.0128 -0.1549 90 CYS C C 3540 O O . CYS C 89 ? 0.7345 0.6862 0.7185 -0.0882 0.0332 -0.1605 90 CYS C O 3541 C CB . CYS C 89 ? 0.6937 0.7006 0.7239 -0.0687 0.0075 -0.1528 90 CYS C CB 3542 S SG . CYS C 89 ? 0.7621 0.7442 0.7487 -0.0479 -0.0241 -0.1523 90 CYS C SG 3543 N N . VAL C 90 ? 0.7190 0.6951 0.7308 -0.0937 -0.0082 -0.1537 91 VAL C N 3544 C CA . VAL C 90 ? 0.7721 0.6940 0.7363 -0.0931 -0.0119 -0.1621 91 VAL C CA 3545 C C . VAL C 90 ? 0.8133 0.7183 0.7462 -0.0995 -0.0410 -0.1634 91 VAL C C 3546 O O . VAL C 90 ? 0.8064 0.7440 0.7638 -0.1191 -0.0643 -0.1604 91 VAL C O 3547 C CB . VAL C 90 ? 0.7878 0.6871 0.7519 -0.0931 -0.0148 -0.1666 91 VAL C CB 3548 C CG1 . VAL C 90 ? 0.8632 0.6956 0.7672 -0.0851 -0.0237 -0.1816 91 VAL C CG1 3549 C CG2 . VAL C 90 ? 0.7551 0.6837 0.7475 -0.0755 0.0089 -0.1722 91 VAL C CG2 3550 N N . VAL C 91 ? 0.8645 0.7250 0.7393 -0.0880 -0.0390 -0.1688 92 VAL C N 3551 C CA . VAL C 91 ? 0.9144 0.7587 0.7488 -0.0864 -0.0709 -0.1727 92 VAL C CA 3552 C C . VAL C 91 ? 0.9774 0.7680 0.7621 -0.0949 -0.0818 -0.1871 92 VAL C C 3553 O O . VAL C 91 ? 1.0087 0.7567 0.7547 -0.0841 -0.0573 -0.1962 92 VAL C O 3554 C CB . VAL C 91 ? 0.9622 0.7691 0.7369 -0.0645 -0.0688 -0.1672 92 VAL C CB 3555 C CG1 . VAL C 91 ? 1.0247 0.8189 0.7521 -0.0526 -0.1100 -0.1728 92 VAL C CG1 3556 C CG2 . VAL C 91 ? 0.9251 0.7578 0.7305 -0.0512 -0.0634 -0.1572 92 VAL C CG2 3557 N N . GLY C 92 ? 1.0053 0.8058 0.7908 -0.1156 -0.1188 -0.1934 93 GLY C N 3558 C CA . GLY C 92 ? 1.0914 0.8253 0.8162 -0.1280 -0.1387 -0.2110 93 GLY C CA 3559 C C . GLY C 92 ? 1.1578 0.8773 0.8238 -0.1187 -0.1662 -0.2212 93 GLY C C 3560 O O . GLY C 92 ? 1.1470 0.9303 0.8398 -0.1214 -0.1961 -0.2194 93 GLY C O 3561 N N . ASP C 93 ? 1.2358 0.8802 0.8186 -0.1023 -0.1579 -0.2351 94 ASP C N 3562 C CA . ASP C 93 ? 1.3134 0.9321 0.8194 -0.0870 -0.1800 -0.2416 94 ASP C CA 3563 C C . ASP C 93 ? 1.3946 0.9865 0.8564 -0.1076 -0.2277 -0.2656 94 ASP C C 3564 O O . ASP C 93 ? 1.4568 1.0444 0.8627 -0.0957 -0.2588 -0.2724 94 ASP C O 3565 C CB . ASP C 93 ? 1.3654 0.9282 0.7918 -0.0617 -0.1391 -0.2406 94 ASP C CB 3566 C CG . ASP C 93 ? 1.4330 0.9411 0.8079 -0.0561 -0.1211 -0.2671 94 ASP C CG 3567 O OD1 . ASP C 93 ? 1.4221 0.9229 0.8364 -0.0630 -0.1235 -0.2784 94 ASP C OD1 3568 O OD2 . ASP C 93 ? 1.5216 0.9877 0.8051 -0.0407 -0.1053 -0.2775 94 ASP C OD2 3569 N N . ARG C 94 ? 1.4120 0.9743 0.8868 -0.1395 -0.2371 -0.2787 95 ARG C N 3570 C CA . ARG C 94 ? 1.5025 1.0304 0.9351 -0.1758 -0.2855 -0.3031 95 ARG C CA 3571 C C . ARG C 94 ? 1.4982 1.0299 0.9792 -0.2345 -0.3015 -0.3018 95 ARG C C 3572 O O . ARG C 94 ? 1.4768 0.9690 0.9741 -0.2339 -0.2745 -0.2910 95 ARG C O 3573 C CB . ARG C 94 ? 1.6216 1.0339 0.9399 -0.1545 -0.2850 -0.3310 95 ARG C CB 3574 C CG . ARG C 94 ? 1.7027 1.1080 0.9445 -0.1432 -0.3177 -0.3468 95 ARG C CG 3575 C CD . ARG C 94 ? 1.8274 1.1219 0.9477 -0.1182 -0.3117 -0.3777 95 ARG C CD 3576 N NE . ARG C 94 ? 1.8302 1.1152 0.8999 -0.0696 -0.2607 -0.3708 95 ARG C NE 3577 C CZ . ARG C 94 ? 1.7953 1.1260 0.8635 -0.0528 -0.2444 -0.3437 95 ARG C CZ 3578 N NH1 . ARG C 94 ? 1.8241 1.1350 0.8325 -0.0262 -0.1936 -0.3380 95 ARG C NH1 3579 N NH2 . ARG C 94 ? 1.7482 1.1424 0.8661 -0.0624 -0.2791 -0.3242 95 ARG C NH2 3580 N N . GLY C 95 ? 1.5328 1.1140 1.0295 -0.2884 -0.3470 -0.3135 96 GLY C N 3581 C CA . GLY C 95 ? 1.5477 1.1434 1.0835 -0.3654 -0.3618 -0.3096 96 GLY C CA 3582 C C . GLY C 95 ? 1.6968 1.1316 1.1337 -0.4073 -0.3832 -0.3286 96 GLY C C 3583 O O . GLY C 95 ? 1.7724 1.2031 1.2026 -0.4914 -0.4167 -0.3367 96 GLY C O 3584 N N . SER C 96 ? 1.7535 1.0562 1.1083 -0.3499 -0.3643 -0.3386 97 SER C N 3585 C CA . SER C 96 ? 1.9196 1.0415 1.1597 -0.3657 -0.3863 -0.3624 97 SER C CA 3586 C C . SER C 96 ? 1.9379 0.9627 1.1296 -0.2841 -0.3511 -0.3672 97 SER C C 3587 O O . SER C 96 ? 1.8275 0.9327 1.0679 -0.2226 -0.3094 -0.3573 97 SER C O 3588 C CB . SER C 96 ? 2.0421 1.1101 1.1947 -0.3788 -0.4292 -0.4007 97 SER C CB 3589 O OG . SER C 96 ? 2.0212 1.1069 1.1429 -0.3002 -0.4094 -0.4135 97 SER C OG 3590 N N . ALA C 97 ? 2.0929 0.9443 1.1831 -0.2847 -0.3711 -0.3854 98 ALA C N 3591 C CA . ALA C 97 ? 2.1419 0.9003 1.1771 -0.1970 -0.3476 -0.4012 98 ALA C CA 3592 C C . ALA C 97 ? 2.1598 0.9307 1.1490 -0.1231 -0.3289 -0.4367 98 ALA C C 3593 O O . ALA C 97 ? 2.0306 0.9351 1.0878 -0.0897 -0.2883 -0.4255 98 ALA C O 3594 C CB . ALA C 97 ? 2.3439 0.8886 1.2567 -0.2096 -0.3858 -0.4169 98 ALA C CB 3595 N N . GLY C 99 ? 1.7836 0.9366 0.9462 -0.0404 -0.2059 -0.3969 100 GLY C N 3596 C CA . GLY C 99 ? 1.6356 0.9085 0.9021 -0.0525 -0.1780 -0.3578 100 GLY C CA 3597 C C . GLY C 99 ? 1.5617 0.8828 0.8845 -0.0162 -0.1304 -0.3508 100 GLY C C 3598 O O . GLY C 99 ? 1.6059 0.8747 0.9164 0.0115 -0.1310 -0.3675 100 GLY C O 3599 N N . ARG C 100 ? 1.4648 0.8794 0.8416 -0.0153 -0.0939 -0.3279 103 ARG C N 3600 C CA . ARG C 100 ? 1.3918 0.8734 0.8290 0.0087 -0.0489 -0.3233 103 ARG C CA 3601 C C . ARG C 100 ? 1.2749 0.8321 0.7991 -0.0196 -0.0394 -0.2864 103 ARG C C 3602 O O . ARG C 100 ? 1.2571 0.8358 0.7752 -0.0372 -0.0393 -0.2680 103 ARG C O 3603 C CB . ARG C 100 ? 1.4267 0.9447 0.8211 0.0367 -0.0014 -0.3433 103 ARG C CB 3604 N N . LEU C 101 ? 1.2113 0.7982 0.8038 -0.0170 -0.0350 -0.2777 104 LEU C N 3605 C CA . LEU C 101 ? 1.1052 0.7611 0.7769 -0.0388 -0.0264 -0.2484 104 LEU C CA 3606 C C . LEU C 101 ? 1.0611 0.7809 0.7543 -0.0343 0.0184 -0.2440 104 LEU C C 3607 O O . LEU C 101 ? 1.0882 0.8288 0.7613 -0.0145 0.0507 -0.2650 104 LEU C O 3608 C CB . LEU C 101 ? 1.0714 0.7305 0.7929 -0.0395 -0.0376 -0.2409 104 LEU C CB 3609 C CG . LEU C 101 ? 1.1199 0.7130 0.8200 -0.0684 -0.0798 -0.2348 104 LEU C CG 3610 C CD1 . LEU C 101 ? 1.1204 0.6939 0.8401 -0.0633 -0.0849 -0.2260 104 LEU C CD1 3611 C CD2 . LEU C 101 ? 1.0743 0.7140 0.8074 -0.1127 -0.0988 -0.2156 104 LEU C CD2 3612 N N . HIS C 102 ? 1.0048 0.7571 0.7346 -0.0552 0.0199 -0.2195 105 HIS C N 3613 C CA . HIS C 102 ? 0.9887 0.7745 0.7220 -0.0657 0.0567 -0.2113 105 HIS C CA 3614 C C . HIS C 102 ? 0.9057 0.7449 0.7171 -0.0734 0.0625 -0.2002 105 HIS C C 3615 O O . HIS C 102 ? 0.8688 0.7120 0.7126 -0.0775 0.0365 -0.1859 105 HIS C O 3616 C CB . HIS C 102 ? 1.0401 0.7783 0.7092 -0.0769 0.0470 -0.1942 105 HIS C CB 3617 C CG . HIS C 102 ? 1.1319 0.8150 0.7169 -0.0685 0.0322 -0.2040 105 HIS C CG 3618 N ND1 . HIS C 102 ? 1.2133 0.8785 0.7268 -0.0697 0.0655 -0.2161 105 HIS C ND1 3619 C CD2 . HIS C 102 ? 1.1648 0.8162 0.7246 -0.0621 -0.0124 -0.2071 105 HIS C CD2 3620 C CE1 . HIS C 102 ? 1.2920 0.9038 0.7315 -0.0587 0.0406 -0.2253 105 HIS C CE1 3621 N NE2 . HIS C 102 ? 1.2668 0.8690 0.7349 -0.0552 -0.0092 -0.2207 105 HIS C NE2 3622 N N . PHE C 103 ? 0.8833 0.7770 0.7255 -0.0763 0.0970 -0.2108 106 PHE C N 3623 C CA . PHE C 103 ? 0.8119 0.7613 0.7260 -0.0804 0.1000 -0.2069 106 PHE C CA 3624 C C . PHE C 103 ? 0.8113 0.7736 0.7255 -0.1126 0.1233 -0.1979 106 PHE C C 3625 O O . PHE C 103 ? 0.8560 0.8320 0.7408 -0.1371 0.1577 -0.2057 106 PHE C O 3626 C CB . PHE C 103 ? 0.7949 0.8052 0.7505 -0.0542 0.1102 -0.2312 106 PHE C CB 3627 C CG . PHE C 103 ? 0.8095 0.7748 0.7545 -0.0215 0.0774 -0.2360 106 PHE C CG 3628 C CD1 . PHE C 103 ? 0.8714 0.7731 0.7542 -0.0072 0.0662 -0.2472 106 PHE C CD1 3629 C CD2 . PHE C 103 ? 0.7744 0.7450 0.7554 -0.0089 0.0558 -0.2289 106 PHE C CD2 3630 C CE1 . PHE C 103 ? 0.9174 0.7506 0.7721 0.0142 0.0324 -0.2520 106 PHE C CE1 3631 C CE2 . PHE C 103 ? 0.8213 0.7203 0.7681 0.0112 0.0239 -0.2288 106 PHE C CE2 3632 C CZ . PHE C 103 ? 0.8995 0.7241 0.7820 0.0206 0.0114 -0.2408 106 PHE C CZ 3633 N N . GLY C 104 ? 0.7761 0.7304 0.7147 -0.1162 0.1054 -0.1832 107 GLY C N 3634 C CA . GLY C 104 ? 0.7891 0.7410 0.7246 -0.1438 0.1214 -0.1792 107 GLY C CA 3635 C C . GLY C 104 ? 0.7435 0.7838 0.7446 -0.1554 0.1412 -0.1968 107 GLY C C 3636 O O . GLY C 104 ? 0.6990 0.7970 0.7504 -0.1282 0.1337 -0.2085 107 GLY C O 3637 N N . ALA C 105 ? 0.7709 0.8141 0.7622 -0.1957 0.1620 -0.1999 108 ALA C N 3638 C CA . ALA C 105 ? 0.7356 0.8807 0.7916 -0.2143 0.1793 -0.2221 108 ALA C CA 3639 C C . ALA C 105 ? 0.6710 0.8484 0.7835 -0.1897 0.1527 -0.2230 108 ALA C C 3640 O O . ALA C 105 ? 0.6375 0.9050 0.8070 -0.1928 0.1564 -0.2425 108 ALA C O 3641 C CB . ALA C 105 ? 0.8078 0.9421 0.8268 -0.2821 0.2100 -0.2267 108 ALA C CB 3642 N N . GLY C 106 ? 0.6596 0.7754 0.7548 -0.1651 0.1257 -0.2042 109 GLY C N 3643 C CA . GLY C 106 ? 0.6091 0.7555 0.7459 -0.1426 0.1036 -0.2023 109 GLY C CA 3644 C C . GLY C 106 ? 0.6257 0.7625 0.7580 -0.1616 0.1026 -0.2087 109 GLY C C 3645 O O . GLY C 106 ? 0.6849 0.7859 0.7815 -0.2002 0.1186 -0.2155 109 GLY C O 3646 N N . THR C 107 ? 0.5917 0.7520 0.7486 -0.1390 0.0841 -0.2069 110 THR C N 3647 C CA . THR C 107 ? 0.6176 0.7685 0.7658 -0.1481 0.0793 -0.2184 110 THR C CA 3648 C C . THR C 107 ? 0.5701 0.8023 0.7668 -0.1364 0.0701 -0.2272 110 THR C C 3649 O O . THR C 107 ? 0.5385 0.7949 0.7495 -0.1091 0.0577 -0.2143 110 THR C O 3650 C CB . THR C 107 ? 0.6503 0.7399 0.7582 -0.1213 0.0634 -0.2118 110 THR C CB 3651 O OG1 . THR C 107 ? 0.7127 0.7240 0.7677 -0.1201 0.0634 -0.2012 110 THR C OG1 3652 C CG2 . THR C 107 ? 0.6993 0.7519 0.7762 -0.1255 0.0573 -0.2302 110 THR C CG2 3653 N N . GLN C 108 ? 0.5808 0.8544 0.7954 -0.1628 0.0753 -0.2490 111 GLN C N 3654 C CA . GLN C 108 ? 0.5526 0.9001 0.8021 -0.1503 0.0609 -0.2615 111 GLN C CA 3655 C C . GLN C 108 ? 0.5711 0.8855 0.7909 -0.1400 0.0489 -0.2642 111 GLN C C 3656 O O . GLN C 108 ? 0.6300 0.8858 0.8117 -0.1620 0.0508 -0.2787 111 GLN C O 3657 C CB . GLN C 108 ? 0.5660 0.9858 0.8485 -0.1862 0.0679 -0.2910 111 GLN C CB 3658 C CG . GLN C 108 ? 0.5433 1.0616 0.8687 -0.1635 0.0469 -0.3074 111 GLN C CG 3659 N N . LEU C 109 ? 0.5377 0.8809 0.7628 -0.1076 0.0369 -0.2514 112 LEU C N 3660 C CA . LEU C 109 ? 0.5555 0.8915 0.7542 -0.0922 0.0296 -0.2579 112 LEU C CA 3661 C C . LEU C 109 ? 0.5591 0.9515 0.7634 -0.0892 0.0164 -0.2731 112 LEU C C 3662 O O . LEU C 109 ? 0.5417 0.9781 0.7558 -0.0731 0.0073 -0.2580 112 LEU C O 3663 C CB . LEU C 109 ? 0.5354 0.8783 0.7280 -0.0675 0.0307 -0.2349 112 LEU C CB 3664 C CG . LEU C 109 ? 0.5511 0.9185 0.7223 -0.0459 0.0289 -0.2446 112 LEU C CG 3665 C CD1 . LEU C 109 ? 0.5907 0.9015 0.7296 -0.0291 0.0275 -0.2677 112 LEU C CD1 3666 C CD2 . LEU C 109 ? 0.5321 0.9479 0.7104 -0.0392 0.0343 -0.2202 112 LEU C CD2 3667 N N . ILE C 110 ? 0.5998 0.9760 0.7834 -0.1045 0.0113 -0.3028 113 ILE C N 3668 C CA . ILE C 110 ? 0.6127 1.0418 0.7943 -0.1024 -0.0055 -0.3230 113 ILE C CA 3669 C C . ILE C 110 ? 0.6441 1.0589 0.7800 -0.0756 -0.0086 -0.3306 113 ILE C C 3670 O O . ILE C 110 ? 0.6932 1.0432 0.7921 -0.0708 -0.0052 -0.3475 113 ILE C O 3671 C CB . ILE C 110 ? 0.6551 1.0893 0.8430 -0.1466 -0.0121 -0.3588 113 ILE C CB 3672 N N . VAL C 111 ? 0.6319 1.1027 0.7600 -0.0541 -0.0156 -0.3189 114 VAL C N 3673 C CA . VAL C 111 ? 0.6656 1.1477 0.7490 -0.0296 -0.0132 -0.3283 114 VAL C CA 3674 C C . VAL C 111 ? 0.7131 1.2244 0.7667 -0.0289 -0.0335 -0.3561 114 VAL C C 3675 O O . VAL C 111 ? 0.7107 1.2692 0.7656 -0.0264 -0.0487 -0.3435 114 VAL C O 3676 C CB . VAL C 111 ? 0.6404 1.1631 0.7174 -0.0155 0.0009 -0.2917 114 VAL C CB 3677 C CG1 . VAL C 111 ? 0.6857 1.2484 0.7180 0.0051 0.0087 -0.3055 114 VAL C CG1 3678 C CG2 . VAL C 111 ? 0.6058 1.1088 0.7089 -0.0163 0.0170 -0.2739 114 VAL C CG2 3679 N N . ILE C 112 ? 0.7721 1.2428 0.7880 -0.0271 -0.0386 -0.3960 115 ILE C N 3680 C CA . ILE C 112 ? 0.8296 1.3184 0.8055 -0.0269 -0.0598 -0.4305 115 ILE C CA 3681 C C . ILE C 112 ? 0.8532 1.3887 0.7807 0.0099 -0.0523 -0.4253 115 ILE C C 3682 O O . ILE C 112 ? 0.8550 1.3928 0.7698 0.0356 -0.0292 -0.4192 115 ILE C O 3683 C CB . ILE C 112 ? 0.9156 1.3173 0.8504 -0.0438 -0.0707 -0.4789 115 ILE C CB 3684 C CG1 . ILE C 112 ? 0.9496 1.2694 0.8508 -0.0134 -0.0549 -0.4831 115 ILE C CG1 3685 C CG2 . ILE C 112 ? 0.9164 1.2986 0.8886 -0.1025 -0.0806 -0.4886 115 ILE C CG2 3686 C CD1 . ILE C 112 ? 1.0812 1.2887 0.9011 -0.0070 -0.0710 -0.5335 115 ILE C CD1 3687 N N . PRO C 113 ? 0.8793 1.4634 0.7776 0.0125 -0.0716 -0.4288 116 PRO C N 3688 C CA . PRO C 113 ? 0.9192 1.5464 0.7563 0.0395 -0.0604 -0.4216 116 PRO C CA 3689 C C . PRO C 113 ? 1.0028 1.6118 0.7796 0.0619 -0.0630 -0.4754 116 PRO C C 3690 O O . PRO C 113 ? 1.0531 1.6202 0.8148 0.0488 -0.0902 -0.5175 116 PRO C O 3691 C CB . PRO C 113 ? 0.9367 1.6025 0.7509 0.0364 -0.0873 -0.4025 116 PRO C CB 3692 C CG . PRO C 113 ? 0.9302 1.5914 0.7868 0.0166 -0.1205 -0.4327 116 PRO C CG 3693 C CD . PRO C 113 ? 0.8823 1.4965 0.8006 -0.0071 -0.1050 -0.4390 116 PRO C CD 3694 N N . ASP C 114 ? 1.0286 1.6733 0.7693 0.0938 -0.0347 -0.4779 117 ASP C N 3695 C CA . ASP C 114 ? 1.1219 1.7571 0.7940 0.1306 -0.0355 -0.5335 117 ASP C CA 3696 C C . ASP C 114 ? 1.1879 1.8651 0.7898 0.1321 -0.0509 -0.5443 117 ASP C C 3697 O O . ASP C 114 ? 1.1890 1.9381 0.7620 0.1318 -0.0323 -0.5088 117 ASP C O 3698 C CB . ASP C 114 ? 1.1264 1.8161 0.7937 0.1729 0.0020 -0.5391 117 ASP C CB 3699 C CG . ASP C 114 ? 1.2389 1.9276 0.8289 0.2266 0.0019 -0.6031 117 ASP C CG 3700 O OD1 . ASP C 114 ? 1.3189 1.9050 0.8648 0.2338 -0.0304 -0.6505 117 ASP C OD1 3701 O OD2 . ASP C 114 ? 1.2633 2.0559 0.8322 0.2593 0.0350 -0.6088 117 ASP C OD2 3702 N N . ILE C 115 ? 0.6487 1.3937 0.9582 0.2622 -0.0950 -0.0499 118 ILE C N 3703 C CA . ILE C 115 ? 0.6369 1.2877 0.9230 0.2347 -0.0520 -0.0602 118 ILE C CA 3704 C C . ILE C 115 ? 0.6647 1.3274 0.9856 0.2806 -0.0136 -0.0529 118 ILE C C 3705 O O . ILE C 115 ? 0.7076 1.3315 1.0120 0.3415 -0.0064 -0.0314 118 ILE C O 3706 C CB . ILE C 115 ? 0.6436 1.1495 0.8375 0.2250 -0.0455 -0.0529 118 ILE C CB 3707 C CG1 . ILE C 115 ? 0.6245 1.1226 0.7841 0.1925 -0.0791 -0.0600 118 ILE C CG1 3708 C CG2 . ILE C 115 ? 0.6406 1.0674 0.8087 0.1905 -0.0102 -0.0654 118 ILE C CG2 3709 C CD1 . ILE C 115 ? 0.5923 1.1273 0.7826 0.1302 -0.0877 -0.0904 118 ILE C CD1 3710 N N . GLN C 116 ? 0.6510 1.3641 1.0198 0.2516 0.0146 -0.0704 119 GLN C N 3711 C CA . GLN C 116 ? 0.6837 1.4230 1.0894 0.2930 0.0581 -0.0708 119 GLN C CA 3712 C C . GLN C 116 ? 0.7207 1.3167 1.0437 0.2999 0.0954 -0.0760 119 GLN C C 3713 O O . GLN C 116 ? 0.7747 1.3276 1.0883 0.3581 0.1185 -0.0718 119 GLN C O 3714 C CB . GLN C 116 ? 0.6632 1.5168 1.1479 0.2550 0.0803 -0.0861 119 GLN C CB 3715 N N . ASN C 117 ? 0.7016 1.2236 0.9662 0.2410 0.0993 -0.0860 120 ASN C N 3716 C CA . ASN C 117 ? 0.7379 1.1363 0.9210 0.2370 0.1265 -0.0944 120 ASN C CA 3717 C C . ASN C 117 ? 0.7242 1.0193 0.8367 0.2109 0.0987 -0.0873 120 ASN C C 3718 O O . ASN C 117 ? 0.6904 0.9703 0.7819 0.1586 0.0864 -0.0888 120 ASN C O 3719 C CB . ASN C 117 ? 0.7467 1.1588 0.9201 0.1973 0.1625 -0.1089 120 ASN C CB 3720 C CG . ASN C 117 ? 0.7637 1.2890 1.0128 0.2217 0.1976 -0.1157 120 ASN C CG 3721 O OD1 . ASN C 117 ? 0.8106 1.3372 1.0724 0.2799 0.2245 -0.1235 120 ASN C OD1 3722 N ND2 . ASN C 117 ? 0.7356 1.3558 1.0413 0.1772 0.2004 -0.1128 120 ASN C ND2 3723 N N . PRO C 118 ? 0.7569 0.9820 0.8384 0.2491 0.0912 -0.0763 121 PRO C N 3724 C CA . PRO C 118 ? 0.7527 0.8865 0.7740 0.2261 0.0712 -0.0681 121 PRO C CA 3725 C C . PRO C 118 ? 0.7814 0.8242 0.7414 0.1960 0.0912 -0.0850 121 PRO C C 3726 O O . PRO C 118 ? 0.8341 0.8472 0.7789 0.2134 0.1230 -0.1027 121 PRO C O 3727 C CB . PRO C 118 ? 0.7975 0.8909 0.8126 0.2789 0.0656 -0.0460 121 PRO C CB 3728 C CG . PRO C 118 ? 0.8176 0.9952 0.8965 0.3336 0.0739 -0.0395 121 PRO C CG 3729 C CD . PRO C 118 ? 0.8090 1.0388 0.9174 0.3179 0.1030 -0.0660 121 PRO C CD 3730 N N . ASP C 119 ? 0.7548 0.7600 0.6803 0.1528 0.0719 -0.0817 122 ASP C N 3731 C CA . ASP C 119 ? 0.7806 0.7135 0.6491 0.1208 0.0800 -0.0942 122 ASP C CA 3732 C C . ASP C 119 ? 0.7729 0.6442 0.6132 0.1049 0.0580 -0.0824 122 ASP C C 3733 O O . ASP C 119 ? 0.7420 0.6128 0.5708 0.0692 0.0414 -0.0781 122 ASP C O 3734 C CB . ASP C 119 ? 0.7553 0.7270 0.6204 0.0799 0.0813 -0.0971 122 ASP C CB 3735 C CG . ASP C 119 ? 0.8055 0.7262 0.6078 0.0544 0.0928 -0.1108 122 ASP C CG 3736 O OD1 . ASP C 119 ? 0.8686 0.7226 0.6319 0.0627 0.0991 -0.1266 122 ASP C OD1 3737 O OD2 . ASP C 119 ? 0.8020 0.7491 0.5918 0.0239 0.0948 -0.1051 122 ASP C OD2 3738 N N . PRO C 120 ? 0.8104 0.6304 0.6441 0.1331 0.0607 -0.0735 123 PRO C N 3739 C CA . PRO C 120 ? 0.8080 0.5818 0.6246 0.1192 0.0451 -0.0564 123 PRO C CA 3740 C C . PRO C 120 ? 0.8109 0.5438 0.5954 0.0730 0.0393 -0.0682 123 PRO C C 3741 O O . PRO C 120 ? 0.8677 0.5452 0.6216 0.0621 0.0524 -0.0892 123 PRO C O 3742 C CB . PRO C 120 ? 0.8799 0.5866 0.6889 0.1550 0.0612 -0.0463 123 PRO C CB 3743 C CG . PRO C 120 ? 0.9003 0.6453 0.7381 0.2014 0.0763 -0.0500 123 PRO C CG 3744 C CD . PRO C 120 ? 0.8727 0.6664 0.7142 0.1802 0.0845 -0.0775 123 PRO C CD 3745 N N . ALA C 121 ? 0.7557 0.5199 0.5488 0.0475 0.0189 -0.0574 124 ALA C N 3746 C CA . ALA C 121 ? 0.7529 0.5013 0.5274 0.0082 0.0079 -0.0630 124 ALA C CA 3747 C C . ALA C 121 ? 0.7154 0.4789 0.5083 -0.0048 -0.0088 -0.0446 124 ALA C C 3748 O O . ALA C 121 ? 0.6828 0.4814 0.4973 0.0108 -0.0135 -0.0334 124 ALA C O 3749 C CB . ALA C 121 ? 0.7369 0.5206 0.5038 -0.0078 0.0057 -0.0714 124 ALA C CB 3750 N N . VAL C 122 ? 0.7305 0.4741 0.5160 -0.0337 -0.0172 -0.0451 125 VAL C N 3751 C CA . VAL C 122 ? 0.7008 0.4671 0.5117 -0.0450 -0.0283 -0.0284 125 VAL C CA 3752 C C . VAL C 122 ? 0.6906 0.4811 0.5081 -0.0727 -0.0472 -0.0287 125 VAL C C 3753 O O . VAL C 122 ? 0.7209 0.4990 0.5337 -0.0991 -0.0545 -0.0338 125 VAL C O 3754 C CB . VAL C 122 ? 0.7355 0.4671 0.5495 -0.0511 -0.0185 -0.0178 125 VAL C CB 3755 C CG1 . VAL C 122 ? 0.7067 0.4785 0.5501 -0.0523 -0.0213 0.0009 125 VAL C CG1 3756 C CG2 . VAL C 122 ? 0.7697 0.4615 0.5688 -0.0212 0.0000 -0.0112 125 VAL C CG2 3757 N N . TYR C 123 ? 0.6587 0.4844 0.4904 -0.0672 -0.0564 -0.0218 126 TYR C N 3758 C CA . TYR C 123 ? 0.6575 0.5081 0.4963 -0.0842 -0.0758 -0.0127 126 TYR C CA 3759 C C . TYR C 123 ? 0.6374 0.5181 0.5207 -0.0847 -0.0848 0.0020 126 TYR C C 3760 O O . TYR C 123 ? 0.6155 0.5014 0.5208 -0.0687 -0.0726 0.0044 126 TYR C O 3761 C CB . TYR C 123 ? 0.6464 0.5090 0.4826 -0.0768 -0.0770 -0.0058 126 TYR C CB 3762 C CG . TYR C 123 ? 0.6635 0.5129 0.4681 -0.0736 -0.0612 -0.0193 126 TYR C CG 3763 C CD1 . TYR C 123 ? 0.7144 0.5532 0.4733 -0.0880 -0.0596 -0.0296 126 TYR C CD1 3764 C CD2 . TYR C 123 ? 0.6416 0.4981 0.4633 -0.0560 -0.0476 -0.0247 126 TYR C CD2 3765 C CE1 . TYR C 123 ? 0.7346 0.5681 0.4685 -0.0807 -0.0384 -0.0440 126 TYR C CE1 3766 C CE2 . TYR C 123 ? 0.6584 0.5183 0.4648 -0.0503 -0.0311 -0.0358 126 TYR C CE2 3767 C CZ . TYR C 123 ? 0.7033 0.5509 0.4674 -0.0607 -0.0235 -0.0447 126 TYR C CZ 3768 O OH . TYR C 123 ? 0.7191 0.5769 0.4723 -0.0509 -0.0008 -0.0573 126 TYR C OH 3769 N N . GLN C 124 ? 0.6533 0.5623 0.5491 -0.1012 -0.1057 0.0119 127 GLN C N 3770 C CA . GLN C 124 ? 0.6414 0.5943 0.5924 -0.0966 -0.1137 0.0281 127 GLN C CA 3771 C C . GLN C 124 ? 0.6347 0.6086 0.6077 -0.0783 -0.1265 0.0478 127 GLN C C 3772 O O . GLN C 124 ? 0.6631 0.6450 0.6148 -0.0868 -0.1461 0.0598 127 GLN C O 3773 C CB . GLN C 124 ? 0.6671 0.6518 0.6354 -0.1270 -0.1306 0.0287 127 GLN C CB 3774 C CG . GLN C 124 ? 0.6633 0.7111 0.7029 -0.1202 -0.1360 0.0470 127 GLN C CG 3775 C CD . GLN C 124 ? 0.7094 0.8113 0.7786 -0.1550 -0.1611 0.0491 127 GLN C CD 3776 O OE1 . GLN C 124 ? 0.7085 0.8764 0.8216 -0.1488 -0.1859 0.0685 127 GLN C OE1 3777 N NE2 . GLN C 124 ? 0.7473 0.8219 0.7968 -0.1920 -0.1560 0.0294 127 GLN C NE2 3778 N N . LEU C 125 ? 0.6132 0.5919 0.6245 -0.0525 -0.1139 0.0514 128 LEU C N 3779 C CA . LEU C 125 ? 0.6224 0.6006 0.6592 -0.0310 -0.1201 0.0687 128 LEU C CA 3780 C C . LEU C 125 ? 0.6225 0.6492 0.7235 -0.0132 -0.1267 0.0852 128 LEU C C 3781 O O . LEU C 125 ? 0.6084 0.6646 0.7391 -0.0113 -0.1134 0.0760 128 LEU C O 3782 C CB . LEU C 125 ? 0.6166 0.5554 0.6505 -0.0148 -0.0993 0.0521 128 LEU C CB 3783 C CG . LEU C 125 ? 0.6191 0.5252 0.6070 -0.0280 -0.0921 0.0381 128 LEU C CG 3784 C CD1 . LEU C 125 ? 0.5884 0.4955 0.5475 -0.0366 -0.0830 0.0196 128 LEU C CD1 3785 C CD2 . LEU C 125 ? 0.6143 0.4929 0.6149 -0.0177 -0.0796 0.0246 128 LEU C CD2 3786 N N . ARG C 126 ? 0.6470 0.6859 0.7718 0.0020 -0.1453 0.1140 129 ARG C N 3787 C CA . ARG C 126 ? 0.6523 0.7503 0.8479 0.0249 -0.1555 0.1351 129 ARG C CA 3788 C C . ARG C 126 ? 0.6766 0.7453 0.9149 0.0681 -0.1421 0.1454 129 ARG C C 3789 O O . ARG C 126 ? 0.7023 0.7051 0.9129 0.0729 -0.1361 0.1478 129 ARG C O 3790 C CB . ARG C 126 ? 0.6772 0.8315 0.8744 0.0109 -0.1955 0.1653 129 ARG C CB 3791 C CG . ARG C 126 ? 0.6653 0.8534 0.8353 -0.0343 -0.2084 0.1464 129 ARG C CG 3792 C CD . ARG C 126 ? 0.6759 0.9584 0.8924 -0.0451 -0.2453 0.1667 129 ARG C CD 3793 N NE . ARG C 126 ? 0.6637 0.9780 0.8836 -0.0899 -0.2472 0.1406 129 ARG C NE 3794 N N . ASP C 127 ? 0.6780 0.7949 0.9884 0.0984 -0.1343 0.1500 130 ASP C N 3795 C CA . ASP C 127 ? 0.7129 0.7949 1.0693 0.1449 -0.1134 0.1493 130 ASP C CA 3796 C C . ASP C 127 ? 0.7676 0.8196 1.1401 0.1702 -0.1339 0.1934 130 ASP C C 3797 O O . ASP C 127 ? 0.7808 0.8735 1.1442 0.1597 -0.1690 0.2318 130 ASP C O 3798 C CB . ASP C 127 ? 0.7074 0.8602 1.1407 0.1749 -0.0951 0.1427 130 ASP C CB 3799 C CG . ASP C 127 ? 0.7506 0.8552 1.2169 0.2209 -0.0600 0.1196 130 ASP C CG 3800 O OD1 . ASP C 127 ? 0.7815 0.7960 1.2020 0.2168 -0.0469 0.0951 130 ASP C OD1 3801 O OD2 . ASP C 127 ? 0.7693 0.9291 1.3105 0.2600 -0.0442 0.1223 130 ASP C OD2 3802 N N . SER C 128 ? 0.8149 0.7918 1.2073 0.2024 -0.1117 0.1877 131 SER C N 3803 C CA . SER C 128 ? 0.8857 0.8158 1.2984 0.2317 -0.1243 0.2356 131 SER C CA 3804 C C . SER C 128 ? 0.9164 0.9084 1.4176 0.2863 -0.1348 0.2722 131 SER C C 3805 O O . SER C 128 ? 0.9744 0.9607 1.4936 0.3120 -0.1586 0.3295 131 SER C O 3806 C CB . SER C 128 ? 0.9412 0.7524 1.3458 0.2403 -0.0939 0.2127 131 SER C CB 3807 O OG . SER C 128 ? 0.9154 0.6833 1.2488 0.1906 -0.0888 0.1865 131 SER C OG 3808 N N . LYS C 129 ? 0.8854 0.9428 1.4433 0.3060 -0.1158 0.2432 132 LYS C N 3809 C CA . LYS C 129 ? 0.9153 1.0460 1.5741 0.3634 -0.1190 0.2726 132 LYS C CA 3810 C C . LYS C 129 ? 0.8645 1.1434 1.5641 0.3471 -0.1495 0.2918 132 LYS C C 3811 O O . LYS C 129 ? 0.8921 1.2452 1.6463 0.3737 -0.1853 0.3440 132 LYS C O 3812 C CB . LYS C 129 ? 0.9407 1.0432 1.6522 0.4081 -0.0682 0.2277 132 LYS C CB 3813 C CG . LYS C 129 ? 1.0322 1.0034 1.7523 0.4493 -0.0454 0.2253 132 LYS C CG 3814 N N . SER C 130 ? 0.8001 1.1227 1.4757 0.3023 -0.1365 0.2517 133 SER C N 3815 C CA . SER C 130 ? 0.7583 1.2144 1.4785 0.2764 -0.1593 0.2621 133 SER C CA 3816 C C . SER C 130 ? 0.7143 1.1657 1.3504 0.2034 -0.1761 0.2433 133 SER C C 3817 O O . SER C 130 ? 0.6821 1.1010 1.2780 0.1752 -0.1449 0.2034 133 SER C O 3818 C CB . SER C 130 ? 0.7398 1.2692 1.5396 0.2981 -0.1183 0.2367 133 SER C CB 3819 O OG . SER C 130 ? 0.7094 1.1881 1.4484 0.2677 -0.0784 0.1879 133 SER C OG 3820 N N . SER C 131 ? 0.7243 1.2084 1.3319 0.1764 -0.2249 0.2727 134 SER C N 3821 C CA . SER C 131 ? 0.7008 1.1729 1.2259 0.1104 -0.2422 0.2527 134 SER C CA 3822 C C . SER C 131 ? 0.6580 1.1821 1.2042 0.0692 -0.2252 0.2204 134 SER C C 3823 O O . SER C 131 ? 0.6453 1.1315 1.1230 0.0194 -0.2245 0.1952 134 SER C O 3824 C CB . SER C 131 ? 0.7362 1.2616 1.2378 0.0915 -0.2991 0.2865 134 SER C CB 3825 O OG . SER C 131 ? 0.7420 1.4013 1.3369 0.0999 -0.3297 0.3099 134 SER C OG 3826 N N . ASP C 132 ? 0.6438 1.2522 1.2875 0.0917 -0.2074 0.2237 135 ASP C N 3827 C CA . ASP C 132 ? 0.6136 1.2718 1.2858 0.0538 -0.1823 0.2004 135 ASP C CA 3828 C C . ASP C 132 ? 0.5951 1.1533 1.1921 0.0413 -0.1373 0.1661 135 ASP C C 3829 O O . ASP C 132 ? 0.5872 1.1379 1.1539 -0.0067 -0.1277 0.1500 135 ASP C O 3830 C CB . ASP C 132 ? 0.6099 1.3851 1.4069 0.0865 -0.1630 0.2131 135 ASP C CB 3831 C CG . ASP C 132 ? 0.6241 1.3627 1.4504 0.1591 -0.1252 0.2117 135 ASP C CG 3832 N N . LYS C 133 ? 0.6003 1.0802 1.1672 0.0839 -0.1125 0.1561 136 LYS C N 3833 C CA . LYS C 133 ? 0.5895 0.9892 1.0890 0.0793 -0.0737 0.1236 136 LYS C CA 3834 C C . LYS C 133 ? 0.5861 0.8886 0.9876 0.0562 -0.0881 0.1124 136 LYS C C 3835 O O . LYS C 133 ? 0.6013 0.8602 0.9823 0.0713 -0.1077 0.1231 136 LYS C O 3836 C CB . LYS C 133 ? 0.6079 0.9867 1.1324 0.1337 -0.0365 0.1079 136 LYS C CB 3837 N N . SER C 134 ? 0.5720 0.8426 0.9177 0.0219 -0.0751 0.0946 137 SER C N 3838 C CA . SER C 134 ? 0.5727 0.7635 0.8349 0.0031 -0.0840 0.0825 137 SER C CA 3839 C C . SER C 134 ? 0.5672 0.7130 0.7776 -0.0015 -0.0541 0.0603 137 SER C C 3840 O O . SER C 134 ? 0.5715 0.7466 0.8000 0.0027 -0.0264 0.0571 137 SER C O 3841 C CB . SER C 134 ? 0.5805 0.7794 0.8190 -0.0383 -0.1152 0.0897 137 SER C CB 3842 O OG . SER C 134 ? 0.5891 0.8008 0.8271 -0.0729 -0.1036 0.0820 137 SER C OG 3843 N N . VAL C 135 ? 0.5652 0.6485 0.7125 -0.0085 -0.0592 0.0486 138 VAL C N 3844 C CA . VAL C 135 ? 0.5667 0.6146 0.6635 -0.0113 -0.0390 0.0332 138 VAL C CA 3845 C C . VAL C 135 ? 0.5723 0.5794 0.6197 -0.0368 -0.0497 0.0317 138 VAL C C 3846 O O . VAL C 135 ? 0.5775 0.5822 0.6217 -0.0557 -0.0714 0.0367 138 VAL C O 3847 C CB . VAL C 135 ? 0.5693 0.5889 0.6446 0.0150 -0.0284 0.0124 138 VAL C CB 3848 C CG1 . VAL C 135 ? 0.5810 0.6311 0.6923 0.0423 -0.0071 0.0030 138 VAL C CG1 3849 C CG2 . VAL C 135 ? 0.5695 0.5549 0.6386 0.0159 -0.0473 0.0110 138 VAL C CG2 3850 N N . CYS C 136 ? 0.5826 0.5605 0.5896 -0.0337 -0.0341 0.0248 139 CYS C N 3851 C CA . CYS C 136 ? 0.6025 0.5354 0.5652 -0.0457 -0.0383 0.0206 139 CYS C CA 3852 C C . CYS C 136 ? 0.5925 0.5077 0.5241 -0.0240 -0.0341 0.0086 139 CYS C C 3853 O O . CYS C 136 ? 0.5986 0.5248 0.5201 -0.0067 -0.0213 0.0073 139 CYS C O 3854 C CB . CYS C 136 ? 0.6362 0.5492 0.5876 -0.0611 -0.0234 0.0308 139 CYS C CB 3855 S SG . CYS C 136 ? 0.6817 0.6332 0.6848 -0.0931 -0.0218 0.0444 139 CYS C SG 3856 N N . LEU C 137 ? 0.5867 0.4836 0.5024 -0.0267 -0.0447 0.0001 140 LEU C N 3857 C CA . LEU C 137 ? 0.5821 0.4774 0.4822 -0.0109 -0.0429 -0.0121 140 LEU C CA 3858 C C . LEU C 137 ? 0.6022 0.4760 0.4744 -0.0063 -0.0378 -0.0129 140 LEU C C 3859 O O . LEU C 137 ? 0.6149 0.4700 0.4757 -0.0172 -0.0398 -0.0168 140 LEU C O 3860 C CB . LEU C 137 ? 0.5695 0.4672 0.4835 -0.0158 -0.0523 -0.0189 140 LEU C CB 3861 C CG . LEU C 137 ? 0.5605 0.4650 0.4723 -0.0107 -0.0517 -0.0337 140 LEU C CG 3862 C CD1 . LEU C 137 ? 0.5769 0.4999 0.4984 0.0015 -0.0504 -0.0501 140 LEU C CD1 3863 C CD2 . LEU C 137 ? 0.5543 0.4499 0.4769 -0.0253 -0.0559 -0.0305 140 LEU C CD2 3864 N N . PHE C 138 ? 0.6160 0.4936 0.4744 0.0133 -0.0301 -0.0082 141 PHE C N 3865 C CA . PHE C 138 ? 0.6428 0.5014 0.4829 0.0285 -0.0245 -0.0053 141 PHE C CA 3866 C C . PHE C 138 ? 0.6299 0.5260 0.4798 0.0412 -0.0318 -0.0192 141 PHE C C 3867 O O . PHE C 138 ? 0.6245 0.5592 0.4794 0.0509 -0.0392 -0.0249 141 PHE C O 3868 C CB . PHE C 138 ? 0.6793 0.5252 0.5010 0.0481 -0.0141 0.0164 141 PHE C CB 3869 C CG . PHE C 138 ? 0.7060 0.5280 0.5149 0.0739 -0.0077 0.0248 141 PHE C CG 3870 C CD1 . PHE C 138 ? 0.7167 0.4961 0.5243 0.0685 -0.0003 0.0133 141 PHE C CD1 3871 C CD2 . PHE C 138 ? 0.7273 0.5720 0.5235 0.1075 -0.0086 0.0443 141 PHE C CD2 3872 C CE1 . PHE C 138 ? 0.7602 0.5141 0.5622 0.0999 0.0103 0.0188 141 PHE C CE1 3873 C CE2 . PHE C 138 ? 0.7749 0.6003 0.5677 0.1402 -0.0029 0.0574 141 PHE C CE2 3874 C CZ . PHE C 138 ? 0.7840 0.5604 0.5838 0.1381 0.0088 0.0435 141 PHE C CZ 3875 N N . THR C 139 ? 0.6363 0.5262 0.4888 0.0385 -0.0285 -0.0276 142 THR C N 3876 C CA . THR C 139 ? 0.6214 0.5563 0.4962 0.0402 -0.0329 -0.0406 142 THR C CA 3877 C C . THR C 139 ? 0.6398 0.5834 0.5189 0.0549 -0.0211 -0.0447 142 THR C C 3878 O O . THR C 139 ? 0.6705 0.5707 0.5285 0.0602 -0.0079 -0.0435 142 THR C O 3879 C CB . THR C 139 ? 0.6000 0.5372 0.4892 0.0117 -0.0379 -0.0476 142 THR C CB 3880 O OG1 . THR C 139 ? 0.6031 0.5801 0.5196 0.0055 -0.0387 -0.0588 142 THR C OG1 3881 C CG2 . THR C 139 ? 0.6083 0.5114 0.4787 -0.0054 -0.0327 -0.0420 142 THR C CG2 3882 N N . ASP C 140 ? 0.6306 0.6340 0.5415 0.0599 -0.0248 -0.0533 143 ASP C N 3883 C CA . ASP C 140 ? 0.6463 0.6842 0.5787 0.0763 -0.0111 -0.0583 143 ASP C CA 3884 C C . ASP C 140 ? 0.6825 0.7130 0.6107 0.1211 -0.0039 -0.0477 143 ASP C C 3885 O O . ASP C 140 ? 0.7116 0.7334 0.6433 0.1395 0.0168 -0.0525 143 ASP C O 3886 C CB . ASP C 140 ? 0.6588 0.6729 0.5777 0.0549 0.0082 -0.0652 143 ASP C CB 3887 C CG . ASP C 140 ? 0.6466 0.6755 0.5781 0.0167 0.0034 -0.0660 143 ASP C CG 3888 O OD1 . ASP C 140 ? 0.6355 0.7152 0.6081 0.0074 -0.0048 -0.0713 143 ASP C OD1 3889 O OD2 . ASP C 140 ? 0.6664 0.6553 0.5671 -0.0046 0.0071 -0.0607 143 ASP C OD2 3890 N N . PHE C 141 ? 0.6920 0.7242 0.6107 0.1414 -0.0185 -0.0318 144 PHE C N 3891 C CA . PHE C 141 ? 0.7432 0.7613 0.6568 0.1885 -0.0127 -0.0106 144 PHE C CA 3892 C C . PHE C 141 ? 0.7483 0.8617 0.7015 0.2233 -0.0283 -0.0037 144 PHE C C 3893 O O . PHE C 141 ? 0.7144 0.9040 0.6918 0.2043 -0.0493 -0.0173 144 PHE C O 3894 C CB . PHE C 141 ? 0.7717 0.7282 0.6446 0.1930 -0.0141 0.0139 144 PHE C CB 3895 C CG . PHE C 141 ? 0.7359 0.7248 0.5960 0.1728 -0.0333 0.0150 144 PHE C CG 3896 C CD1 . PHE C 141 ? 0.7492 0.7750 0.5932 0.1993 -0.0471 0.0370 144 PHE C CD1 3897 C CD2 . PHE C 141 ? 0.6927 0.6737 0.5526 0.1311 -0.0359 -0.0049 144 PHE C CD2 3898 C CE1 . PHE C 141 ? 0.7324 0.7876 0.5562 0.1820 -0.0600 0.0309 144 PHE C CE1 3899 C CE2 . PHE C 141 ? 0.6645 0.6695 0.5146 0.1182 -0.0480 -0.0091 144 PHE C CE2 3900 C CZ . PHE C 141 ? 0.6831 0.7249 0.5128 0.1422 -0.0583 0.0048 144 PHE C CZ 3901 N N . ASP C 142 ? 0.8019 0.9114 0.7660 0.2741 -0.0186 0.0159 145 ASP C N 3902 C CA . ASP C 142 ? 0.8165 1.0287 0.8245 0.3154 -0.0372 0.0288 145 ASP C CA 3903 C C . ASP C 142 ? 0.8374 1.0766 0.8145 0.3285 -0.0669 0.0549 145 ASP C C 3904 O O . ASP C 142 ? 0.8567 1.0212 0.7805 0.3163 -0.0626 0.0696 145 ASP C O 3905 C CB . ASP C 142 ? 0.8749 1.0738 0.9097 0.3754 -0.0152 0.0454 145 ASP C CB 3906 C CG . ASP C 142 ? 0.9527 1.0597 0.9463 0.4163 -0.0081 0.0855 145 ASP C CG 3907 N N . SER C 143 ? 0.8431 1.1980 0.8537 0.3524 -0.0965 0.0607 146 SER C N 3908 C CA . SER C 143 ? 0.8690 1.2709 0.8417 0.3609 -0.1291 0.0791 146 SER C CA 3909 C C . SER C 143 ? 0.9522 1.3162 0.8872 0.4204 -0.1277 0.1370 146 SER C C 3910 O O . SER C 143 ? 0.9898 1.3973 0.8830 0.4354 -0.1533 0.1618 146 SER C O 3911 C CB . SER C 143 ? 0.8477 1.3968 0.8673 0.3538 -0.1673 0.0560 146 SER C CB 3912 O OG . SER C 143 ? 0.7879 1.3522 0.8411 0.2938 -0.1634 0.0071 146 SER C OG 3913 N N . GLN C 144 ? 0.9954 1.2722 0.9402 0.4533 -0.0957 0.1582 147 GLN C N 3914 C CA . GLN C 144 ? 1.0909 1.2930 0.9995 0.5050 -0.0845 0.2166 147 GLN C CA 3915 C C . GLN C 144 ? 1.1133 1.2065 0.9529 0.4695 -0.0669 0.2305 147 GLN C C 3916 O O . GLN C 144 ? 1.1904 1.2420 0.9859 0.4977 -0.0640 0.2838 147 GLN C O 3917 C CB . GLN C 144 ? 1.1402 1.2709 1.0865 0.5496 -0.0514 0.2256 147 GLN C CB 3918 N N . THR C 145 ? 1.0524 1.1066 0.8867 0.4082 -0.0545 0.1868 148 THR C N 3919 C CA . THR C 145 ? 1.0648 1.0328 0.8509 0.3697 -0.0371 0.1939 148 THR C CA 3920 C C . THR C 145 ? 1.0592 1.0869 0.8021 0.3544 -0.0569 0.2025 148 THR C C 3921 O O . THR C 145 ? 1.0075 1.1256 0.7605 0.3363 -0.0819 0.1676 148 THR C O 3922 C CB . THR C 145 ? 1.0025 0.9230 0.8024 0.3140 -0.0215 0.1464 148 THR C CB 3923 O OG1 . THR C 145 ? 1.0055 0.9032 0.8418 0.3260 -0.0070 0.1250 148 THR C OG1 3924 N N . ASN C 146 ? 1.1250 1.0983 0.8187 0.3603 -0.0419 0.2474 149 ASN C N 3925 C CA . ASN C 146 ? 1.1307 1.1456 0.7739 0.3412 -0.0482 0.2532 149 ASN C CA 3926 C C . ASN C 146 ? 1.1072 1.0538 0.7435 0.2906 -0.0199 0.2399 149 ASN C C 3927 O O . ASN C 146 ? 1.1421 0.9927 0.7854 0.2808 0.0071 0.2601 149 ASN C O 3928 C CB . ASN C 146 ? 1.2317 1.2573 0.8194 0.3854 -0.0501 0.3209 149 ASN C CB 3929 C CG . ASN C 146 ? 1.2519 1.3929 0.8367 0.4306 -0.0911 0.3293 149 ASN C CG 3930 O OD1 . ASN C 146 ? 1.1974 1.4356 0.7922 0.4129 -0.1206 0.2802 149 ASN C OD1 3931 N ND2 . ASN C 146 ? 1.3401 1.4710 0.9143 0.4891 -0.0943 0.3928 149 ASN C ND2 3932 N N . VAL C 147 ? 1.0559 1.0537 0.6839 0.2588 -0.0268 0.2032 150 VAL C N 3933 C CA . VAL C 147 ? 1.0303 0.9876 0.6611 0.2162 -0.0029 0.1910 150 VAL C CA 3934 C C . VAL C 147 ? 1.0932 1.0616 0.6700 0.2193 0.0156 0.2289 150 VAL C C 3935 O O . VAL C 147 ? 1.1044 1.1467 0.6433 0.2272 0.0045 0.2167 150 VAL C O 3936 C CB . VAL C 147 ? 0.9490 0.9473 0.6093 0.1846 -0.0152 0.1310 150 VAL C CB 3937 C CG1 . VAL C 147 ? 0.9284 0.8989 0.5993 0.1497 0.0075 0.1238 150 VAL C CG1 3938 C CG2 . VAL C 147 ? 0.8963 0.8837 0.6050 0.1770 -0.0277 0.1005 150 VAL C CG2 3939 N N . SER C 148 ? 1.1453 1.0402 0.7172 0.2099 0.0464 0.2726 151 SER C N 3940 C CA . SER C 148 ? 1.2142 1.1151 0.7384 0.2078 0.0734 0.3171 151 SER C CA 3941 C C . SER C 148 ? 1.1695 1.0963 0.7123 0.1676 0.0927 0.2867 151 SER C C 3942 O O . SER C 148 ? 1.0917 1.0132 0.6877 0.1410 0.0852 0.2406 151 SER C O 3943 C CB . SER C 148 ? 1.3030 1.1082 0.8227 0.2096 0.1023 0.3804 151 SER C CB 3944 O OG . SER C 148 ? 1.3542 1.1292 0.8642 0.2556 0.0871 0.4107 151 SER C OG 3945 N N . GLN C 149 ? 1.2271 1.1873 0.7256 0.1669 0.1189 0.3157 152 GLN C N 3946 C CA . GLN C 149 ? 1.1988 1.1935 0.7203 0.1358 0.1441 0.2916 152 GLN C CA 3947 C C . GLN C 149 ? 1.2106 1.1473 0.7816 0.0963 0.1766 0.3206 152 GLN C C 3948 O O . GLN C 149 ? 1.2602 1.1191 0.8351 0.0921 0.1832 0.3604 152 GLN C O 3949 C CB . GLN C 149 ? 1.2618 1.3305 0.7126 0.1525 0.1632 0.3027 152 GLN C CB 3950 C CG . GLN C 149 ? 1.2492 1.3901 0.6628 0.1758 0.1318 0.2468 152 GLN C CG 3951 C CD . GLN C 149 ? 1.1599 1.3041 0.6406 0.1584 0.1124 0.1756 152 GLN C CD 3952 O OE1 . GLN C 149 ? 1.1246 1.2760 0.6146 0.1672 0.0751 0.1403 152 GLN C OE1 3953 N NE2 . GLN C 149 ? 1.1260 1.2689 0.6582 0.1341 0.1383 0.1592 152 GLN C NE2 3954 N N . SER C 150 ? 1.1716 1.1470 0.7858 0.0676 0.1963 0.2981 153 SER C N 3955 C CA . SER C 150 ? 1.1817 1.1256 0.8537 0.0231 0.2248 0.3210 153 SER C CA 3956 C C . SER C 150 ? 1.2783 1.2296 0.9173 0.0146 0.2723 0.3830 153 SER C C 3957 O O . SER C 150 ? 1.3062 1.3297 0.9008 0.0325 0.2936 0.3879 153 SER C O 3958 C CB . SER C 150 ? 1.1032 1.1008 0.8477 -0.0009 0.2237 0.2756 153 SER C CB 3959 O OG . SER C 150 ? 1.1170 1.1034 0.9250 -0.0477 0.2470 0.2962 153 SER C OG 3960 N N . LYS C 151 ? 1.3393 1.2121 0.9977 -0.0148 0.2918 0.4290 154 LYS C N 3961 C CA . LYS C 151 ? 1.4381 1.3072 1.0805 -0.0360 0.3433 0.4947 154 LYS C CA 3962 C C . LYS C 151 ? 1.4059 1.3481 1.1222 -0.0804 0.3746 0.4808 154 LYS C C 3963 O O . LYS C 151 ? 1.4803 1.4486 1.1938 -0.1020 0.4242 0.5297 154 LYS C O 3964 C CB . LYS C 151 ? 1.5267 1.2724 1.1750 -0.0576 0.3553 0.5456 154 LYS C CB 3965 N N . ASP C 152 ? 1.2998 1.2810 1.0842 -0.0914 0.3462 0.4182 155 ASP C N 3966 C CA . ASP C 152 ? 1.2574 1.3201 1.1287 -0.1263 0.3666 0.4002 155 ASP C CA 3967 C C . ASP C 152 ? 1.2046 1.3707 1.0697 -0.0892 0.3707 0.3611 155 ASP C C 3968 O O . ASP C 152 ? 1.1538 1.3202 0.9855 -0.0509 0.3352 0.3178 155 ASP C O 3969 C CB . ASP C 152 ? 1.1927 1.2317 1.1494 -0.1639 0.3314 0.3625 155 ASP C CB 3970 C CG . ASP C 152 ? 1.1695 1.2970 1.2285 -0.2056 0.3500 0.3556 155 ASP C CG 3971 O OD1 . ASP C 152 ? 1.0938 1.2974 1.1974 -0.1877 0.3315 0.3140 155 ASP C OD1 3972 O OD2 . ASP C 152 ? 1.2352 1.3582 1.3351 -0.2558 0.3842 0.3943 155 ASP C OD2 3973 N N . SER C 153 ? 1.2228 1.4750 1.1271 -0.1029 0.4172 0.3743 156 SER C N 3974 C CA . SER C 153 ? 1.1982 1.5463 1.0954 -0.0650 0.4349 0.3383 156 SER C CA 3975 C C . SER C 153 ? 1.0967 1.4816 1.0718 -0.0530 0.4013 0.2769 156 SER C C 3976 O O . SER C 153 ? 1.0848 1.5265 1.0521 -0.0146 0.4102 0.2379 156 SER C O 3977 C CB . SER C 153 ? 1.2610 1.6957 1.1822 -0.0813 0.5029 0.3736 156 SER C CB 3978 N N . ASP C 154 ? 1.0349 1.3835 1.0792 -0.0843 0.3636 0.2684 157 ASP C N 3979 C CA . ASP C 154 ? 0.9476 1.3346 1.0693 -0.0752 0.3316 0.2235 157 ASP C CA 3980 C C . ASP C 154 ? 0.8904 1.2025 0.9860 -0.0630 0.2737 0.1920 157 ASP C C 3981 O O . ASP C 154 ? 0.8333 1.1658 0.9800 -0.0523 0.2448 0.1605 157 ASP C O 3982 C CB . ASP C 154 ? 0.9302 1.3758 1.1686 -0.1218 0.3364 0.2372 157 ASP C CB 3983 N N . VAL C 155 ? 0.9106 1.1400 0.9291 -0.0620 0.2594 0.2048 158 VAL C N 3984 C CA . VAL C 155 ? 0.8624 1.0289 0.8529 -0.0485 0.2120 0.1766 158 VAL C CA 3985 C C . VAL C 155 ? 0.8673 1.0295 0.7804 -0.0036 0.2068 0.1558 158 VAL C C 3986 O O . VAL C 155 ? 0.9273 1.0848 0.7720 0.0097 0.2268 0.1800 158 VAL C O 3987 C CB . VAL C 155 ? 0.8893 0.9687 0.8580 -0.0753 0.1969 0.1987 158 VAL C CB 3988 C CG1 . VAL C 155 ? 0.8415 0.8723 0.7961 -0.0640 0.1524 0.1665 158 VAL C CG1 3989 C CG2 . VAL C 155 ? 0.9079 0.9875 0.9445 -0.1293 0.2072 0.2180 158 VAL C CG2 3990 N N . TYR C 156 ? 0.8120 0.9774 0.7356 0.0170 0.1790 0.1129 159 TYR C N 3991 C CA . TYR C 156 ? 0.8187 0.9827 0.6790 0.0510 0.1698 0.0834 159 TYR C CA 3992 C C . TYR C 156 ? 0.7859 0.8950 0.6257 0.0527 0.1289 0.0696 159 TYR C C 3993 O O . TYR C 156 ? 0.7385 0.8294 0.6219 0.0444 0.1049 0.0507 159 TYR C O 3994 C CB . TYR C 156 ? 0.8065 1.0123 0.6954 0.0734 0.1773 0.0404 159 TYR C CB 3995 C CG . TYR C 156 ? 0.8339 1.1064 0.7598 0.0774 0.2215 0.0481 159 TYR C CG 3996 C CD1 . TYR C 156 ? 0.9026 1.2130 0.7709 0.0872 0.2612 0.0625 159 TYR C CD1 3997 C CD2 . TYR C 156 ? 0.8014 1.1086 0.8209 0.0741 0.2246 0.0431 159 TYR C CD2 3998 C CE1 . TYR C 156 ? 0.9329 1.3144 0.8387 0.0911 0.3089 0.0693 159 TYR C CE1 3999 C CE2 . TYR C 156 ? 0.8259 1.2089 0.8932 0.0810 0.2679 0.0499 159 TYR C CE2 4000 C CZ . TYR C 156 ? 0.8908 1.3105 0.9021 0.0884 0.3128 0.0614 159 TYR C CZ 4001 O OH . TYR C 156 ? 0.9223 1.4256 0.9841 0.0953 0.3621 0.0682 159 TYR C OH 4002 N N . ILE C 157 ? 0.8182 0.9088 0.5924 0.0658 0.1223 0.0826 160 ILE C N 4003 C CA . ILE C 157 ? 0.7901 0.8433 0.5486 0.0717 0.0878 0.0713 160 ILE C CA 4004 C C . ILE C 157 ? 0.8088 0.8929 0.5169 0.0972 0.0729 0.0423 160 ILE C C 4005 O O . ILE C 157 ? 0.8660 0.9821 0.5162 0.1138 0.0853 0.0553 160 ILE C O 4006 C CB . ILE C 157 ? 0.8189 0.8234 0.5576 0.0671 0.0882 0.1141 160 ILE C CB 4007 C CG1 . ILE C 157 ? 0.8072 0.7766 0.5960 0.0328 0.1000 0.1326 160 ILE C CG1 4008 C CG2 . ILE C 157 ? 0.8001 0.7786 0.5281 0.0803 0.0579 0.1019 160 ILE C CG2 4009 C CD1 . ILE C 157 ? 0.8638 0.7743 0.6335 0.0238 0.1144 0.1770 160 ILE C CD1 4010 N N . THR C 158 ? 0.7700 0.8486 0.4982 0.0968 0.0462 0.0037 161 THR C N 4011 C CA . THR C 158 ? 0.7967 0.9074 0.4857 0.1117 0.0268 -0.0289 161 THR C CA 4012 C C . THR C 158 ? 0.8116 0.9238 0.4749 0.1231 0.0040 -0.0070 161 THR C C 4013 O O . THR C 158 ? 0.7893 0.8620 0.4771 0.1183 0.0010 0.0193 161 THR C O 4014 C CB . THR C 158 ? 0.7632 0.8670 0.4902 0.1020 0.0106 -0.0806 161 THR C CB 4015 O OG1 . THR C 158 ? 0.7098 0.7785 0.4794 0.0876 -0.0065 -0.0735 161 THR C OG1 4016 C CG2 . THR C 158 ? 0.7637 0.8630 0.5226 0.1008 0.0331 -0.1010 161 THR C CG2 4017 N N . ASP C 159 ? 0.8604 1.0228 0.4750 0.1401 -0.0124 -0.0203 162 ASP C N 4018 C CA . ASP C 159 ? 0.8766 1.0610 0.4788 0.1567 -0.0402 -0.0042 162 ASP C CA 4019 C C . ASP C 159 ? 0.8239 1.0056 0.4825 0.1413 -0.0637 -0.0391 162 ASP C C 4020 O O . ASP C 159 ? 0.8004 0.9724 0.4893 0.1193 -0.0637 -0.0813 162 ASP C O 4021 C CB . ASP C 159 ? 0.9459 1.2033 0.4799 0.1777 -0.0569 -0.0101 162 ASP C CB 4022 C CG . ASP C 159 ? 0.9752 1.2647 0.4937 0.2064 -0.0826 0.0278 162 ASP C CG 4023 N N . LYS C 160 ? 0.8174 1.0061 0.4927 0.1545 -0.0798 -0.0186 163 LYS C N 4024 C CA . LYS C 160 ? 0.7712 0.9646 0.5026 0.1392 -0.0954 -0.0450 163 LYS C CA 4025 C C . LYS C 160 ? 0.7759 1.0209 0.5194 0.1196 -0.1169 -0.0989 163 LYS C C 4026 O O . LYS C 160 ? 0.8215 1.1181 0.5228 0.1260 -0.1302 -0.1181 163 LYS C O 4027 C CB . LYS C 160 ? 0.7731 0.9818 0.5213 0.1647 -0.1054 -0.0155 163 LYS C CB 4028 C CG . LYS C 160 ? 0.8178 1.1101 0.5419 0.1957 -0.1328 -0.0049 163 LYS C CG 4029 N N . CYS C 161 ? 0.7385 0.9658 0.5361 0.0927 -0.1186 -0.1239 164 CYS C N 4030 C CA . CYS C 161 ? 0.7520 1.0079 0.5737 0.0646 -0.1343 -0.1757 164 CYS C CA 4031 C C . CYS C 161 ? 0.7127 0.9685 0.5977 0.0426 -0.1374 -0.1799 164 CYS C C 4032 O O . CYS C 161 ? 0.6812 0.8825 0.5864 0.0375 -0.1187 -0.1580 164 CYS C O 4033 C CB . CYS C 161 ? 0.7672 0.9709 0.5813 0.0486 -0.1172 -0.2044 164 CYS C CB 4034 S SG . CYS C 161 ? 0.8081 0.9964 0.6681 0.0072 -0.1250 -0.2649 164 CYS C SG 4035 N N . VAL C 162 ? 0.7253 1.0502 0.6404 0.0269 -0.1609 -0.2088 165 VAL C N 4036 C CA . VAL C 162 ? 0.6963 1.0458 0.6764 0.0066 -0.1617 -0.2091 165 VAL C CA 4037 C C . VAL C 162 ? 0.7032 1.0185 0.7251 -0.0423 -0.1559 -0.2447 165 VAL C C 4038 O O . VAL C 162 ? 0.7427 1.0513 0.7550 -0.0629 -0.1654 -0.2871 165 VAL C O 4039 C CB . VAL C 162 ? 0.7080 1.1718 0.7139 0.0178 -0.1910 -0.2137 165 VAL C CB 4040 C CG1 . VAL C 162 ? 0.6775 1.1776 0.7566 0.0029 -0.1839 -0.2076 165 VAL C CG1 4041 C CG2 . VAL C 162 ? 0.7236 1.2147 0.6848 0.0716 -0.1981 -0.1732 165 VAL C CG2 4042 N N . LEU C 163 ? 0.6762 0.9655 0.7405 -0.0600 -0.1378 -0.2270 166 LEU C N 4043 C CA . LEU C 163 ? 0.6932 0.9508 0.8035 -0.1079 -0.1294 -0.2488 166 LEU C CA 4044 C C . LEU C 163 ? 0.6805 0.9945 0.8536 -0.1320 -0.1237 -0.2407 166 LEU C C 4045 O O . LEU C 163 ? 0.6503 0.9861 0.8265 -0.1088 -0.1111 -0.2080 166 LEU C O 4046 C CB . LEU C 163 ? 0.6930 0.8451 0.7871 -0.1114 -0.1056 -0.2297 166 LEU C CB 4047 C CG . LEU C 163 ? 0.6609 0.7769 0.7498 -0.1020 -0.0844 -0.1841 166 LEU C CG 4048 C CD1 . LEU C 163 ? 0.6779 0.7838 0.8115 -0.1402 -0.0695 -0.1764 166 LEU C CD1 4049 C CD2 . LEU C 163 ? 0.6593 0.6997 0.7120 -0.0853 -0.0751 -0.1656 166 LEU C CD2 4050 N N . ASP C 164 ? 0.7137 1.0495 0.9385 -0.1804 -0.1299 -0.2739 167 ASP C N 4051 C CA . ASP C 164 ? 0.7109 1.1058 1.0070 -0.2141 -0.1198 -0.2683 167 ASP C CA 4052 C C . ASP C 164 ? 0.7385 1.0421 1.0538 -0.2557 -0.0907 -0.2562 167 ASP C C 4053 O O . ASP C 164 ? 0.7865 1.0200 1.1023 -0.2843 -0.0927 -0.2825 167 ASP C O 4054 C CB . ASP C 164 ? 0.7421 1.2418 1.0929 -0.2468 -0.1504 -0.3141 167 ASP C CB 4055 C CG . ASP C 164 ? 0.7361 1.3381 1.1744 -0.2744 -0.1420 -0.3057 167 ASP C CG 4056 O OD1 . ASP C 164 ? 0.7187 1.3067 1.1694 -0.2672 -0.1079 -0.2655 167 ASP C OD1 4057 O OD2 . ASP C 164 ? 0.7547 1.4611 1.2505 -0.3045 -0.1699 -0.3419 167 ASP C OD2 4058 N N . MET C 165 ? 0.7192 1.0189 1.0445 -0.2553 -0.0620 -0.2149 168 MET C N 4059 C CA . MET C 165 ? 0.7577 0.9892 1.1035 -0.2967 -0.0331 -0.1927 168 MET C CA 4060 C C . MET C 165 ? 0.7803 1.0912 1.2108 -0.3499 -0.0255 -0.2063 168 MET C C 4061 O O . MET C 165 ? 0.7555 1.1537 1.2180 -0.3458 -0.0104 -0.1886 168 MET C O 4062 C CB . MET C 165 ? 0.7402 0.9328 1.0414 -0.2716 -0.0060 -0.1418 168 MET C CB 4063 C CG . MET C 165 ? 0.7374 0.8462 0.9679 -0.2330 -0.0136 -0.1281 168 MET C CG 4064 S SD . MET C 165 ? 0.7311 0.8196 0.8994 -0.1982 0.0047 -0.0832 168 MET C SD 4065 C CE . MET C 165 ? 0.7875 0.8104 0.9547 -0.2353 0.0311 -0.0414 168 MET C CE 4066 N N . ARG C 166 ? 0.8355 1.1170 1.3062 -0.4007 -0.0345 -0.2414 169 ARG C N 4067 C CA . ARG C 166 ? 0.8653 1.2369 1.4265 -0.4594 -0.0381 -0.2700 169 ARG C CA 4068 C C . ARG C 166 ? 0.8778 1.2796 1.4935 -0.4966 0.0033 -0.2287 169 ARG C C 4069 O O . ARG C 166 ? 0.8629 1.3948 1.5506 -0.5161 0.0049 -0.2359 169 ARG C O 4070 C CB . ARG C 166 ? 0.9445 1.2548 1.5313 -0.5122 -0.0541 -0.3228 169 ARG C CB 4071 C CG . ARG C 166 ? 0.9479 1.2620 1.4872 -0.4833 -0.0951 -0.3764 169 ARG C CG 4072 C CD . ARG C 166 ? 1.0489 1.3245 1.6233 -0.5448 -0.1101 -0.4428 169 ARG C CD 4073 N NE . ARG C 166 ? 1.0809 1.3240 1.5897 -0.5158 -0.1382 -0.4934 169 ARG C NE 4074 C CZ . ARG C 166 ? 1.1762 1.3936 1.6952 -0.5591 -0.1571 -0.5668 169 ARG C CZ 4075 N NH1 . ARG C 166 ? 1.2516 1.4673 1.8512 -0.6384 -0.1537 -0.5990 169 ARG C NH1 4076 N NH2 . ARG C 166 ? 1.2045 1.3980 1.6520 -0.5262 -0.1772 -0.6111 169 ARG C NH2 4077 N N . SER C 167 ? 0.9107 1.2016 1.4927 -0.5043 0.0371 -0.1828 170 SER C N 4078 C CA . SER C 167 ? 0.9366 1.2471 1.5530 -0.5390 0.0824 -0.1356 170 SER C CA 4079 C C . SER C 167 ? 0.8728 1.2734 1.4652 -0.4913 0.0998 -0.1073 170 SER C C 4080 O O . SER C 167 ? 0.8793 1.3729 1.5275 -0.5152 0.1302 -0.0919 170 SER C O 4081 C CB . SER C 167 ? 1.0048 1.1695 1.5783 -0.5537 0.1103 -0.0874 170 SER C CB 4082 O OG . SER C 167 ? 0.9699 1.0835 1.4504 -0.4919 0.1106 -0.0527 170 SER C OG 4083 N N . MET C 168 ? 0.8193 1.1901 1.3317 -0.4252 0.0837 -0.1032 171 MET C N 4084 C CA . MET C 168 ? 0.7720 1.2014 1.2497 -0.3748 0.0996 -0.0835 171 MET C CA 4085 C C . MET C 168 ? 0.7204 1.2816 1.2474 -0.3449 0.0813 -0.1138 171 MET C C 4086 O O . MET C 168 ? 0.6987 1.3225 1.2219 -0.3079 0.1025 -0.1009 171 MET C O 4087 C CB . MET C 168 ? 0.7520 1.0892 1.1296 -0.3228 0.0889 -0.0686 171 MET C CB 4088 C CG . MET C 168 ? 0.8013 1.0507 1.1202 -0.3318 0.1159 -0.0222 171 MET C CG 4089 S SD . MET C 168 ? 0.8263 1.1389 1.1159 -0.3165 0.1610 0.0068 171 MET C SD 4090 N N . ASP C 169 ? 0.7101 1.3126 1.2807 -0.3581 0.0419 -0.1543 172 ASP C N 4091 C CA . ASP C 169 ? 0.6676 1.3937 1.2763 -0.3222 0.0119 -0.1798 172 ASP C CA 4092 C C . ASP C 169 ? 0.6265 1.3228 1.1569 -0.2445 0.0034 -0.1667 172 ASP C C 4093 O O . ASP C 169 ? 0.6019 1.3878 1.1539 -0.1983 -0.0020 -0.1659 172 ASP C O 4094 C CB . ASP C 169 ? 0.6655 1.5401 1.3746 -0.3388 0.0332 -0.1770 172 ASP C CB 4095 C CG . ASP C 169 ? 0.6417 1.6602 1.4199 -0.3233 -0.0090 -0.2087 172 ASP C CG 4096 N N . PHE C 170 ? 0.6262 1.1947 1.0718 -0.2315 0.0029 -0.1552 173 PHE C N 4097 C CA . PHE C 170 ? 0.5995 1.1197 0.9695 -0.1707 -0.0003 -0.1410 173 PHE C CA 4098 C C . PHE C 170 ? 0.5912 1.0842 0.9249 -0.1495 -0.0395 -0.1608 173 PHE C C 4099 O O . PHE C 170 ? 0.6120 1.0596 0.9415 -0.1812 -0.0548 -0.1805 173 PHE C O 4100 C CB . PHE C 170 ? 0.6109 1.0233 0.9143 -0.1730 0.0263 -0.1124 173 PHE C CB 4101 C CG . PHE C 170 ? 0.5905 0.9538 0.8226 -0.1212 0.0261 -0.1010 173 PHE C CG 4102 C CD1 . PHE C 170 ? 0.5876 0.9915 0.8162 -0.0836 0.0460 -0.0951 173 PHE C CD1 4103 C CD2 . PHE C 170 ? 0.5845 0.8597 0.7584 -0.1116 0.0091 -0.0980 173 PHE C CD2 4104 C CE1 . PHE C 170 ? 0.5882 0.9336 0.7531 -0.0423 0.0472 -0.0890 173 PHE C CE1 4105 C CE2 . PHE C 170 ? 0.5760 0.8073 0.6920 -0.0730 0.0094 -0.0885 173 PHE C CE2 4106 C CZ . PHE C 170 ? 0.5832 0.8434 0.6929 -0.0410 0.0278 -0.0851 173 PHE C CZ 4107 N N . LYS C 171 ? 0.5739 1.0913 0.8800 -0.0946 -0.0517 -0.1547 174 LYS C N 4108 C CA . LYS C 171 ? 0.5749 1.0704 0.8354 -0.0693 -0.0832 -0.1648 174 LYS C CA 4109 C C . LYS C 171 ? 0.5687 0.9896 0.7600 -0.0235 -0.0731 -0.1389 174 LYS C C 4110 O O . LYS C 171 ? 0.5682 0.9946 0.7579 0.0065 -0.0530 -0.1204 174 LYS C O 4111 C CB . LYS C 171 ? 0.5792 1.1933 0.8791 -0.0511 -0.1158 -0.1802 174 LYS C CB 4112 C CG . LYS C 171 ? 0.5968 1.2682 0.9436 -0.1033 -0.1418 -0.2207 174 LYS C CG 4113 C CD . LYS C 171 ? 0.5937 1.4177 1.0037 -0.0936 -0.1730 -0.2338 174 LYS C CD 4114 C CE . LYS C 171 ? 0.5857 1.4980 1.0949 -0.1280 -0.1548 -0.2358 174 LYS C CE 4115 N N . SER C 172 ? 0.5740 0.9251 0.7117 -0.0205 -0.0839 -0.1405 175 SER C N 4116 C CA . SER C 172 ? 0.5744 0.8533 0.6533 0.0115 -0.0738 -0.1170 175 SER C CA 4117 C C . SER C 172 ? 0.5856 0.8397 0.6198 0.0275 -0.0913 -0.1184 175 SER C C 4118 O O . SER C 172 ? 0.5971 0.8492 0.6292 0.0056 -0.1041 -0.1415 175 SER C O 4119 C CB . SER C 172 ? 0.5723 0.7716 0.6293 -0.0102 -0.0519 -0.1058 175 SER C CB 4120 O OG . SER C 172 ? 0.5767 0.7316 0.6270 -0.0373 -0.0588 -0.1152 175 SER C OG 4121 N N . ASN C 173 ? 0.5928 0.8231 0.5907 0.0649 -0.0872 -0.0942 176 ASN C N 4122 C CA . ASN C 173 ? 0.6069 0.8065 0.5567 0.0796 -0.0939 -0.0855 176 ASN C CA 4123 C C . ASN C 173 ? 0.5951 0.7132 0.5200 0.0632 -0.0780 -0.0790 176 ASN C C 4124 O O . ASN C 173 ? 0.5825 0.6617 0.5137 0.0509 -0.0636 -0.0727 176 ASN C O 4125 C CB . ASN C 173 ? 0.6361 0.8412 0.5628 0.1245 -0.0935 -0.0548 176 ASN C CB 4126 C CG . ASN C 173 ? 0.6627 0.9628 0.6148 0.1502 -0.1153 -0.0544 176 ASN C CG 4127 O OD1 . ASN C 173 ? 0.6732 1.0428 0.6493 0.1300 -0.1370 -0.0824 176 ASN C OD1 4128 N ND2 . ASN C 173 ? 0.7009 1.0052 0.6513 0.1953 -0.1110 -0.0230 176 ASN C ND2 4129 N N . SER C 174 ? 0.6037 0.7061 0.5003 0.0639 -0.0809 -0.0808 177 SER C N 4130 C CA . SER C 174 ? 0.5957 0.6388 0.4798 0.0519 -0.0676 -0.0728 177 SER C CA 4131 C C . SER C 174 ? 0.6130 0.6542 0.4645 0.0646 -0.0637 -0.0657 177 SER C C 4132 O O . SER C 174 ? 0.6369 0.7161 0.4740 0.0701 -0.0726 -0.0843 177 SER C O 4133 C CB . SER C 174 ? 0.5847 0.6095 0.4965 0.0236 -0.0674 -0.0918 177 SER C CB 4134 O OG . SER C 174 ? 0.6014 0.6561 0.5262 0.0141 -0.0782 -0.1233 177 SER C OG 4135 N N . ALA C 175 ? 0.6102 0.6114 0.4491 0.0659 -0.0492 -0.0410 178 ALA C N 4136 C CA . ALA C 175 ? 0.6257 0.6260 0.4420 0.0718 -0.0373 -0.0297 178 ALA C CA 4137 C C . ALA C 175 ? 0.6047 0.5753 0.4447 0.0530 -0.0263 -0.0253 178 ALA C C 4138 O O . ALA C 175 ? 0.5919 0.5336 0.4492 0.0383 -0.0284 -0.0193 178 ALA C O 4139 C CB . ALA C 175 ? 0.6618 0.6543 0.4456 0.0914 -0.0287 0.0049 178 ALA C CB 4140 N N . VAL C 176 ? 0.6081 0.5942 0.4487 0.0550 -0.0147 -0.0293 179 VAL C N 4141 C CA . VAL C 176 ? 0.5867 0.5640 0.4636 0.0422 -0.0068 -0.0251 179 VAL C CA 4142 C C . VAL C 176 ? 0.6048 0.5952 0.4798 0.0417 0.0148 -0.0018 179 VAL C C 4143 O O . VAL C 176 ? 0.6400 0.6537 0.4824 0.0560 0.0292 0.0019 179 VAL C O 4144 C CB . VAL C 176 ? 0.5814 0.5669 0.4847 0.0462 -0.0085 -0.0538 179 VAL C CB 4145 C CG1 . VAL C 176 ? 0.5702 0.5600 0.5174 0.0437 -0.0003 -0.0435 179 VAL C CG1 4146 C CG2 . VAL C 176 ? 0.5689 0.5338 0.4845 0.0369 -0.0262 -0.0692 179 VAL C CG2 4147 N N . ALA C 177 ? 0.5896 0.5718 0.4988 0.0222 0.0168 0.0142 180 ALA C N 4148 C CA . ALA C 177 ? 0.6069 0.6101 0.5324 0.0126 0.0391 0.0366 180 ALA C CA 4149 C C . ALA C 177 ? 0.5832 0.6182 0.5713 0.0010 0.0378 0.0364 180 ALA C C 4150 O O . ALA C 177 ? 0.5591 0.5840 0.5709 -0.0085 0.0148 0.0310 180 ALA C O 4151 C CB . ALA C 177 ? 0.6360 0.6008 0.5445 -0.0061 0.0442 0.0629 180 ALA C CB 4152 N N . TRP C 178 ? 0.5971 0.6788 0.6122 0.0042 0.0632 0.0454 181 TRP C N 4153 C CA . TRP C 178 ? 0.5831 0.7142 0.6714 -0.0041 0.0641 0.0514 181 TRP C CA 4154 C C . TRP C 178 ? 0.6089 0.7909 0.7238 -0.0149 0.0990 0.0727 181 TRP C C 4155 O O . TRP C 178 ? 0.6449 0.8282 0.7149 -0.0039 0.1273 0.0788 181 TRP C O 4156 C CB . TRP C 178 ? 0.5724 0.7231 0.6919 0.0273 0.0600 0.0293 181 TRP C CB 4157 C CG . TRP C 178 ? 0.6030 0.7762 0.7061 0.0578 0.0915 0.0101 181 TRP C CG 4158 C CD1 . TRP C 178 ? 0.6214 0.8547 0.7706 0.0756 0.1219 0.0086 181 TRP C CD1 4159 C CD2 . TRP C 178 ? 0.6317 0.7760 0.6660 0.0739 0.0963 -0.0146 181 TRP C CD2 4160 N NE1 . TRP C 178 ? 0.6681 0.9038 0.7717 0.1023 0.1483 -0.0189 181 TRP C NE1 4161 C CE2 . TRP C 178 ? 0.6745 0.8576 0.7056 0.0995 0.1297 -0.0341 181 TRP C CE2 4162 C CE3 . TRP C 178 ? 0.6246 0.7234 0.6025 0.0695 0.0750 -0.0240 181 TRP C CE3 4163 C CZ2 . TRP C 178 ? 0.7129 0.8876 0.6765 0.1169 0.1385 -0.0663 181 TRP C CZ2 4164 C CZ3 . TRP C 178 ? 0.6543 0.7537 0.5772 0.0867 0.0811 -0.0514 181 TRP C CZ3 4165 C CH2 . TRP C 178 ? 0.7000 0.8353 0.6113 0.1082 0.1106 -0.0739 181 TRP C CH2 4166 N N . SER C 179 ? 0.5977 0.8295 0.7854 -0.0379 0.0968 0.0863 182 SER C N 4167 C CA . SER C 179 ? 0.6250 0.9162 0.8541 -0.0565 0.1324 0.1092 182 SER C CA 4168 C C . SER C 179 ? 0.6066 0.9913 0.9353 -0.0515 0.1339 0.1102 182 SER C C 4169 O O . SER C 179 ? 0.5807 0.9814 0.9553 -0.0610 0.0969 0.1079 182 SER C O 4170 C CB . SER C 179 ? 0.6529 0.9085 0.8767 -0.1077 0.1310 0.1321 182 SER C CB 4171 O OG . SER C 179 ? 0.6774 0.9993 0.9668 -0.1395 0.1597 0.1555 182 SER C OG 4172 N N . ASN C 180 ? 0.6304 1.0838 0.9912 -0.0337 0.1776 0.1153 183 ASN C N 4173 C CA . ASN C 180 ? 0.6199 1.1795 1.0898 -0.0243 0.1872 0.1200 183 ASN C CA 4174 C C . ASN C 180 ? 0.6121 1.2226 1.1577 -0.0798 0.1665 0.1427 183 ASN C C 4175 O O . ASN C 180 ? 0.5870 1.2638 1.2146 -0.0772 0.1370 0.1436 183 ASN C O 4176 C CB . ASN C 180 ? 0.6567 1.2846 1.1419 -0.0003 0.2483 0.1221 183 ASN C CB 4177 N N . LYS C 181 ? 0.6442 1.2204 1.1603 -0.1301 0.1802 0.1610 184 LYS C N 4178 C CA . LYS C 181 ? 0.6551 1.2605 1.2325 -0.1951 0.1624 0.1754 184 LYS C CA 4179 C C . LYS C 181 ? 0.6396 1.1780 1.1846 -0.2154 0.1039 0.1580 184 LYS C C 4180 O O . LYS C 181 ? 0.6079 1.1871 1.1900 -0.1989 0.0640 0.1472 184 LYS C O 4181 C CB . LYS C 181 ? 0.7155 1.2820 1.2648 -0.2412 0.2025 0.2012 184 LYS C CB 4182 N N . ASP C 183 ? 0.7821 1.2597 1.3338 -0.3687 -0.0253 0.1153 186 ASP C N 4183 C CA . ASP C 183 ? 0.8483 1.2408 1.3712 -0.4218 0.0009 0.1153 186 ASP C CA 4184 C C . ASP C 183 ? 0.8602 1.1190 1.2744 -0.3867 0.0243 0.1158 186 ASP C C 4185 O O . ASP C 183 ? 0.9238 1.0926 1.3027 -0.4153 0.0498 0.1224 186 ASP C O 4186 C CB . ASP C 183 ? 0.8729 1.3344 1.4765 -0.4525 0.0467 0.1444 186 ASP C CB 4187 N N . PHE C 184 ? 0.8055 1.0538 1.1732 -0.3248 0.0146 0.1105 187 PHE C N 4188 C CA . PHE C 184 ? 0.8057 0.9529 1.0808 -0.2865 0.0299 0.1093 187 PHE C CA 4189 C C . PHE C 184 ? 0.7939 0.8874 1.0134 -0.2760 -0.0082 0.0815 187 PHE C C 4190 O O . PHE C 184 ? 0.7482 0.8842 0.9739 -0.2473 -0.0340 0.0741 187 PHE C O 4191 C CB . PHE C 184 ? 0.7642 0.9474 1.0316 -0.2285 0.0542 0.1215 187 PHE C CB 4192 C CG . PHE C 184 ? 0.7506 0.8567 0.9319 -0.1864 0.0570 0.1143 187 PHE C CG 4193 C CD1 . PHE C 184 ? 0.7919 0.8256 0.9165 -0.1854 0.0822 0.1296 187 PHE C CD1 4194 C CD2 . PHE C 184 ? 0.7010 0.8115 0.8637 -0.1476 0.0345 0.0959 187 PHE C CD2 4195 C CE1 . PHE C 184 ? 0.7844 0.7667 0.8397 -0.1451 0.0803 0.1239 187 PHE C CE1 4196 C CE2 . PHE C 184 ? 0.6853 0.7390 0.7803 -0.1148 0.0358 0.0872 187 PHE C CE2 4197 C CZ . PHE C 184 ? 0.7271 0.7249 0.7708 -0.1127 0.0565 0.0998 187 PHE C CZ 4198 N N . ALA C 185 ? 0.8440 0.8411 1.0098 -0.2977 -0.0074 0.0684 188 ALA C N 4199 C CA . ALA C 185 ? 0.8456 0.7904 0.9537 -0.2904 -0.0356 0.0397 188 ALA C CA 4200 C C . ALA C 185 ? 0.8215 0.7112 0.8674 -0.2376 -0.0225 0.0418 188 ALA C C 4201 O O . ALA C 185 ? 0.8386 0.6914 0.8654 -0.2186 0.0073 0.0607 188 ALA C O 4202 C CB . ALA C 185 ? 0.9257 0.7972 1.0121 -0.3404 -0.0398 0.0153 188 ALA C CB 4203 N N . CYS C 186 ? 0.7875 0.6783 0.8027 -0.2159 -0.0457 0.0252 189 CYS C N 4204 C CA . CYS C 186 ? 0.7696 0.6184 0.7357 -0.1734 -0.0359 0.0234 189 CYS C CA 4205 C C . CYS C 186 ? 0.8177 0.5780 0.7350 -0.1750 -0.0233 0.0112 189 CYS C C 4206 O O . CYS C 186 ? 0.8153 0.5446 0.7038 -0.1396 -0.0086 0.0180 189 CYS C O 4207 C CB . CYS C 186 ? 0.7295 0.6100 0.6868 -0.1522 -0.0585 0.0149 189 CYS C CB 4208 S SG . CYS C 186 ? 0.7034 0.6589 0.7118 -0.1232 -0.0588 0.0323 189 CYS C SG 4209 N N . ALA C 187 ? 0.8704 0.5925 0.7817 -0.2152 -0.0297 -0.0089 190 ALA C N 4210 C CA . ALA C 187 ? 0.9378 0.5614 0.8100 -0.2175 -0.0114 -0.0231 190 ALA C CA 4211 C C . ALA C 187 ? 0.9662 0.5438 0.8458 -0.2061 0.0205 0.0097 190 ALA C C 4212 O O . ALA C 187 ? 0.9995 0.5133 0.8467 -0.1728 0.0384 0.0164 190 ALA C O 4213 C CB . ALA C 187 ? 1.0122 0.6002 0.8779 -0.2704 -0.0236 -0.0585 190 ALA C CB 4214 N N . ASN C 188 ? 0.9563 0.5730 0.8797 -0.2309 0.0290 0.0344 191 ASN C N 4215 C CA . ASN C 188 ? 0.9987 0.5778 0.9234 -0.2229 0.0627 0.0740 191 ASN C CA 4216 C C . ASN C 188 ? 0.9451 0.6059 0.8873 -0.1978 0.0733 0.1062 191 ASN C C 4217 O O . ASN C 188 ? 0.9547 0.6560 0.9371 -0.2242 0.0897 0.1283 191 ASN C O 4218 C CB . ASN C 188 ? 1.0866 0.6065 1.0372 -0.2801 0.0792 0.0773 191 ASN C CB 4219 C CG . ASN C 188 ? 1.1649 0.5624 1.0785 -0.2863 0.0857 0.0526 191 ASN C CG 4220 O OD1 . ASN C 188 ? 1.1921 0.5180 1.0692 -0.2428 0.1056 0.0716 191 ASN C OD1 4221 N ND2 . ASN C 188 ? 1.1985 0.5750 1.1204 -0.3371 0.0681 0.0076 191 ASN C ND2 4222 N N . ALA C 189 ? 0.8977 0.5839 0.8095 -0.1480 0.0656 0.1048 192 ALA C N 4223 C CA . ALA C 189 ? 0.8547 0.6116 0.7685 -0.1184 0.0733 0.1221 192 ALA C CA 4224 C C . ALA C 189 ? 0.8883 0.6142 0.7508 -0.0756 0.0869 0.1457 192 ALA C C 4225 O O . ALA C 189 ? 0.9269 0.6647 0.7756 -0.0668 0.1110 0.1803 192 ALA C O 4226 C CB . ALA C 189 ? 0.7763 0.5926 0.7019 -0.1019 0.0473 0.0942 192 ALA C CB 4227 N N . PHE C 190 ? 0.8814 0.5753 0.7158 -0.0486 0.0717 0.1294 193 PHE C N 4228 C CA . PHE C 190 ? 0.9141 0.5913 0.7075 -0.0040 0.0772 0.1515 193 PHE C CA 4229 C C . PHE C 190 ? 1.0138 0.6003 0.7907 -0.0034 0.0998 0.1853 193 PHE C C 4230 O O . PHE C 190 ? 1.0550 0.6053 0.8049 0.0361 0.1009 0.2012 193 PHE C O 4231 C CB . PHE C 190 ? 0.8683 0.5617 0.6528 0.0241 0.0542 0.1222 193 PHE C CB 4232 C CG . PHE C 190 ? 0.7937 0.5619 0.5929 0.0243 0.0360 0.0954 193 PHE C CG 4233 C CD1 . PHE C 190 ? 0.7545 0.5336 0.5815 -0.0018 0.0223 0.0675 193 PHE C CD1 4234 C CD2 . PHE C 190 ? 0.7837 0.6081 0.5661 0.0503 0.0322 0.0981 193 PHE C CD2 4235 C CE1 . PHE C 190 ? 0.6861 0.5196 0.5297 0.0010 0.0084 0.0483 193 PHE C CE1 4236 C CE2 . PHE C 190 ? 0.7215 0.5986 0.5199 0.0484 0.0185 0.0686 193 PHE C CE2 4237 C CZ . PHE C 190 ? 0.6731 0.5488 0.5050 0.0253 0.0084 0.0468 193 PHE C CZ 4238 N N . ASN C 191 ? 1.0608 0.6130 0.8606 -0.0476 0.1188 0.1985 194 ASN C N 4239 C CA . ASN C 191 ? 1.1729 0.6212 0.9655 -0.0596 0.1445 0.2290 194 ASN C CA 4240 C C . ASN C 191 ? 1.2463 0.6729 0.9994 -0.0200 0.1666 0.2905 194 ASN C C 4241 O O . ASN C 191 ? 1.3522 0.6781 1.0946 -0.0178 0.1889 0.3241 194 ASN C O 4242 C CB . ASN C 191 ? 1.2060 0.6365 1.0420 -0.1269 0.1591 0.2275 194 ASN C CB 4243 C CG . ASN C 191 ? 1.1881 0.6994 1.0433 -0.1427 0.1776 0.2598 194 ASN C CG 4244 O OD1 . ASN C 191 ? 1.2620 0.7386 1.1190 -0.1623 0.2110 0.3057 194 ASN C OD1 4245 N ND2 . ASN C 191 ? 1.0995 0.7157 0.9700 -0.1334 0.1602 0.2369 194 ASN C ND2 4246 N N . ASN C 192 ? 1.2045 0.7213 0.9322 0.0114 0.1603 0.3051 195 ASN C N 4247 C CA . ASN C 192 ? 1.2779 0.7937 0.9552 0.0522 0.1755 0.3650 195 ASN C CA 4248 C C . ASN C 192 ? 1.2718 0.8058 0.9166 0.1145 0.1500 0.3653 195 ASN C C 4249 O O . ASN C 192 ? 1.3439 0.8755 0.9450 0.1562 0.1552 0.4177 195 ASN C O 4250 C CB . ASN C 192 ? 1.2648 0.8703 0.9239 0.0453 0.1903 0.3849 195 ASN C CB 4251 C CG . ASN C 192 ? 1.3798 0.9558 0.9932 0.0569 0.2244 0.4612 195 ASN C CG 4252 O OD1 . ASN C 192 ? 1.4502 0.9782 1.0230 0.0998 0.2227 0.5034 195 ASN C OD1 4253 N ND2 . ASN C 192 ? 1.4048 1.0143 1.0269 0.0210 0.2575 0.4838 195 ASN C ND2 4254 N N . SER C 193 ? 1.1904 0.7495 0.8591 0.1197 0.1223 0.3102 196 SER C N 4255 C CA . SER C 193 ? 1.1788 0.7639 0.8361 0.1717 0.0985 0.3037 196 SER C CA 4256 C C . SER C 193 ? 1.2394 0.7266 0.9112 0.1914 0.1069 0.3065 196 SER C C 4257 O O . SER C 193 ? 1.2863 0.6797 0.9739 0.1575 0.1280 0.3018 196 SER C O 4258 C CB . SER C 193 ? 1.0684 0.7360 0.7475 0.1644 0.0699 0.2449 196 SER C CB 4259 O OG . SER C 193 ? 1.0257 0.7675 0.6961 0.1464 0.0666 0.2346 196 SER C OG 4260 N N . ILE C 194 ? 1.2459 0.7583 0.9155 0.2462 0.0910 0.3116 197 ILE C N 4261 C CA . ILE C 194 ? 1.2915 0.7278 0.9828 0.2732 0.0994 0.3009 197 ILE C CA 4262 C C . ILE C 194 ? 1.1990 0.6741 0.9204 0.2520 0.0853 0.2323 197 ILE C C 4263 O O . ILE C 194 ? 1.1341 0.7043 0.8680 0.2725 0.0620 0.2128 197 ILE C O 4264 C CB . ILE C 194 ? 1.3479 0.8037 1.0335 0.3490 0.0912 0.3438 197 ILE C CB 4265 N N . ILE C 195 ? 1.2013 0.6066 0.9324 0.2061 0.0989 0.1971 198 ILE C N 4266 C CA . ILE C 195 ? 1.1318 0.5638 0.8799 0.1837 0.0890 0.1380 198 ILE C CA 4267 C C . ILE C 195 ? 1.1867 0.5664 0.9435 0.2207 0.1032 0.1183 198 ILE C C 4268 O O . ILE C 195 ? 1.2916 0.5663 1.0428 0.2391 0.1271 0.1348 198 ILE C O 4269 C CB . ILE C 195 ? 1.1173 0.5146 0.8665 0.1172 0.0920 0.1083 198 ILE C CB 4270 N N . PRO C 196 ? 1.1249 0.5751 0.8980 0.2328 0.0928 0.0836 199 PRO C N 4271 C CA . PRO C 196 ? 1.1763 0.5903 0.9603 0.2671 0.1120 0.0576 199 PRO C CA 4272 C C . PRO C 196 ? 1.2533 0.5523 1.0156 0.2335 0.1355 0.0185 199 PRO C C 4273 O O . PRO C 196 ? 1.2469 0.5164 0.9922 0.1753 0.1298 0.0067 199 PRO C O 4274 C CB . PRO C 196 ? 1.0834 0.6085 0.8873 0.2633 0.0974 0.0265 199 PRO C CB 4275 C CG . PRO C 196 ? 0.9983 0.6166 0.8096 0.2528 0.0683 0.0491 199 PRO C CG 4276 C CD . PRO C 196 ? 1.0149 0.5830 0.8005 0.2189 0.0666 0.0702 199 PRO C CD 4277 N N . GLU C 197 ? 1.3337 0.5732 1.0987 0.2705 0.1616 -0.0046 200 GLU C N 4278 C CA . GLU C 197 ? 1.4212 0.5520 1.1582 0.2386 0.1844 -0.0548 200 GLU C CA 4279 C C . GLU C 197 ? 1.3584 0.5516 1.0748 0.1949 0.1742 -0.1076 200 GLU C C 4280 O O . GLU C 197 ? 1.3763 0.5322 1.0630 0.1355 0.1677 -0.1386 200 GLU C O 4281 C CB . GLU C 197 ? 1.5420 0.5814 1.2859 0.2987 0.2210 -0.0672 200 GLU C CB 4282 N N . ASP C 198 ? 1.2893 0.5846 1.0239 0.2231 0.1713 -0.1129 201 ASP C N 4283 C CA . ASP C 198 ? 1.2427 0.5992 0.9560 0.1903 0.1677 -0.1535 201 ASP C CA 4284 C C . ASP C 198 ? 1.1310 0.5705 0.8450 0.1425 0.1323 -0.1375 201 ASP C C 4285 O O . ASP C 198 ? 1.0684 0.5922 0.7863 0.1335 0.1253 -0.1447 201 ASP C O 4286 C CB . ASP C 198 ? 1.2342 0.6619 0.9741 0.2395 0.1877 -0.1636 201 ASP C CB 4287 C CG . ASP C 198 ? 1.1638 0.6843 0.9613 0.2813 0.1722 -0.1170 201 ASP C CG 4288 N N . THR C 199 ? 1.1145 0.5269 0.8282 0.1128 0.1142 -0.1141 202 THR C N 4289 C CA . THR C 199 ? 1.0187 0.5023 0.7401 0.0760 0.0843 -0.0977 202 THR C CA 4290 C C . THR C 199 ? 1.0231 0.5038 0.7127 0.0230 0.0731 -0.1292 202 THR C C 4291 O O . THR C 199 ? 1.0998 0.5072 0.7611 -0.0009 0.0811 -0.1576 202 THR C O 4292 C CB . THR C 199 ? 1.0050 0.4766 0.7426 0.0704 0.0740 -0.0584 202 THR C CB 4293 O OG1 . THR C 199 ? 1.0290 0.4885 0.7819 0.1224 0.0853 -0.0271 202 THR C OG1 4294 C CG2 . THR C 199 ? 0.9046 0.4631 0.6590 0.0513 0.0486 -0.0420 202 THR C CG2 4295 N N . PHE C 200 ? 0.9483 0.5080 0.6423 0.0052 0.0534 -0.1236 203 PHE C N 4296 C CA . PHE C 200 ? 0.9535 0.5284 0.6153 -0.0372 0.0384 -0.1444 203 PHE C CA 4297 C C . PHE C 200 ? 0.9209 0.5091 0.5985 -0.0735 0.0117 -0.1276 203 PHE C C 4298 O O . PHE C 200 ? 0.8482 0.4853 0.5599 -0.0684 -0.0011 -0.0984 203 PHE C O 4299 C CB . PHE C 200 ? 0.9112 0.5572 0.5685 -0.0329 0.0368 -0.1416 203 PHE C CB 4300 C CG . PHE C 200 ? 0.9326 0.5995 0.5475 -0.0704 0.0211 -0.1535 203 PHE C CG 4301 C CD1 . PHE C 200 ? 1.0143 0.6372 0.5783 -0.0970 0.0201 -0.1889 203 PHE C CD1 4302 C CD2 . PHE C 200 ? 0.8816 0.6108 0.5045 -0.0789 0.0066 -0.1289 203 PHE C CD2 4303 C CE1 . PHE C 200 ? 1.0367 0.6921 0.5543 -0.1302 0.0000 -0.1971 203 PHE C CE1 4304 C CE2 . PHE C 200 ? 0.9088 0.6604 0.4883 -0.1080 -0.0097 -0.1297 203 PHE C CE2 4305 C CZ . PHE C 200 ? 0.9817 0.7036 0.5061 -0.1327 -0.0152 -0.1629 203 PHE C CZ 4306 N N . PHE C 201 ? 0.9844 0.5310 0.6399 -0.1105 0.0051 -0.1507 204 PHE C N 4307 C CA . PHE C 201 ? 0.9687 0.5341 0.6501 -0.1479 -0.0180 -0.1376 204 PHE C CA 4308 C C . PHE C 201 ? 0.9976 0.5975 0.6517 -0.1898 -0.0458 -0.1588 204 PHE C C 4309 O O . PHE C 201 ? 1.0715 0.6319 0.7039 -0.2268 -0.0509 -0.1914 204 PHE C O 4310 C CB . PHE C 201 ? 1.0276 0.5185 0.7227 -0.1623 -0.0036 -0.1399 204 PHE C CB 4311 C CG . PHE C 201 ? 0.9886 0.4690 0.7165 -0.1283 0.0133 -0.1008 204 PHE C CG 4312 C CD1 . PHE C 201 ? 1.0342 0.4463 0.7521 -0.0915 0.0406 -0.0978 204 PHE C CD1 4313 C CD2 . PHE C 201 ? 0.9174 0.4589 0.6833 -0.1298 0.0027 -0.0664 204 PHE C CD2 4314 C CE1 . PHE C 201 ? 1.0182 0.4283 0.7577 -0.0583 0.0522 -0.0563 204 PHE C CE1 4315 C CE2 . PHE C 201 ? 0.9074 0.4451 0.6899 -0.0993 0.0181 -0.0321 204 PHE C CE2 4316 C CZ . PHE C 201 ? 0.9553 0.4298 0.7215 -0.0644 0.0405 -0.0245 204 PHE C CZ 4317 N N . PRO C 202 ? 0.9449 0.6177 0.6002 -0.1852 -0.0653 -0.1391 205 PRO C N 4318 C CA . PRO C 202 ? 0.9740 0.6942 0.5984 -0.2150 -0.0954 -0.1467 205 PRO C CA 4319 C C . PRO C 202 ? 0.9808 0.7369 0.6416 -0.2527 -0.1265 -0.1413 205 PRO C C 4320 O O . PRO C 202 ? 0.9186 0.7087 0.6416 -0.2445 -0.1311 -0.1092 205 PRO C O 4321 C CB . PRO C 202 ? 0.9095 0.6869 0.5447 -0.1901 -0.1018 -0.1105 205 PRO C CB 4322 C CG . PRO C 202 ? 0.8648 0.6206 0.5237 -0.1529 -0.0725 -0.1006 205 PRO C CG 4323 C CD . PRO C 202 ? 0.8638 0.5756 0.5516 -0.1502 -0.0601 -0.1055 205 PRO C CD 4324 N N . SER C 203 ? 1.0654 0.8208 0.6891 -0.2946 -0.1469 -0.1760 206 SER C N 4325 C CA . SER C 203 ? 1.0802 0.8924 0.7442 -0.3363 -0.1830 -0.1731 206 SER C CA 4326 C C . SER C 203 ? 1.0191 0.9284 0.7188 -0.3195 -0.2129 -0.1264 206 SER C C 4327 O O . SER C 203 ? 1.0166 0.9470 0.6751 -0.2967 -0.2180 -0.1109 206 SER C O 4328 C CB . SER C 203 ? 1.1864 0.9922 0.7940 -0.3870 -0.2063 -0.2248 206 SER C CB 4329 O OG . SER C 203 ? 1.2499 0.9749 0.8673 -0.4194 -0.1876 -0.2628 206 SER C OG 4330 N N . PRO C 204 ? 0.9797 0.9460 0.7599 -0.3285 -0.2282 -0.1014 207 PRO C N 4331 C CA . PRO C 204 ? 0.9213 0.9708 0.7500 -0.3020 -0.2500 -0.0553 207 PRO C CA 4332 C C . PRO C 204 ? 0.9593 1.1031 0.7989 -0.3301 -0.3016 -0.0497 207 PRO C C 4333 O O . PRO C 204 ? 0.9830 1.1612 0.7776 -0.3176 -0.3260 -0.0328 207 PRO C O 4334 C CB . PRO C 204 ? 0.8617 0.9204 0.7746 -0.2895 -0.2284 -0.0350 207 PRO C CB 4335 C CG . PRO C 204 ? 0.9066 0.9090 0.8218 -0.3291 -0.2092 -0.0667 207 PRO C CG 4336 C CD . PRO C 204 ? 0.9893 0.9407 0.8256 -0.3601 -0.2182 -0.1117 207 PRO C CD 4337 N N . ALA D 3 ? 1.4769 1.5987 1.2638 -0.8580 -0.1215 0.2588 3 ALA D N 4338 C CA . ALA D 3 ? 1.4093 1.5217 1.1616 -0.7756 -0.1149 0.2411 3 ALA D CA 4339 C C . ALA D 3 ? 1.3666 1.3680 1.1248 -0.6922 -0.1604 0.2109 3 ALA D C 4340 O O . ALA D 3 ? 1.4338 1.3171 1.1835 -0.6991 -0.2077 0.2187 3 ALA D O 4341 C CB . ALA D 3 ? 1.5132 1.5702 1.1618 -0.8072 -0.1168 0.2972 3 ALA D CB 4342 N N . VAL D 4 ? 1.2643 1.3067 1.0372 -0.6161 -0.1442 0.1736 4 VAL D N 4343 C CA . VAL D 4 ? 1.2263 1.1831 1.0008 -0.5384 -0.1774 0.1458 4 VAL D CA 4344 C C . VAL D 4 ? 1.2476 1.1572 0.9641 -0.5037 -0.1877 0.1617 4 VAL D C 4345 O O . VAL D 4 ? 1.2235 1.2106 0.9236 -0.5082 -0.1549 0.1650 4 VAL D O 4346 C CB . VAL D 4 ? 1.0987 1.1374 0.9410 -0.4797 -0.1540 0.0896 4 VAL D CB 4347 C CG1 . VAL D 4 ? 1.0767 1.0299 0.9171 -0.4123 -0.1853 0.0637 4 VAL D CG1 4348 C CG2 . VAL D 4 ? 1.0737 1.1901 0.9792 -0.5115 -0.1422 0.0717 4 VAL D CG2 4349 N N . THR D 5 ? 1.3000 1.0877 0.9884 -0.4665 -0.2357 0.1667 5 THR D N 4350 C CA . THR D 5 ? 1.3316 1.0740 0.9726 -0.4303 -0.2562 0.1811 5 THR D CA 4351 C C . THR D 5 ? 1.2735 0.9895 0.9473 -0.3481 -0.2737 0.1380 5 THR D C 4352 O O . THR D 5 ? 1.2830 0.9398 0.9789 -0.3234 -0.2968 0.1159 5 THR D O 4353 C CB . THR D 5 ? 1.4897 1.1036 1.0544 -0.4654 -0.3059 0.2383 5 THR D CB 4354 O OG1 . THR D 5 ? 1.5655 1.1593 1.1179 -0.5460 -0.3037 0.2712 5 THR D OG1 4355 C CG2 . THR D 5 ? 1.5359 1.1652 1.0354 -0.4736 -0.3053 0.2731 5 THR D CG2 4356 N N . GLN D 6 ? 1.2212 0.9875 0.8977 -0.3092 -0.2612 0.1237 6 GLN D N 4357 C CA . GLN D 6 ? 1.1694 0.9311 0.8813 -0.2383 -0.2713 0.0844 6 GLN D CA 4358 C C . GLN D 6 ? 1.2300 0.9493 0.9103 -0.2082 -0.3092 0.0999 6 GLN D C 4359 O O . GLN D 6 ? 1.2600 1.0043 0.8993 -0.2325 -0.3079 0.1274 6 GLN D O 4360 C CB . GLN D 6 ? 1.0475 0.9183 0.8073 -0.2175 -0.2227 0.0460 6 GLN D CB 4361 C CG . GLN D 6 ? 0.9895 0.9119 0.7844 -0.2361 -0.1887 0.0277 6 GLN D CG 4362 C CD . GLN D 6 ? 0.8985 0.9058 0.7321 -0.2114 -0.1483 -0.0061 6 GLN D CD 4363 O OE1 . GLN D 6 ? 0.8632 0.9294 0.7192 -0.2281 -0.1190 -0.0162 6 GLN D OE1 4364 N NE2 . GLN D 6 ? 0.8693 0.8827 0.7144 -0.1718 -0.1491 -0.0246 6 GLN D NE2 4365 N N . SER D 7 ? 1.2558 0.9164 0.9545 -0.1523 -0.3448 0.0790 7 SER D N 4366 C CA . SER D 7 ? 1.2960 0.9405 0.9887 -0.1066 -0.3817 0.0797 7 SER D CA 4367 C C . SER D 7 ? 1.2276 0.9145 0.9883 -0.0394 -0.3753 0.0244 7 SER D C 4368 O O . SER D 7 ? 1.2238 0.8805 1.0073 -0.0181 -0.3737 -0.0029 7 SER D O 4369 C CB . SER D 7 ? 1.4489 0.9601 1.0830 -0.1061 -0.4480 0.1210 7 SER D CB 4370 O OG . SER D 7 ? 1.4954 0.9302 1.1555 -0.0505 -0.4845 0.0916 7 SER D OG 4371 N N . PRO D 8 ? 1.1800 0.9440 0.9721 -0.0099 -0.3701 0.0062 8 PRO D N 4372 C CA . PRO D 8 ? 1.1944 0.9956 0.9552 -0.0315 -0.3774 0.0321 8 PRO D CA 4373 C C . PRO D 8 ? 1.1177 0.9964 0.8708 -0.0828 -0.3222 0.0338 8 PRO D C 4374 O O . PRO D 8 ? 1.0544 0.9567 0.8320 -0.0977 -0.2818 0.0170 8 PRO D O 4375 C CB . PRO D 8 ? 1.1628 1.0301 0.9813 0.0228 -0.3903 -0.0033 8 PRO D CB 4376 C CG . PRO D 8 ? 1.0818 0.9945 0.9677 0.0512 -0.3537 -0.0508 8 PRO D CG 4377 C CD . PRO D 8 ? 1.1118 0.9421 0.9747 0.0431 -0.3535 -0.0454 8 PRO D CD 4378 N N . ARG D 9 ? 1.1348 1.0500 0.8506 -0.1056 -0.3247 0.0516 9 ARG D N 4379 C CA . ARG D 9 ? 1.0710 1.0648 0.7818 -0.1441 -0.2748 0.0423 9 ARG D CA 4380 C C . ARG D 9 ? 0.9855 1.0635 0.7544 -0.1200 -0.2524 -0.0027 9 ARG D C 4381 O O . ARG D 9 ? 0.9106 1.0371 0.7094 -0.1318 -0.2066 -0.0282 9 ARG D O 4382 C CB . ARG D 9 ? 1.1522 1.1425 0.7800 -0.1880 -0.2841 0.0819 9 ARG D CB 4383 C CG . ARG D 9 ? 1.2148 1.1563 0.7908 -0.2393 -0.2765 0.1237 9 ARG D CG 4384 C CD . ARG D 9 ? 1.1394 1.1568 0.7383 -0.2734 -0.2153 0.1040 9 ARG D CD 4385 N N . ASN D 10 ? 1.0050 1.0974 0.7912 -0.0874 -0.2885 -0.0119 10 ASN D N 4386 C CA . ASN D 10 ? 0.9339 1.1068 0.7862 -0.0680 -0.2733 -0.0549 10 ASN D CA 4387 C C . ASN D 10 ? 0.9337 1.1126 0.8473 -0.0161 -0.3024 -0.0745 10 ASN D C 4388 O O . ASN D 10 ? 1.0100 1.1340 0.9035 0.0119 -0.3528 -0.0546 10 ASN D O 4389 C CB . ASN D 10 ? 0.9568 1.1798 0.7814 -0.0858 -0.2854 -0.0585 10 ASN D CB 4390 C CG . ASN D 10 ? 0.9308 1.1800 0.7197 -0.1290 -0.2417 -0.0638 10 ASN D CG 4391 N N . LYS D 11 ? 0.8589 1.1035 0.8458 -0.0033 -0.2706 -0.1137 11 LYS D N 4392 C CA . LYS D 11 ? 0.8537 1.1323 0.9103 0.0451 -0.2871 -0.1411 11 LYS D CA 4393 C C . LYS D 11 ? 0.7896 1.1725 0.9231 0.0408 -0.2565 -0.1801 11 LYS D C 4394 O O . LYS D 11 ? 0.7353 1.1372 0.8782 0.0104 -0.2063 -0.1905 11 LYS D O 4395 C CB . LYS D 11 ? 0.8528 1.0797 0.9154 0.0700 -0.2758 -0.1456 11 LYS D CB 4396 N N . VAL D 12 ? 0.8054 1.2539 0.9945 0.0703 -0.2904 -0.2002 12 VAL D N 4397 C CA . VAL D 12 ? 0.7543 1.3140 1.0319 0.0651 -0.2646 -0.2393 12 VAL D CA 4398 C C . VAL D 12 ? 0.7474 1.3528 1.0964 0.1127 -0.2575 -0.2679 12 VAL D C 4399 O O . VAL D 12 ? 0.7983 1.4031 1.1686 0.1666 -0.3058 -0.2742 12 VAL D O 4400 C CB . VAL D 12 ? 0.7753 1.4061 1.0820 0.0606 -0.3051 -0.2513 12 VAL D CB 4401 N N . ALA D 13 ? 0.6972 1.3391 1.0775 0.0949 -0.1983 -0.2856 13 ALA D N 4402 C CA . ALA D 13 ? 0.6949 1.3855 1.1305 0.1357 -0.1789 -0.3157 13 ALA D CA 4403 C C . ALA D 13 ? 0.6589 1.4857 1.1864 0.1165 -0.1370 -0.3503 13 ALA D C 4404 O O . ALA D 13 ? 0.6293 1.4848 1.1637 0.0592 -0.1090 -0.3458 13 ALA D O 4405 C CB . ALA D 13 ? 0.6916 1.2993 1.0674 0.1349 -0.1460 -0.3038 13 ALA D CB 4406 N N . VAL D 14 ? 0.6707 1.5808 1.2693 0.1634 -0.1325 -0.3867 14 VAL D N 4407 C CA . VAL D 14 ? 0.6462 1.7049 1.3406 0.1444 -0.0872 -0.4217 14 VAL D CA 4408 C C . VAL D 14 ? 0.6380 1.6951 1.3064 0.1245 -0.0173 -0.4239 14 VAL D C 4409 O O . VAL D 14 ? 0.6603 1.6351 1.2676 0.1578 -0.0158 -0.4191 14 VAL D O 4410 C CB . VAL D 14 ? 0.6710 1.8506 1.4701 0.2114 -0.1178 -0.4683 14 VAL D CB 4411 C CG1 . VAL D 14 ? 0.6437 1.9998 1.5585 0.1758 -0.0854 -0.5010 14 VAL D CG1 4412 C CG2 . VAL D 14 ? 0.7124 1.8420 1.5024 0.2600 -0.2039 -0.4593 14 VAL D CG2 4413 N N . THR D 15 ? 0.6193 1.7631 1.3288 0.0670 0.0375 -0.4297 15 THR D N 4414 C CA . THR D 15 ? 0.6288 1.7853 1.3112 0.0430 0.1059 -0.4290 15 THR D CA 4415 C C . THR D 15 ? 0.6580 1.8849 1.3748 0.1094 0.1177 -0.4707 15 THR D C 4416 O O . THR D 15 ? 0.6626 2.0255 1.4830 0.1422 0.1112 -0.5131 15 THR D O 4417 C CB . THR D 15 ? 0.6240 1.8732 1.3551 -0.0348 0.1593 -0.4274 15 THR D CB 4418 O OG1 . THR D 15 ? 0.6104 1.7833 1.3084 -0.0901 0.1427 -0.3966 15 THR D OG1 4419 C CG2 . THR D 15 ? 0.6521 1.8976 1.3327 -0.0660 0.2290 -0.4157 15 THR D CG2 4420 N N . GLY D 16 ? 0.6840 1.8205 1.3155 0.1322 0.1318 -0.4632 16 GLY D N 4421 C CA . GLY D 16 ? 0.7273 1.9075 1.3717 0.1994 0.1409 -0.5075 16 GLY D CA 4422 C C . GLY D 16 ? 0.7562 1.8566 1.3928 0.2783 0.0689 -0.5228 16 GLY D C 4423 O O . GLY D 16 ? 0.8037 1.9277 1.4559 0.3454 0.0638 -0.5671 16 GLY D O 4424 N N . GLY D 17 ? 0.7416 1.7436 1.3492 0.2691 0.0132 -0.4867 17 GLY D N 4425 C CA . GLY D 17 ? 0.7866 1.6900 1.3717 0.3309 -0.0597 -0.4872 17 GLY D CA 4426 C C . GLY D 17 ? 0.8173 1.5660 1.2946 0.3325 -0.0689 -0.4633 17 GLY D C 4427 O O . GLY D 17 ? 0.7929 1.5052 1.2098 0.2830 -0.0263 -0.4393 17 GLY D O 4428 N N . LYS D 18 ? 0.8810 1.5356 1.3353 0.3890 -0.1290 -0.4697 18 LYS D N 4429 C CA . LYS D 18 ? 0.9224 1.4303 1.2829 0.3899 -0.1457 -0.4515 18 LYS D CA 4430 C C . LYS D 18 ? 0.9262 1.3148 1.2291 0.3564 -0.1926 -0.3957 18 LYS D C 4431 O O . LYS D 18 ? 0.9808 1.3131 1.2861 0.3887 -0.2548 -0.3869 18 LYS D O 4432 C CB . LYS D 18 ? 1.0111 1.4787 1.3747 0.4693 -0.1779 -0.4995 18 LYS D CB 4433 N N . VAL D 19 ? 0.8783 1.2316 1.1276 0.2923 -0.1623 -0.3579 19 VAL D N 4434 C CA . VAL D 19 ? 0.8784 1.1389 1.0727 0.2531 -0.1931 -0.3079 19 VAL D CA 4435 C C . VAL D 19 ? 0.9143 1.0603 1.0360 0.2417 -0.2024 -0.2922 19 VAL D C 4436 O O . VAL D 19 ? 0.9011 1.0512 1.0020 0.2351 -0.1664 -0.3066 19 VAL D O 4437 C CB . VAL D 19 ? 0.8037 1.1129 0.9984 0.1914 -0.1576 -0.2813 19 VAL D CB 4438 N N . THR D 20 ? 0.9695 1.0154 1.0508 0.2359 -0.2527 -0.2611 20 THR D N 4439 C CA . THR D 20 ? 1.0155 0.9524 1.0353 0.2170 -0.2693 -0.2440 20 THR D CA 4440 C C . THR D 20 ? 1.0111 0.9032 0.9901 0.1599 -0.2819 -0.1907 20 THR D C 4441 O O . THR D 20 ? 1.0388 0.9220 1.0152 0.1573 -0.3126 -0.1664 20 THR D O 4442 C CB . THR D 20 ? 1.1272 0.9662 1.1338 0.2676 -0.3257 -0.2623 20 THR D CB 4443 O OG1 . THR D 20 ? 1.1437 1.0470 1.2073 0.3346 -0.3275 -0.3123 20 THR D OG1 4444 C CG2 . THR D 20 ? 1.1686 0.9271 1.1296 0.2594 -0.3278 -0.2737 20 THR D CG2 4445 N N . LEU D 21 ? 0.9845 0.8567 0.9313 0.1158 -0.2586 -0.1745 21 LEU D N 4446 C CA . LEU D 21 ? 0.9818 0.8298 0.8946 0.0598 -0.2619 -0.1297 21 LEU D CA 4447 C C . LEU D 21 ? 1.0505 0.8036 0.9219 0.0348 -0.2882 -0.1125 21 LEU D C 4448 O O . LEU D 21 ? 1.0254 0.7812 0.8923 0.0191 -0.2684 -0.1229 21 LEU D O 4449 C CB . LEU D 21 ? 0.8888 0.8157 0.8129 0.0250 -0.2105 -0.1263 21 LEU D CB 4450 C CG . LEU D 21 ? 0.8220 0.8360 0.7827 0.0299 -0.1837 -0.1373 21 LEU D CG 4451 N N . SER D 22 ? 1.1495 0.8154 0.9893 0.0291 -0.3368 -0.0849 22 SER D N 4452 C CA . SER D 22 ? 1.2368 0.8025 1.0375 -0.0045 -0.3664 -0.0648 22 SER D CA 4453 C C . SER D 22 ? 1.2099 0.8055 0.9926 -0.0773 -0.3416 -0.0271 22 SER D C 4454 O O . SER D 22 ? 1.1741 0.8281 0.9523 -0.1011 -0.3217 -0.0032 22 SER D O 4455 C CB . SER D 22 ? 1.3706 0.8156 1.1369 0.0110 -0.4307 -0.0433 22 SER D CB 4456 N N . CYS D 23 ? 1.2314 0.7953 1.0072 -0.1105 -0.3432 -0.0277 23 CYS D N 4457 C CA . CYS D 23 ? 1.2140 0.8169 0.9849 -0.1789 -0.3210 0.0019 23 CYS D CA 4458 C C . CYS D 23 ? 1.3217 0.8290 1.0649 -0.2274 -0.3581 0.0252 23 CYS D C 4459 O O . CYS D 23 ? 1.3803 0.8088 1.1201 -0.2067 -0.3904 0.0004 23 CYS D O 4460 C CB . CYS D 23 ? 1.1091 0.8086 0.9187 -0.1775 -0.2770 -0.0265 23 CYS D CB 4461 S SG . CYS D 23 ? 1.1048 0.8616 0.9284 -0.2502 -0.2564 -0.0060 23 CYS D SG 4462 N N . ASN D 24 ? 1.3575 0.8747 1.0795 -0.2954 -0.3518 0.0710 24 ASN D N 4463 C CA . ASN D 24 ? 1.4797 0.9039 1.1720 -0.3571 -0.3862 0.1034 24 ASN D CA 4464 C C . ASN D 24 ? 1.4639 0.9717 1.1708 -0.4387 -0.3523 0.1291 24 ASN D C 4465 O O . ASN D 24 ? 1.4006 1.0143 1.1139 -0.4551 -0.3091 0.1415 24 ASN D O 4466 C CB . ASN D 24 ? 1.6125 0.9151 1.2414 -0.3632 -0.4326 0.1487 24 ASN D CB 4467 C CG . ASN D 24 ? 1.7675 0.9231 1.3615 -0.4068 -0.4853 0.1719 24 ASN D CG 4468 O OD1 . ASN D 24 ? 1.8673 0.9770 1.4170 -0.4827 -0.4954 0.2293 24 ASN D OD1 4469 N ND2 . ASN D 24 ? 1.7981 0.8771 1.4075 -0.3627 -0.5188 0.1265 24 ASN D ND2 4470 N N . GLN D 25 ? 1.5289 0.9933 1.2447 -0.4890 -0.3732 0.1319 25 GLN D N 4471 C CA . GLN D 25 ? 1.5352 1.0797 1.2734 -0.5750 -0.3464 0.1565 25 GLN D CA 4472 C C . GLN D 25 ? 1.6800 1.1112 1.3986 -0.6438 -0.3913 0.1813 25 GLN D C 4473 O O . GLN D 25 ? 1.7355 1.0590 1.4503 -0.6153 -0.4374 0.1532 25 GLN D O 4474 C CB . GLN D 25 ? 1.4037 1.0930 1.2168 -0.5604 -0.3071 0.1116 25 GLN D CB 4475 C CG . GLN D 25 ? 1.3741 1.0317 1.2140 -0.5073 -0.3322 0.0591 25 GLN D CG 4476 C CD . GLN D 25 ? 1.4491 1.0666 1.3083 -0.5610 -0.3666 0.0520 25 GLN D CD 4477 O OE1 . GLN D 25 ? 1.4996 1.1516 1.3754 -0.6440 -0.3609 0.0824 25 GLN D OE1 4478 N NE2 . GLN D 25 ? 1.4655 1.0164 1.3225 -0.5168 -0.4014 0.0091 25 GLN D NE2 4479 N N . THR D 26 ? 1.7514 1.2073 1.4552 -0.7374 -0.3768 0.2321 26 THR D N 4480 C CA . THR D 26 ? 1.9031 1.2549 1.5892 -0.8222 -0.4162 0.2634 26 THR D CA 4481 C C . THR D 26 ? 1.8709 1.3599 1.6292 -0.9026 -0.3835 0.2574 26 THR D C 4482 O O . THR D 26 ? 1.9948 1.4410 1.7440 -1.0010 -0.3986 0.2961 26 THR D O 4483 C CB . THR D 26 ? 2.0679 1.2975 1.6613 -0.8796 -0.4391 0.3404 26 THR D CB 4484 O OG1 . THR D 26 ? 2.0165 1.3558 1.5848 -0.8850 -0.3880 0.3700 26 THR D OG1 4485 C CG2 . THR D 26 ? 2.1674 1.2026 1.6986 -0.8117 -0.5053 0.3416 26 THR D CG2 4486 N N . ASN D 27 ? 1.7135 1.3664 1.5464 -0.8608 -0.3416 0.2087 27 ASN D N 4487 C CA . ASN D 27 ? 1.6676 1.4744 1.5860 -0.9195 -0.3127 0.1921 27 ASN D CA 4488 C C . ASN D 27 ? 1.6822 1.4563 1.6494 -0.9209 -0.3573 0.1488 27 ASN D C 4489 O O . ASN D 27 ? 1.6329 1.5426 1.6830 -0.9531 -0.3422 0.1233 27 ASN D O 4490 C CB . ASN D 27 ? 1.5107 1.5054 1.4866 -0.8712 -0.2529 0.1597 27 ASN D CB 4491 C CG . ASN D 27 ? 1.5133 1.5770 1.4524 -0.8958 -0.2027 0.1983 27 ASN D CG 4492 O OD1 . ASN D 27 ? 1.5074 1.5138 1.3850 -0.8436 -0.2008 0.2091 27 ASN D OD1 4493 N ND2 . ASN D 27 ? 1.5286 1.7269 1.5069 -0.9759 -0.1613 0.2154 27 ASN D ND2 4494 N N . ASN D 28 ? 1.7566 1.3551 1.6726 -0.8825 -0.4143 0.1366 28 ASN D N 4495 C CA . ASN D 28 ? 1.8013 1.3376 1.7420 -0.8820 -0.4657 0.0926 28 ASN D CA 4496 C C . ASN D 28 ? 1.6642 1.3382 1.6742 -0.8240 -0.4507 0.0317 28 ASN D C 4497 O O . ASN D 28 ? 1.6751 1.4052 1.7429 -0.8620 -0.4705 0.0045 28 ASN D O 4498 C CB . ASN D 28 ? 1.9375 1.4385 1.8962 -1.0035 -0.4926 0.1215 28 ASN D CB 4499 C CG . ASN D 28 ? 2.0390 1.4020 1.9895 -1.0060 -0.5635 0.0831 28 ASN D CG 4500 N N . HIS D 29 ? 1.5451 1.2701 1.5469 -0.7341 -0.4192 0.0123 29 HIS D N 4501 C CA . HIS D 29 ? 1.4296 1.2652 1.4801 -0.6724 -0.4069 -0.0377 29 HIS D CA 4502 C C . HIS D 29 ? 1.4569 1.1912 1.4714 -0.6085 -0.4518 -0.0843 29 HIS D C 4503 O O . HIS D 29 ? 1.5660 1.1482 1.5275 -0.6113 -0.4940 -0.0851 29 HIS D O 4504 C CB . HIS D 29 ? 1.3046 1.2398 1.3621 -0.6141 -0.3518 -0.0355 29 HIS D CB 4505 C CG . HIS D 29 ? 1.2582 1.3441 1.3715 -0.6631 -0.3041 -0.0144 29 HIS D CG 4506 N ND1 . HIS D 29 ? 1.2390 1.3522 1.3259 -0.6687 -0.2621 0.0187 29 HIS D ND1 4507 C CD2 . HIS D 29 ? 1.2344 1.4610 1.4303 -0.7068 -0.2919 -0.0267 29 HIS D CD2 4508 C CE1 . HIS D 29 ? 1.2050 1.4677 1.3507 -0.7126 -0.2221 0.0239 29 HIS D CE1 4509 N NE2 . HIS D 29 ? 1.1993 1.5378 1.4176 -0.7355 -0.2385 -0.0035 29 HIS D NE2 4510 N N . ASN D 30 ? 1.3697 1.1863 1.4083 -0.5498 -0.4439 -0.1238 30 ASN D N 4511 C CA . ASN D 30 ? 1.3950 1.1378 1.3919 -0.4883 -0.4791 -0.1702 30 ASN D CA 4512 C C . ASN D 30 ? 1.2945 1.0847 1.2715 -0.4011 -0.4466 -0.1879 30 ASN D C 4513 O O . ASN D 30 ? 1.3180 1.0351 1.2401 -0.3432 -0.4598 -0.2162 30 ASN D O 4514 C CB . ASN D 30 ? 1.4419 1.2144 1.4740 -0.5202 -0.5227 -0.2045 30 ASN D CB 4515 N N . ASN D 31 ? 1.1923 1.1042 1.2129 -0.3940 -0.4031 -0.1726 31 ASN D N 4516 C CA . ASN D 31 ? 1.1099 1.0591 1.1120 -0.3215 -0.3713 -0.1822 31 ASN D CA 4517 C C . ASN D 31 ? 1.0582 1.0065 1.0477 -0.3090 -0.3286 -0.1528 31 ASN D C 4518 O O . ASN D 31 ? 1.0372 1.0399 1.0596 -0.3513 -0.3051 -0.1249 31 ASN D O 4519 C CB . ASN D 31 ? 1.0480 1.1198 1.1025 -0.3082 -0.3625 -0.1944 31 ASN D CB 4520 C CG . ASN D 31 ? 1.1051 1.1837 1.1681 -0.3126 -0.4113 -0.2267 31 ASN D CG 4521 O OD1 . ASN D 31 ? 1.1711 1.1642 1.1741 -0.2860 -0.4416 -0.2514 31 ASN D OD1 4522 N ND2 . ASN D 31 ? 1.0953 1.2840 1.2347 -0.3450 -0.4203 -0.2311 31 ASN D ND2 4523 N N . MET D 32 ? 1.0444 0.9383 0.9858 -0.2531 -0.3185 -0.1613 32 MET D N 4524 C CA . MET D 32 ? 1.0026 0.8927 0.9319 -0.2383 -0.2852 -0.1386 32 MET D CA 4525 C C . MET D 32 ? 0.9363 0.8560 0.8513 -0.1796 -0.2550 -0.1514 32 MET D C 4526 O O . MET D 32 ? 0.9563 0.8443 0.8384 -0.1400 -0.2639 -0.1763 32 MET D O 4527 C CB . MET D 32 ? 1.0786 0.8590 0.9684 -0.2399 -0.3090 -0.1306 32 MET D CB 4528 C CG . MET D 32 ? 1.1635 0.8962 1.0576 -0.3074 -0.3375 -0.1055 32 MET D CG 4529 S SD . MET D 32 ? 1.2700 0.8704 1.1142 -0.3048 -0.3643 -0.0821 32 MET D SD 4530 C CE . MET D 32 ? 1.1866 0.8622 1.0352 -0.3006 -0.3172 -0.0475 32 MET D CE 4531 N N . TYR D 33 ? 0.8691 0.8481 0.8045 -0.1780 -0.2184 -0.1347 33 TYR D N 4532 C CA . TYR D 33 ? 0.8126 0.8241 0.7422 -0.1346 -0.1896 -0.1432 33 TYR D CA 4533 C C . TYR D 33 ? 0.7823 0.7866 0.7021 -0.1221 -0.1637 -0.1319 33 TYR D C 4534 O O . TYR D 33 ? 0.7825 0.7912 0.7106 -0.1498 -0.1600 -0.1127 33 TYR D O 4535 C CB . TYR D 33 ? 0.7688 0.8632 0.7393 -0.1381 -0.1746 -0.1431 33 TYR D CB 4536 C CG . TYR D 33 ? 0.7925 0.9173 0.7876 -0.1497 -0.2035 -0.1561 33 TYR D CG 4537 C CD1 . TYR D 33 ? 0.8219 0.9620 0.8478 -0.2002 -0.2239 -0.1515 33 TYR D CD1 4538 C CD2 . TYR D 33 ? 0.7993 0.9399 0.7867 -0.1136 -0.2130 -0.1707 33 TYR D CD2 4539 C CE1 . TYR D 33 ? 0.8436 1.0241 0.9027 -0.2149 -0.2533 -0.1669 33 TYR D CE1 4540 C CE2 . TYR D 33 ? 0.8216 0.9983 0.8351 -0.1211 -0.2467 -0.1849 33 TYR D CE2 4541 C CZ . TYR D 33 ? 0.8407 1.0432 0.8959 -0.1722 -0.2666 -0.1857 33 TYR D CZ 4542 O OH . TYR D 33 ? 0.8662 1.1160 0.9576 -0.1844 -0.3025 -0.2030 33 TYR D OH 4543 N N . TRP D 34 ? 0.7651 0.7620 0.6651 -0.0841 -0.1469 -0.1432 34 TRP D N 4544 C CA . TRP D 34 ? 0.7359 0.7444 0.6380 -0.0731 -0.1212 -0.1370 34 TRP D CA 4545 C C . TRP D 34 ? 0.6935 0.7451 0.6064 -0.0633 -0.0917 -0.1370 34 TRP D C 4546 O O . TRP D 34 ? 0.7040 0.7530 0.6017 -0.0447 -0.0892 -0.1442 34 TRP D O 4547 C CB . TRP D 34 ? 0.7608 0.7343 0.6408 -0.0422 -0.1229 -0.1518 34 TRP D CB 4548 C CG . TRP D 34 ? 0.8121 0.7380 0.6876 -0.0441 -0.1505 -0.1500 34 TRP D CG 4549 C CD1 . TRP D 34 ? 0.8813 0.7463 0.7360 -0.0306 -0.1817 -0.1665 34 TRP D CD1 4550 C CD2 . TRP D 34 ? 0.8174 0.7415 0.7028 -0.0576 -0.1552 -0.1308 34 TRP D CD2 4551 N NE1 . TRP D 34 ? 0.9249 0.7415 0.7783 -0.0329 -0.2078 -0.1567 34 TRP D NE1 4552 C CE2 . TRP D 34 ? 0.8881 0.7418 0.7574 -0.0501 -0.1927 -0.1318 34 TRP D CE2 4553 C CE3 . TRP D 34 ? 0.7811 0.7510 0.6812 -0.0738 -0.1352 -0.1145 34 TRP D CE3 4554 C CZ2 . TRP D 34 ? 0.9278 0.7529 0.7923 -0.0578 -0.2128 -0.1105 34 TRP D CZ2 4555 C CZ3 . TRP D 34 ? 0.8132 0.7645 0.7062 -0.0837 -0.1527 -0.0964 34 TRP D CZ3 4556 C CH2 . TRP D 34 ? 0.8871 0.7653 0.7611 -0.0755 -0.1923 -0.0912 34 TRP D CH2 4557 N N . TYR D 35 ? 0.6613 0.7437 0.5931 -0.0751 -0.0729 -0.1291 35 TYR D N 4558 C CA . TYR D 35 ? 0.6337 0.7428 0.5758 -0.0663 -0.0486 -0.1325 35 TYR D CA 4559 C C . TYR D 35 ? 0.6189 0.7339 0.5637 -0.0662 -0.0288 -0.1334 35 TYR D C 4560 O O . TYR D 35 ? 0.6187 0.7363 0.5655 -0.0759 -0.0343 -0.1294 35 TYR D O 4561 C CB . TYR D 35 ? 0.6176 0.7721 0.5883 -0.0803 -0.0453 -0.1332 35 TYR D CB 4562 C CG . TYR D 35 ? 0.6248 0.7963 0.6100 -0.0803 -0.0637 -0.1368 35 TYR D CG 4563 C CD1 . TYR D 35 ? 0.6354 0.8136 0.6292 -0.1080 -0.0833 -0.1311 35 TYR D CD1 4564 C CD2 . TYR D 35 ? 0.6277 0.8081 0.6202 -0.0549 -0.0657 -0.1452 35 TYR D CD2 4565 C CE1 . TYR D 35 ? 0.6486 0.8550 0.6661 -0.1136 -0.1026 -0.1378 35 TYR D CE1 4566 C CE2 . TYR D 35 ? 0.6394 0.8478 0.6531 -0.0521 -0.0886 -0.1514 35 TYR D CE2 4567 C CZ . TYR D 35 ? 0.6422 0.8705 0.6727 -0.0834 -0.1060 -0.1498 35 TYR D CZ 4568 O OH . TYR D 35 ? 0.6497 0.9157 0.7098 -0.0859 -0.1312 -0.1591 35 TYR D OH 4569 N N . ARG D 36 ? 0.6179 0.7313 0.5619 -0.0568 -0.0101 -0.1377 36 ARG D N 4570 C CA . ARG D 36 ? 0.6110 0.7327 0.5636 -0.0633 0.0076 -0.1418 36 ARG D CA 4571 C C . ARG D 36 ? 0.6120 0.7420 0.5764 -0.0669 0.0182 -0.1496 36 ARG D C 4572 O O . ARG D 36 ? 0.6287 0.7424 0.5896 -0.0532 0.0175 -0.1504 36 ARG D O 4573 C CB . ARG D 36 ? 0.6296 0.7335 0.5682 -0.0555 0.0218 -0.1413 36 ARG D CB 4574 C CG . ARG D 36 ? 0.6331 0.7509 0.5885 -0.0696 0.0403 -0.1466 36 ARG D CG 4575 C CD . ARG D 36 ? 0.6696 0.7798 0.6116 -0.0706 0.0607 -0.1428 36 ARG D CD 4576 N NE . ARG D 36 ? 0.6752 0.8092 0.6441 -0.0927 0.0778 -0.1491 36 ARG D NE 4577 C CZ . ARG D 36 ? 0.7043 0.8518 0.6742 -0.1062 0.1019 -0.1467 36 ARG D CZ 4578 N NH1 . ARG D 36 ? 0.7319 0.8692 0.6667 -0.0968 0.1146 -0.1378 36 ARG D NH1 4579 N NH2 . ARG D 36 ? 0.7117 0.8889 0.7167 -0.1329 0.1140 -0.1547 36 ARG D NH2 4580 N N . GLN D 37 ? 0.6059 0.7595 0.5819 -0.0812 0.0240 -0.1584 37 GLN D N 4581 C CA . GLN D 37 ? 0.6193 0.7784 0.6042 -0.0818 0.0339 -0.1755 37 GLN D CA 4582 C C . GLN D 37 ? 0.6383 0.7819 0.6259 -0.0930 0.0439 -0.1859 37 GLN D C 4583 O O . GLN D 37 ? 0.6287 0.7956 0.6214 -0.1077 0.0414 -0.1876 37 GLN D O 4584 C CB . GLN D 37 ? 0.6094 0.8169 0.5996 -0.0922 0.0333 -0.1844 37 GLN D CB 4585 C CG . GLN D 37 ? 0.6264 0.8476 0.6266 -0.0839 0.0445 -0.2120 37 GLN D CG 4586 C CD . GLN D 37 ? 0.6261 0.9122 0.6324 -0.0913 0.0506 -0.2221 37 GLN D CD 4587 O OE1 . GLN D 37 ? 0.6305 0.9483 0.6184 -0.1154 0.0514 -0.2155 37 GLN D OE1 4588 N NE2 . GLN D 37 ? 0.6275 0.9382 0.6590 -0.0707 0.0545 -0.2378 37 GLN D NE2 4589 N N . ASP D 38 ? 0.6766 0.7776 0.6615 -0.0867 0.0506 -0.1924 38 ASP D N 4590 C CA . ASP D 38 ? 0.7106 0.7854 0.6994 -0.1048 0.0587 -0.2035 38 ASP D CA 4591 C C . ASP D 38 ? 0.7572 0.7937 0.7448 -0.0931 0.0571 -0.2262 38 ASP D C 4592 O O . ASP D 38 ? 0.7740 0.7894 0.7576 -0.0656 0.0512 -0.2251 38 ASP D O 4593 C CB . ASP D 38 ? 0.7372 0.7756 0.7157 -0.1154 0.0686 -0.1825 38 ASP D CB 4594 C CG . ASP D 38 ? 0.7007 0.7810 0.6833 -0.1172 0.0711 -0.1691 38 ASP D CG 4595 N N . THR D 39 ? 0.7875 0.8154 0.7811 -0.1105 0.0585 -0.2511 39 THR D N 4596 C CA . THR D 39 ? 0.8463 0.8340 0.8383 -0.0948 0.0543 -0.2835 39 THR D CA 4597 C C . THR D 39 ? 0.9115 0.8095 0.8910 -0.0747 0.0479 -0.2715 39 THR D C 4598 O O . THR D 39 ? 0.9338 0.7855 0.8973 -0.0909 0.0510 -0.2388 39 THR D O 4599 C CB . THR D 39 ? 0.8844 0.8631 0.8794 -0.1210 0.0525 -0.3161 39 THR D CB 4600 O OG1 . THR D 39 ? 0.8908 0.8543 0.8932 -0.1588 0.0556 -0.2978 39 THR D OG1 4601 C CG2 . THR D 39 ? 0.8488 0.9107 0.8423 -0.1256 0.0519 -0.3388 39 THR D CG2 4602 N N . GLY D 40 ? 0.9510 0.8286 0.9352 -0.0373 0.0384 -0.2983 40 GLY D N 4603 C CA . GLY D 40 ? 1.0266 0.8149 0.9975 -0.0058 0.0225 -0.2882 40 GLY D CA 4604 C C . GLY D 40 ? 1.0076 0.7911 0.9616 0.0033 0.0177 -0.2432 40 GLY D C 4605 O O . GLY D 40 ? 1.0783 0.7734 0.9983 0.0013 0.0092 -0.2128 40 GLY D O 4606 N N . HIS D 41 ? 0.9250 0.7979 0.8956 0.0100 0.0216 -0.2381 41 HIS D N 4607 C CA . HIS D 41 ? 0.9076 0.7819 0.8601 0.0171 0.0145 -0.2024 41 HIS D CA 4608 C C . HIS D 41 ? 0.8605 0.8063 0.8398 0.0452 0.0031 -0.2099 41 HIS D C 4609 O O . HIS D 41 ? 0.8969 0.8196 0.8704 0.0769 -0.0182 -0.2003 41 HIS D O 4610 C CB . HIS D 41 ? 0.8695 0.7632 0.8053 -0.0207 0.0307 -0.1772 41 HIS D CB 4611 C CG . HIS D 41 ? 0.9358 0.7570 0.8290 -0.0359 0.0349 -0.1447 41 HIS D CG 4612 N ND1 . HIS D 41 ? 1.0230 0.7648 0.8991 -0.0536 0.0381 -0.1406 41 HIS D ND1 4613 C CD2 . HIS D 41 ? 0.9482 0.7635 0.8063 -0.0396 0.0380 -0.1149 41 HIS D CD2 4614 C CE1 . HIS D 41 ? 1.0806 0.7744 0.9121 -0.0726 0.0459 -0.1040 41 HIS D CE1 4615 N NE2 . HIS D 41 ? 1.0390 0.7806 0.8570 -0.0618 0.0473 -0.0899 41 HIS D NE2 4616 N N . GLY D 42 ? 0.7895 0.8221 0.7960 0.0301 0.0147 -0.2245 42 GLY D N 4617 C CA . GLY D 42 ? 0.7437 0.8492 0.7758 0.0393 0.0068 -0.2245 42 GLY D CA 4618 C C . GLY D 42 ? 0.7068 0.8140 0.7165 0.0167 0.0043 -0.1944 42 GLY D C 4619 O O . GLY D 42 ? 0.7251 0.7778 0.7000 0.0070 0.0073 -0.1744 42 GLY D O 4620 N N . LEU D 43 ? 0.6624 0.8327 0.6923 0.0065 -0.0001 -0.1936 43 LEU D N 4621 C CA . LEU D 43 ? 0.6357 0.8019 0.6451 -0.0141 -0.0055 -0.1725 43 LEU D CA 4622 C C . LEU D 43 ? 0.6666 0.7854 0.6453 0.0031 -0.0223 -0.1569 43 LEU D C 4623 O O . LEU D 43 ? 0.6941 0.8098 0.6784 0.0289 -0.0404 -0.1595 43 LEU D O 4624 C CB . LEU D 43 ? 0.6065 0.8360 0.6408 -0.0349 -0.0107 -0.1733 43 LEU D CB 4625 C CG . LEU D 43 ? 0.5811 0.8531 0.6222 -0.0640 0.0053 -0.1769 43 LEU D CG 4626 C CD1 . LEU D 43 ? 0.5877 0.9122 0.6570 -0.0547 0.0211 -0.2035 43 LEU D CD1 4627 C CD2 . LEU D 43 ? 0.5659 0.8675 0.6108 -0.0945 -0.0045 -0.1621 43 LEU D CD2 4628 N N . ARG D 44 ? 0.6684 0.7557 0.6133 -0.0081 -0.0173 -0.1432 44 ARG D N 4629 C CA . ARG D 44 ? 0.7052 0.7531 0.6070 0.0044 -0.0282 -0.1304 44 ARG D CA 4630 C C . ARG D 44 ? 0.6928 0.7527 0.5858 -0.0051 -0.0382 -0.1316 44 ARG D C 4631 O O . ARG D 44 ? 0.6642 0.7398 0.5717 -0.0219 -0.0308 -0.1346 44 ARG D O 4632 C CB . ARG D 44 ? 0.7410 0.7409 0.6051 0.0010 -0.0079 -0.1175 44 ARG D CB 4633 C CG . ARG D 44 ? 0.7820 0.7404 0.6427 0.0097 -0.0051 -0.1134 44 ARG D CG 4634 C CD . ARG D 44 ? 0.8280 0.7375 0.6518 -0.0085 0.0172 -0.0963 44 ARG D CD 4635 N N . LEU D 45 ? 0.7264 0.7725 0.5923 0.0079 -0.0602 -0.1307 45 LEU D N 4636 C CA . LEU D 45 ? 0.7317 0.7769 0.5865 0.0015 -0.0765 -0.1385 45 LEU D CA 4637 C C . LEU D 45 ? 0.7605 0.7772 0.5707 0.0081 -0.0616 -0.1400 45 LEU D C 4638 O O . LEU D 45 ? 0.8036 0.7986 0.5701 0.0192 -0.0494 -0.1318 45 LEU D O 4639 C CB . LEU D 45 ? 0.7601 0.8096 0.6082 0.0109 -0.1111 -0.1445 45 LEU D CB 4640 C CG . LEU D 45 ? 0.7762 0.8169 0.6158 0.0006 -0.1369 -0.1578 45 LEU D CG 4641 C CD1 . LEU D 45 ? 0.7399 0.8023 0.6269 -0.0304 -0.1397 -0.1581 45 LEU D CD1 4642 C CD2 . LEU D 45 ? 0.8203 0.8677 0.6500 0.0102 -0.1737 -0.1662 45 LEU D CD2 4643 N N . ILE D 46 ? 0.7495 0.7674 0.5697 0.0017 -0.0629 -0.1503 46 ILE D N 4644 C CA . ILE D 46 ? 0.7755 0.7838 0.5677 0.0141 -0.0477 -0.1609 46 ILE D CA 4645 C C . ILE D 46 ? 0.8248 0.8079 0.5818 0.0293 -0.0723 -0.1813 46 ILE D C 4646 O O . ILE D 46 ? 0.8729 0.8474 0.5785 0.0455 -0.0643 -0.1896 46 ILE D O 4647 C CB . ILE D 46 ? 0.7432 0.7706 0.5730 0.0075 -0.0351 -0.1642 46 ILE D CB 4648 C CG1 . ILE D 46 ? 0.7093 0.7600 0.5631 -0.0071 -0.0092 -0.1509 46 ILE D CG1 4649 C CG2 . ILE D 46 ? 0.7731 0.8061 0.5892 0.0275 -0.0238 -0.1839 46 ILE D CG2 4650 C CD1 . ILE D 46 ? 0.6837 0.7575 0.5774 -0.0180 -0.0088 -0.1522 46 ILE D CD1 4651 N N . HIS D 47 ? 0.8265 0.7936 0.6055 0.0208 -0.1022 -0.1893 47 HIS D N 4652 C CA . HIS D 47 ? 0.8854 0.8156 0.6354 0.0297 -0.1353 -0.2122 47 HIS D CA 4653 C C . HIS D 47 ? 0.8826 0.8047 0.6633 0.0010 -0.1694 -0.2056 47 HIS D C 4654 O O . HIS D 47 ? 0.8415 0.7871 0.6647 -0.0232 -0.1633 -0.1858 47 HIS D O 4655 C CB . HIS D 47 ? 0.9167 0.8203 0.6621 0.0489 -0.1391 -0.2356 47 HIS D CB 4656 C CG . HIS D 47 ? 0.9383 0.8653 0.6558 0.0778 -0.1059 -0.2527 47 HIS D CG 4657 N ND1 . HIS D 47 ? 0.9916 0.9192 0.6490 0.0944 -0.0980 -0.2681 47 HIS D ND1 4658 C CD2 . HIS D 47 ? 0.9249 0.8849 0.6669 0.0904 -0.0778 -0.2578 47 HIS D CD2 4659 C CE1 . HIS D 47 ? 1.0069 0.9699 0.6516 0.1122 -0.0603 -0.2802 47 HIS D CE1 4660 N NE2 . HIS D 47 ? 0.9628 0.9505 0.6656 0.1103 -0.0480 -0.2760 47 HIS D NE2 4661 N N . TYR D 48 ? 0.9370 0.8317 0.6953 0.0001 -0.2042 -0.2241 48 TYR D N 4662 C CA . TYR D 48 ? 0.9463 0.8402 0.7393 -0.0359 -0.2375 -0.2197 48 TYR D CA 4663 C C . TYR D 48 ? 1.0298 0.8633 0.7945 -0.0383 -0.2806 -0.2487 48 TYR D C 4664 O O . TYR D 48 ? 1.0824 0.8866 0.7941 -0.0053 -0.2856 -0.2769 48 TYR D O 4665 C CB . TYR D 48 ? 0.9147 0.8688 0.7343 -0.0449 -0.2393 -0.2090 48 TYR D CB 4666 C CG . TYR D 48 ? 0.9594 0.9121 0.7328 -0.0180 -0.2567 -0.2246 48 TYR D CG 4667 C CD1 . TYR D 48 ? 0.9797 0.9187 0.6949 0.0160 -0.2328 -0.2247 48 TYR D CD1 4668 C CD2 . TYR D 48 ? 0.9913 0.9611 0.7768 -0.0305 -0.2981 -0.2372 48 TYR D CD2 4669 C CE1 . TYR D 48 ? 1.0356 0.9682 0.6921 0.0383 -0.2498 -0.2332 48 TYR D CE1 4670 C CE2 . TYR D 48 ? 1.0448 1.0124 0.7790 -0.0038 -0.3206 -0.2502 48 TYR D CE2 4671 C CZ . TYR D 48 ? 1.0708 1.0151 0.7337 0.0312 -0.2964 -0.2461 48 TYR D CZ 4672 O OH . TYR D 48 ? 1.1397 1.0765 0.7356 0.0556 -0.3197 -0.2535 48 TYR D OH 4673 N N . SER D 49 ? 1.0537 0.8679 0.8504 -0.0805 -0.3109 -0.2433 49 SER D N 4674 C CA . SER D 49 ? 1.1489 0.8872 0.9210 -0.0895 -0.3568 -0.2712 49 SER D CA 4675 C C . SER D 49 ? 1.1755 0.9301 0.9840 -0.1417 -0.3929 -0.2697 49 SER D C 4676 O O . SER D 49 ? 1.1478 0.9351 1.0074 -0.1894 -0.3874 -0.2400 49 SER D O 4677 C CB . SER D 49 ? 1.1925 0.8508 0.9579 -0.0900 -0.3656 -0.2685 49 SER D CB 4678 O OG . SER D 49 ? 1.3083 0.8750 1.0439 -0.0915 -0.4133 -0.3013 49 SER D OG 4679 N N . TYR D 50 ? 1.2376 0.9759 1.0183 -0.1346 -0.4297 -0.3040 50 TYR D N 4680 C CA . TYR D 50 ? 1.2713 1.0342 1.0912 -0.1841 -0.4707 -0.3109 50 TYR D CA 4681 C C . TYR D 50 ? 1.3653 1.0376 1.1900 -0.2333 -0.5106 -0.3172 50 TYR D C 4682 O O . TYR D 50 ? 1.4138 1.0959 1.2707 -0.2832 -0.5495 -0.3270 50 TYR D O 4683 C CB . TYR D 50 ? 1.3101 1.0919 1.0932 -0.1566 -0.5013 -0.3467 50 TYR D CB 4684 C CG . TYR D 50 ? 1.2371 1.1194 1.0392 -0.1333 -0.4819 -0.3314 50 TYR D CG 4685 C CD1 . TYR D 50 ? 1.1926 1.1688 1.0767 -0.1679 -0.4896 -0.3167 50 TYR D CD1 4686 C CD2 . TYR D 50 ? 1.2245 1.1076 0.9632 -0.0768 -0.4570 -0.3323 50 TYR D CD2 4687 C CE1 . TYR D 50 ? 1.1395 1.1993 1.0434 -0.1370 -0.4786 -0.3065 50 TYR D CE1 4688 C CE2 . TYR D 50 ? 1.1802 1.1340 0.9287 -0.0542 -0.4461 -0.3147 50 TYR D CE2 4689 C CZ . TYR D 50 ? 1.1380 1.1752 0.9697 -0.0797 -0.4599 -0.3035 50 TYR D CZ 4690 O OH . TYR D 50 ? 1.1066 1.2049 0.9502 -0.0482 -0.4554 -0.2897 50 TYR D OH 4691 N N . GLY D 51 ? 1.4013 0.9834 1.1963 -0.2202 -0.5048 -0.3115 51 GLY D N 4692 C CA . GLY D 51 ? 1.5138 0.9811 1.3013 -0.2612 -0.5477 -0.3138 51 GLY D CA 4693 C C . GLY D 51 ? 1.5743 0.9311 1.3108 -0.2118 -0.5525 -0.3288 51 GLY D C 4694 O O . GLY D 51 ? 1.5137 0.9015 1.2315 -0.1523 -0.5148 -0.3329 51 GLY D O 4695 N N . ALA D 52 ? 1.7017 0.9295 1.4200 -0.2374 -0.6014 -0.3382 52 ALA D N 4696 C CA . ALA D 52 ? 1.7862 0.8950 1.4614 -0.1860 -0.6189 -0.3586 52 ALA D CA 4697 C C . ALA D 52 ? 1.8141 0.9174 1.4411 -0.1070 -0.6192 -0.4257 52 ALA D C 4698 O O . ALA D 52 ? 1.8377 0.9652 1.4455 -0.1082 -0.6356 -0.4631 52 ALA D O 4699 C CB . ALA D 52 ? 1.9405 0.8966 1.6028 -0.2339 -0.6803 -0.3551 52 ALA D CB 4700 N N . GLY D 53 ? 1.8177 0.8992 1.4252 -0.0391 -0.6004 -0.4414 53 GLY D N 4701 C CA . GLY D 53 ? 1.8509 0.9423 1.4130 0.0380 -0.5897 -0.5057 53 GLY D CA 4702 C C . GLY D 53 ? 1.7609 0.9816 1.3094 0.0525 -0.5447 -0.5116 53 GLY D C 4703 O O . GLY D 53 ? 1.8174 1.0406 1.3127 0.0892 -0.5501 -0.5652 53 GLY D O 4704 N N . SER D 54 ? 1.6361 0.9571 1.2253 0.0251 -0.5024 -0.4572 54 SER D N 4705 C CA . SER D 54 ? 1.5611 0.9903 1.1379 0.0338 -0.4656 -0.4523 54 SER D CA 4706 C C . SER D 54 ? 1.4479 0.9631 1.0510 0.0494 -0.4053 -0.4142 54 SER D C 4707 O O . SER D 54 ? 1.3963 0.9171 1.0461 0.0268 -0.3935 -0.3744 54 SER D O 4708 C CB . SER D 54 ? 1.5393 1.0068 1.1435 -0.0232 -0.4880 -0.4308 54 SER D CB 4709 O OG . SER D 54 ? 1.4581 1.0265 1.0609 -0.0133 -0.4534 -0.4125 54 SER D OG 4710 N N . THR D 55 ? 1.4240 1.0027 0.9905 0.0837 -0.3688 -0.4257 55 THR D N 4711 C CA . THR D 55 ? 1.3282 0.9856 0.9150 0.0931 -0.3126 -0.3916 55 THR D CA 4712 C C . THR D 55 ? 1.3114 1.0284 0.8559 0.1007 -0.2892 -0.3860 55 THR D C 4713 O O . THR D 55 ? 1.3864 1.0937 0.8636 0.1258 -0.2967 -0.4213 55 THR D O 4714 C CB . THR D 55 ? 1.3321 0.9943 0.9210 0.1364 -0.2822 -0.4096 55 THR D CB 4715 O OG1 . THR D 55 ? 1.2569 1.0009 0.8553 0.1410 -0.2275 -0.3834 55 THR D OG1 4716 C CG2 . THR D 55 ? 1.4367 1.0675 0.9679 0.1846 -0.2913 -0.4724 55 THR D CG2 4717 N N . GLU D 56 ? 1.2270 0.9991 0.8041 0.0806 -0.2633 -0.3420 56 GLU D N 4718 C CA . GLU D 56 ? 1.2240 1.0373 0.7612 0.0865 -0.2485 -0.3274 56 GLU D CA 4719 C C . GLU D 56 ? 1.1498 1.0094 0.7086 0.0850 -0.1996 -0.2897 56 GLU D C 4720 O O . GLU D 56 ? 1.0786 0.9560 0.7009 0.0634 -0.1916 -0.2639 56 GLU D O 4721 C CB . GLU D 56 ? 1.2279 1.0499 0.7808 0.0623 -0.2902 -0.3187 56 GLU D CB 4722 C CG . GLU D 56 ? 1.3154 1.0943 0.8416 0.0574 -0.3446 -0.3582 56 GLU D CG 4723 C CD . GLU D 56 ? 1.4180 1.1741 0.8465 0.0939 -0.3486 -0.3966 56 GLU D CD 4724 O OE1 . GLU D 56 ? 1.4287 1.2154 0.8018 0.1140 -0.3204 -0.3820 56 GLU D OE1 4725 O OE2 . GLU D 56 ? 1.4976 1.2003 0.8988 0.1010 -0.3804 -0.4420 56 GLU D OE2 4726 N N . LYS D 57 ? 1.1803 1.0569 0.6804 0.1042 -0.1672 -0.2876 57 LYS D N 4727 C CA . LYS D 57 ? 1.1336 1.0431 0.6451 0.0976 -0.1224 -0.2526 57 LYS D CA 4728 C C . LYS D 57 ? 1.0956 1.0122 0.6343 0.0813 -0.1353 -0.2181 57 LYS D C 4729 O O . LYS D 57 ? 1.1362 1.0439 0.6441 0.0859 -0.1676 -0.2163 57 LYS D O 4730 C CB . LYS D 57 ? 1.1993 1.1203 0.6299 0.1122 -0.0875 -0.2530 57 LYS D CB 4731 C CG . LYS D 57 ? 1.2431 1.1776 0.6494 0.1349 -0.0664 -0.2946 57 LYS D CG 4732 C CD . LYS D 57 ? 1.3142 1.2762 0.6371 0.1410 -0.0234 -0.2912 57 LYS D CD 4733 N N . GLY D 58 ? 1.0261 0.9624 0.6241 0.0661 -0.1129 -0.1957 58 GLY D N 4734 C CA . GLY D 58 ? 0.9942 0.9414 0.6243 0.0573 -0.1203 -0.1700 58 GLY D CA 4735 C C . GLY D 58 ? 1.0287 0.9624 0.6131 0.0638 -0.0967 -0.1436 58 GLY D C 4736 O O . GLY D 58 ? 1.1041 1.0173 0.6104 0.0752 -0.0947 -0.1405 58 GLY D O 4737 N N . ASP D 59 ? 0.9890 0.9280 0.6150 0.0543 -0.0800 -0.1243 59 ASP D N 4738 C CA . ASP D 59 ? 1.0380 0.9458 0.6229 0.0551 -0.0613 -0.0959 59 ASP D CA 4739 C C . ASP D 59 ? 1.0350 0.9477 0.6157 0.0355 -0.0139 -0.0893 59 ASP D C 4740 O O . ASP D 59 ? 1.1051 0.9928 0.6231 0.0288 0.0079 -0.0687 59 ASP D O 4741 C CB . ASP D 59 ? 1.0194 0.9198 0.6476 0.0606 -0.0765 -0.0838 59 ASP D CB 4742 C CG . ASP D 59 ? 1.0440 0.9494 0.6741 0.0841 -0.1237 -0.0883 59 ASP D CG 4743 N N . ILE D 60 ? 0.9628 0.9112 0.6089 0.0235 0.0005 -0.1050 60 ILE D N 4744 C CA . ILE D 60 ? 0.9531 0.9255 0.6117 0.0061 0.0405 -0.1061 60 ILE D CA 4745 C C . ILE D 60 ? 0.9259 0.9376 0.6075 0.0148 0.0441 -0.1359 60 ILE D C 4746 O O . ILE D 60 ? 0.8701 0.9052 0.6111 0.0107 0.0399 -0.1468 60 ILE D O 4747 C CB . ILE D 60 ? 0.9105 0.8873 0.6237 -0.0144 0.0539 -0.0974 60 ILE D CB 4748 C CG1 . ILE D 60 ? 0.8412 0.8357 0.6134 -0.0109 0.0303 -0.1104 60 ILE D CG1 4749 C CG2 . ILE D 60 ? 0.9699 0.8935 0.6492 -0.0222 0.0571 -0.0697 60 ILE D CG2 4750 N N . PRO D 61 ? 0.9784 0.9937 0.6076 0.0303 0.0492 -0.1507 61 PRO D N 4751 C CA . PRO D 61 ? 0.9726 1.0131 0.6196 0.0496 0.0448 -0.1864 61 PRO D CA 4752 C C . PRO D 61 ? 0.9844 1.0813 0.6432 0.0518 0.0864 -0.2033 61 PRO D C 4753 O O . PRO D 61 ? 0.9827 1.1029 0.6664 0.0762 0.0805 -0.2375 61 PRO D O 4754 C CB . PRO D 61 ? 1.0381 1.0485 0.6183 0.0703 0.0197 -0.2022 61 PRO D CB 4755 C CG . PRO D 61 ? 1.0959 1.0852 0.6058 0.0613 0.0299 -0.1721 61 PRO D CG 4756 C CD . PRO D 61 ? 1.0620 1.0497 0.6040 0.0356 0.0510 -0.1376 61 PRO D CD 4757 N N . ASP D 62 ? 1.0037 1.1224 0.6484 0.0263 0.1260 -0.1807 62 ASP D N 4758 C CA . ASP D 62 ? 1.0229 1.2139 0.6816 0.0201 0.1724 -0.1957 62 ASP D CA 4759 C C . ASP D 62 ? 0.9544 1.2012 0.7095 0.0216 0.1740 -0.2150 62 ASP D C 4760 O O . ASP D 62 ? 0.9110 1.1599 0.7110 -0.0057 0.1759 -0.1955 62 ASP D O 4761 C CB . ASP D 62 ? 1.0765 1.2687 0.6919 -0.0202 0.2133 -0.1591 62 ASP D CB 4762 C CG . ASP D 62 ? 1.1733 1.3315 0.6782 -0.0169 0.2203 -0.1451 62 ASP D CG 4763 N N . GLY D 63 ? 0.9569 1.2451 0.7403 0.0577 0.1688 -0.2563 63 GLY D N 4764 C CA . GLY D 63 ? 0.9067 1.2491 0.7784 0.0696 0.1619 -0.2775 63 GLY D CA 4765 C C . GLY D 63 ? 0.8842 1.1752 0.7774 0.1009 0.1075 -0.2909 63 GLY D C 4766 O O . GLY D 63 ? 0.8598 1.1804 0.8158 0.1172 0.0904 -0.3057 63 GLY D O 4767 N N . TYR D 64 ? 0.9041 1.1176 0.7437 0.1068 0.0775 -0.2838 65 TYR D N 4768 C CA . TYR D 64 ? 0.8969 1.0492 0.7485 0.1212 0.0260 -0.2870 65 TYR D CA 4769 C C . TYR D 64 ? 0.9614 1.0632 0.7653 0.1516 0.0000 -0.3161 65 TYR D C 4770 O O . TYR D 64 ? 1.0013 1.0928 0.7448 0.1501 0.0116 -0.3189 65 TYR D O 4771 C CB . TYR D 64 ? 0.8591 0.9673 0.7051 0.0866 0.0087 -0.2488 65 TYR D CB 4772 C CG . TYR D 64 ? 0.8095 0.9514 0.6914 0.0554 0.0298 -0.2234 65 TYR D CG 4773 C CD1 . TYR D 64 ? 0.7697 0.9220 0.6992 0.0491 0.0126 -0.2180 65 TYR D CD1 4774 C CD2 . TYR D 64 ? 0.8109 0.9637 0.6710 0.0315 0.0622 -0.2045 65 TYR D CD2 4775 C CE1 . TYR D 64 ? 0.7274 0.9083 0.6849 0.0209 0.0286 -0.2018 65 TYR D CE1 4776 C CE2 . TYR D 64 ? 0.7745 0.9448 0.6658 0.0026 0.0770 -0.1865 65 TYR D CE2 4777 C CZ . TYR D 64 ? 0.7323 0.9203 0.6736 -0.0020 0.0606 -0.1889 65 TYR D CZ 4778 O OH . TYR D 64 ? 0.7130 0.9170 0.6807 -0.0301 0.0723 -0.1780 65 TYR D OH 4779 N N . LYS D 65 ? 0.9846 1.0462 0.8098 0.1784 -0.0401 -0.3370 66 LYS D N 4780 C CA . LYS D 65 ? 1.0564 1.0475 0.8393 0.2031 -0.0769 -0.3664 66 LYS D CA 4781 C C . LYS D 65 ? 1.0584 0.9671 0.8508 0.1844 -0.1289 -0.3451 66 LYS D C 4782 O O . LYS D 65 ? 1.0441 0.9433 0.8777 0.1840 -0.1468 -0.3312 66 LYS D O 4783 C CB . LYS D 65 ? 1.1191 1.1260 0.9117 0.2595 -0.0790 -0.4220 66 LYS D CB 4784 C CG . LYS D 65 ? 1.1435 1.2332 0.9103 0.2778 -0.0260 -0.4526 66 LYS D CG 4785 N N . ALA D 66 ? 1.0846 0.9383 0.8372 0.1652 -0.1537 -0.3408 67 ALA D N 4786 C CA . ALA D 66 ? 1.1004 0.8801 0.8603 0.1383 -0.2006 -0.3215 67 ALA D CA 4787 C C . ALA D 66 ? 1.2031 0.8956 0.9396 0.1656 -0.2468 -0.3597 67 ALA D C 4788 O O . ALA D 66 ? 1.2619 0.9526 0.9644 0.2028 -0.2434 -0.4057 67 ALA D O 4789 C CB . ALA D 66 ? 1.0732 0.8557 0.8195 0.0959 -0.2032 -0.2955 67 ALA D CB 4790 N N . SER D 67 ? 1.2379 0.8529 0.9862 0.1456 -0.2905 -0.3411 68 SER D N 4791 C CA . SER D 67 ? 1.3506 0.8563 1.0743 0.1633 -0.3438 -0.3727 68 SER D CA 4792 C C . SER D 67 ? 1.3854 0.8098 1.1091 0.1058 -0.3864 -0.3342 68 SER D C 4793 O O . SER D 67 ? 1.3392 0.7788 1.0869 0.0703 -0.3809 -0.2855 68 SER D O 4794 C CB . SER D 67 ? 1.4077 0.8847 1.1472 0.2240 -0.3589 -0.4032 68 SER D CB 4795 N N . ARG D 68 ? 1.4745 0.8157 1.1684 0.0928 -0.4280 -0.3578 69 ARG D N 4796 C CA . ARG D 68 ? 1.5289 0.7885 1.2230 0.0298 -0.4701 -0.3236 69 ARG D CA 4797 C C . ARG D 68 ? 1.6836 0.7967 1.3462 0.0442 -0.5329 -0.3583 69 ARG D C 4798 O O . ARG D 68 ? 1.7445 0.8252 1.3798 0.0494 -0.5540 -0.4032 69 ARG D O 4799 C CB . ARG D 68 ? 1.4756 0.7954 1.1786 -0.0275 -0.4591 -0.3073 69 ARG D CB 4800 C CG . ARG D 68 ? 1.4817 0.7809 1.2068 -0.1046 -0.4754 -0.2554 69 ARG D CG 4801 C CD . ARG D 68 ? 1.3887 0.7968 1.1450 -0.1486 -0.4478 -0.2372 69 ARG D CD 4802 N NE . ARG D 68 ? 1.4092 0.8156 1.1917 -0.2263 -0.4582 -0.1926 69 ARG D NE 4803 C CZ . ARG D 68 ? 1.3850 0.8649 1.2028 -0.2772 -0.4540 -0.1847 69 ARG D CZ 4804 N NH1 . ARG D 68 ? 1.3420 0.8914 1.1686 -0.2543 -0.4470 -0.2162 69 ARG D NH1 4805 N NH2 . ARG D 68 ? 1.4113 0.9002 1.2551 -0.3515 -0.4575 -0.1445 69 ARG D NH2 4806 N N . PRO D 69 ? 1.7611 0.7779 1.4223 0.0537 -0.5674 -0.3392 70 PRO D N 4807 C CA . PRO D 69 ? 1.9309 0.7825 1.5603 0.0673 -0.6353 -0.3673 70 PRO D CA 4808 C C . PRO D 69 ? 2.0137 0.7690 1.6306 -0.0234 -0.6772 -0.3251 70 PRO D C 4809 O O . PRO D 69 ? 2.1568 0.7789 1.7448 -0.0307 -0.7333 -0.3550 70 PRO D O 4810 C CB . PRO D 69 ? 1.9786 0.7767 1.6142 0.1212 -0.6543 -0.3573 70 PRO D CB 4811 C CG . PRO D 69 ? 1.8212 0.7719 1.4948 0.1305 -0.5928 -0.3265 70 PRO D CG 4812 C CD . PRO D 69 ? 1.7052 0.7592 1.3900 0.0633 -0.5486 -0.2958 70 PRO D CD 4813 N N . SER D 70 ? 1.9316 0.7576 1.5712 -0.0937 -0.6488 -0.2593 71 SER D N 4814 C CA . SER D 70 ? 1.9994 0.7680 1.6361 -0.1914 -0.6754 -0.2126 71 SER D CA 4815 C C . SER D 70 ? 1.8625 0.7882 1.5401 -0.2508 -0.6238 -0.1839 71 SER D C 4816 O O . SER D 70 ? 1.7242 0.7807 1.4252 -0.2165 -0.5710 -0.1876 71 SER D O 4817 C CB . SER D 70 ? 2.0905 0.7570 1.7040 -0.2204 -0.7031 -0.1502 71 SER D CB 4818 N N . GLN D 71 ? 1.9107 0.8235 1.6004 -0.3398 -0.6407 -0.1575 72 GLN D N 4819 C CA . GLN D 71 ? 1.7957 0.8626 1.5345 -0.3963 -0.5960 -0.1328 72 GLN D CA 4820 C C . GLN D 71 ? 1.7198 0.8632 1.4691 -0.4145 -0.5505 -0.0754 72 GLN D C 4821 O O . GLN D 71 ? 1.5871 0.8756 1.3728 -0.4076 -0.4991 -0.0727 72 GLN D O 4822 C CB . GLN D 71 ? 1.8767 0.9205 1.6357 -0.4917 -0.6266 -0.1206 72 GLN D CB 4823 N N . GLU D 72 ? 1.8186 0.8555 1.5293 -0.4340 -0.5739 -0.0317 73 GLU D N 4824 C CA . GLU D 72 ? 1.7779 0.8705 1.4823 -0.4606 -0.5394 0.0261 73 GLU D CA 4825 C C . GLU D 72 ? 1.6620 0.8318 1.3712 -0.3817 -0.5024 0.0134 73 GLU D C 4826 O O . GLU D 72 ? 1.5831 0.8525 1.3028 -0.3998 -0.4597 0.0440 73 GLU D O 4827 C CB . GLU D 72 ? 1.9430 0.8835 1.5899 -0.5057 -0.5839 0.0815 73 GLU D CB 4828 C CG . GLU D 72 ? 2.0595 0.9440 1.7025 -0.6140 -0.6079 0.1153 73 GLU D CG 4829 N N . ASN D 73 ? 1.6592 0.7891 1.3622 -0.2977 -0.5175 -0.0347 74 ASN D N 4830 C CA . ASN D 73 ? 1.5713 0.7659 1.2822 -0.2268 -0.4877 -0.0473 74 ASN D CA 4831 C C . ASN D 73 ? 1.4734 0.7507 1.2109 -0.1641 -0.4575 -0.1048 74 ASN D C 4832 O O . ASN D 73 ? 1.5152 0.7504 1.2456 -0.1420 -0.4787 -0.1486 74 ASN D O 4833 C CB . ASN D 73 ? 1.6744 0.7531 1.3518 -0.1808 -0.5315 -0.0405 74 ASN D CB 4834 N N . PHE D 74 ? 1.3574 0.7464 1.1182 -0.1388 -0.4096 -0.1034 75 PHE D N 4835 C CA . PHE D 74 ? 1.2672 0.7428 1.0475 -0.0927 -0.3730 -0.1448 75 PHE D CA 4836 C C . PHE D 74 ? 1.1968 0.7380 0.9929 -0.0482 -0.3408 -0.1473 75 PHE D C 4837 O O . PHE D 74 ? 1.1318 0.7380 0.9424 -0.0712 -0.3132 -0.1174 75 PHE D O 4838 C CB . PHE D 74 ? 1.1908 0.7554 0.9935 -0.1327 -0.3432 -0.1387 75 PHE D CB 4839 C CG . PHE D 74 ? 1.1220 0.7562 0.9308 -0.0925 -0.3131 -0.1730 75 PHE D CG 4840 C CD1 . PHE D 74 ? 1.1697 0.7665 0.9530 -0.0461 -0.3264 -0.2170 75 PHE D CD1 4841 C CD2 . PHE D 74 ? 1.0270 0.7594 0.8603 -0.1023 -0.2727 -0.1611 75 PHE D CD2 4842 C CE1 . PHE D 74 ? 1.1245 0.7835 0.8990 -0.0158 -0.2969 -0.2413 75 PHE D CE1 4843 C CE2 . PHE D 74 ? 0.9823 0.7630 0.8105 -0.0696 -0.2491 -0.1843 75 PHE D CE2 4844 C CZ . PHE D 74 ? 1.0302 0.7753 0.8251 -0.0296 -0.2600 -0.2207 75 PHE D CZ 4845 N N . SER D 75 ? 1.2159 0.7462 1.0115 0.0141 -0.3441 -0.1875 76 SER D N 4846 C CA . SER D 75 ? 1.1678 0.7588 0.9875 0.0554 -0.3209 -0.1942 76 SER D CA 4847 C C . SER D 75 ? 1.0865 0.7753 0.9229 0.0800 -0.2707 -0.2224 76 SER D C 4848 O O . SER D 75 ? 1.0922 0.7840 0.9101 0.0862 -0.2619 -0.2476 76 SER D O 4849 C CB . SER D 75 ? 1.2575 0.7783 1.0757 0.1099 -0.3616 -0.2172 76 SER D CB 4850 N N . LEU D 76 ? 1.0230 0.7871 0.8891 0.0901 -0.2410 -0.2158 77 LEU D N 4851 C CA . LEU D 76 ? 0.9556 0.8091 0.8377 0.1027 -0.1915 -0.2331 77 LEU D CA 4852 C C . LEU D 76 ? 0.9546 0.8590 0.8727 0.1457 -0.1816 -0.2575 77 LEU D C 4853 O O . LEU D 76 ? 0.9459 0.8651 0.8911 0.1460 -0.1942 -0.2420 77 LEU D O 4854 C CB . LEU D 76 ? 0.8767 0.7834 0.7685 0.0597 -0.1609 -0.2010 77 LEU D CB 4855 C CG . LEU D 76 ? 0.8162 0.7973 0.7196 0.0596 -0.1130 -0.2068 77 LEU D CG 4856 C CD1 . LEU D 76 ? 0.8470 0.8257 0.7184 0.0743 -0.0986 -0.2279 77 LEU D CD1 4857 C CD2 . LEU D 76 ? 0.7605 0.7676 0.6705 0.0212 -0.0958 -0.1786 77 LEU D CD2 4858 N N . ILE D 77 ? 0.9705 0.9104 0.8888 0.1811 -0.1592 -0.2971 78 ILE D N 4859 C CA . ILE D 77 ? 0.9786 0.9838 0.9415 0.2258 -0.1479 -0.3300 78 ILE D CA 4860 C C . ILE D 77 ? 0.9198 1.0335 0.9052 0.2124 -0.0879 -0.3342 78 ILE D C 4861 O O . ILE D 77 ? 0.9236 1.0529 0.8729 0.2029 -0.0549 -0.3409 78 ILE D O 4862 C CB . ILE D 77 ? 1.0651 1.0365 1.0172 0.2842 -0.1684 -0.3824 78 ILE D CB 4863 C CG1 . ILE D 77 ? 1.1443 0.9854 1.0677 0.2914 -0.2327 -0.3767 78 ILE D CG1 4864 C CG2 . ILE D 77 ? 1.0744 1.1292 1.0876 0.3370 -0.1588 -0.4218 78 ILE D CG2 4865 N N . LEU D 78 ? 0.8780 1.0614 0.9185 0.2079 -0.0776 -0.3279 79 LEU D N 4866 C CA . LEU D 78 ? 0.8396 1.1288 0.9131 0.1943 -0.0239 -0.3370 79 LEU D CA 4867 C C . LEU D 78 ? 0.8719 1.2416 0.9992 0.2454 -0.0164 -0.3858 79 LEU D C 4868 O O . LEU D 78 ? 0.8688 1.2766 1.0569 0.2688 -0.0416 -0.3959 79 LEU D O 4869 C CB . LEU D 78 ? 0.7789 1.1049 0.8856 0.1520 -0.0159 -0.3064 79 LEU D CB 4870 C CG . LEU D 78 ? 0.7426 1.0214 0.8082 0.1020 -0.0073 -0.2667 79 LEU D CG 4871 C CD1 . LEU D 78 ? 0.7455 0.9468 0.7873 0.0955 -0.0521 -0.2429 79 LEU D CD1 4872 C CD2 . LEU D 78 ? 0.6899 1.0277 0.7893 0.0643 0.0201 -0.2545 79 LEU D CD2 4873 N N . GLU D 79 ? 0.9107 1.3113 1.0142 0.2656 0.0165 -0.4185 80 GLU D N 4874 C CA . GLU D 79 ? 0.9535 1.4394 1.1058 0.3216 0.0285 -0.4757 80 GLU D CA 4875 C C . GLU D 79 ? 0.9105 1.5354 1.1525 0.3109 0.0602 -0.4839 80 GLU D C 4876 O O . GLU D 79 ? 0.9190 1.5943 1.2356 0.3547 0.0316 -0.5121 80 GLU D O 4877 C CB . GLU D 79 ? 1.0077 1.5111 1.1033 0.3359 0.0680 -0.5081 80 GLU D CB 4878 N N . LEU D 80 ? 0.8743 1.5561 1.1091 0.2518 0.1147 -0.4589 81 LEU D N 4879 C CA . LEU D 80 ? 0.8351 1.6414 1.1526 0.2222 0.1456 -0.4601 81 LEU D CA 4880 C C . LEU D 80 ? 0.7838 1.5418 1.0858 0.1569 0.1419 -0.4067 81 LEU D C 4881 O O . LEU D 80 ? 0.7838 1.5029 1.0259 0.1092 0.1740 -0.3748 81 LEU D O 4882 C CB . LEU D 80 ? 0.8623 1.7846 1.1868 0.2034 0.2187 -0.4813 81 LEU D CB 4883 C CG . LEU D 80 ? 0.9150 1.9276 1.2716 0.2692 0.2353 -0.5470 81 LEU D CG 4884 N N . ALA D 81 ? 0.7525 1.5087 1.1035 0.1592 0.0989 -0.3990 82 ALA D N 4885 C CA . ALA D 81 ? 0.7125 1.4194 1.0468 0.1057 0.0884 -0.3571 82 ALA D CA 4886 C C . ALA D 81 ? 0.6958 1.4795 1.0638 0.0454 0.1361 -0.3486 82 ALA D C 4887 O O . ALA D 81 ? 0.6980 1.6048 1.1423 0.0434 0.1607 -0.3765 82 ALA D O 4888 C CB . ALA D 81 ? 0.6993 1.3893 1.0662 0.1256 0.0293 -0.3541 82 ALA D CB 4889 N N . THR D 82 ? 0.6875 1.3976 1.0016 -0.0040 0.1473 -0.3116 83 THR D N 4890 C CA . THR D 82 ? 0.6938 1.4406 1.0222 -0.0671 0.1886 -0.2975 83 THR D CA 4891 C C . THR D 82 ? 0.6704 1.3691 1.0009 -0.1019 0.1624 -0.2786 83 THR D C 4892 O O . THR D 82 ? 0.6564 1.2678 0.9406 -0.0872 0.1288 -0.2632 83 THR D O 4893 C CB . THR D 82 ? 0.7354 1.4240 0.9827 -0.0936 0.2295 -0.2713 83 THR D CB 4894 O OG1 . THR D 82 ? 0.7595 1.4325 0.9624 -0.0465 0.2310 -0.2847 83 THR D OG1 4895 C CG2 . THR D 82 ? 0.7727 1.5366 1.0439 -0.1490 0.2848 -0.2668 83 THR D CG2 4896 N N . PRO D 83 ? 0.6734 1.4340 1.0586 -0.1505 0.1784 -0.2831 84 PRO D N 4897 C CA . PRO D 83 ? 0.6675 1.3774 1.0463 -0.1881 0.1582 -0.2711 84 PRO D CA 4898 C C . PRO D 83 ? 0.6882 1.2734 0.9813 -0.2055 0.1654 -0.2395 84 PRO D C 4899 O O . PRO D 83 ? 0.6834 1.2096 0.9560 -0.2152 0.1411 -0.2343 84 PRO D O 4900 C CB . PRO D 83 ? 0.6885 1.4828 1.1346 -0.2458 0.1859 -0.2820 84 PRO D CB 4901 C CG . PRO D 83 ? 0.6800 1.6079 1.2019 -0.2208 0.1991 -0.3115 84 PRO D CG 4902 C CD . PRO D 83 ? 0.6855 1.5820 1.1537 -0.1696 0.2109 -0.3081 84 PRO D CD 4903 N N . SER D 84 ? 0.7204 1.2714 0.9628 -0.2055 0.1970 -0.2217 85 SER D N 4904 C CA . SER D 84 ? 0.7505 1.1879 0.9137 -0.2137 0.1991 -0.1920 85 SER D CA 4905 C C . SER D 84 ? 0.7201 1.0957 0.8414 -0.1680 0.1647 -0.1883 85 SER D C 4906 O O . SER D 84 ? 0.7383 1.0322 0.8049 -0.1671 0.1602 -0.1687 85 SER D O 4907 C CB . SER D 84 ? 0.8101 1.2346 0.9248 -0.2296 0.2400 -0.1715 85 SER D CB 4908 O OG . SER D 84 ? 0.8057 1.2726 0.9097 -0.1873 0.2464 -0.1849 85 SER D OG 4909 N N . GLN D 85 ? 0.6843 1.0988 0.8336 -0.1314 0.1383 -0.2064 86 GLN D N 4910 C CA . GLN D 85 ? 0.6688 1.0280 0.7805 -0.0965 0.1067 -0.2006 86 GLN D CA 4911 C C . GLN D 85 ? 0.6431 0.9976 0.7699 -0.0942 0.0711 -0.2036 86 GLN D C 4912 O O . GLN D 85 ? 0.6366 0.9619 0.7427 -0.0702 0.0431 -0.1989 86 GLN D O 4913 C CB . GLN D 85 ? 0.6762 1.0543 0.7847 -0.0556 0.1010 -0.2137 86 GLN D CB 4914 C CG . GLN D 85 ? 0.7184 1.0923 0.7879 -0.0542 0.1346 -0.2110 86 GLN D CG 4915 C CD . GLN D 85 ? 0.7376 1.1525 0.8152 -0.0130 0.1351 -0.2382 86 GLN D CD 4916 O OE1 . GLN D 85 ? 0.7308 1.2183 0.8694 0.0050 0.1309 -0.2639 86 GLN D OE1 4917 N NE2 . GLN D 85 ? 0.7705 1.1408 0.7878 0.0056 0.1370 -0.2373 86 GLN D NE2 4918 N N . THR D 86 ? 0.6392 1.0197 0.7959 -0.1237 0.0720 -0.2107 87 THR D N 4919 C CA . THR D 86 ? 0.6264 1.0032 0.7831 -0.1267 0.0415 -0.2145 87 THR D CA 4920 C C . THR D 86 ? 0.6303 0.9393 0.7378 -0.1333 0.0420 -0.2023 87 THR D C 4921 O O . THR D 86 ? 0.6516 0.9296 0.7500 -0.1549 0.0602 -0.2025 87 THR D O 4922 C CB . THR D 86 ? 0.6324 1.0616 0.8350 -0.1569 0.0394 -0.2331 87 THR D CB 4923 O OG1 . THR D 86 ? 0.6225 1.1352 0.8851 -0.1465 0.0356 -0.2488 87 THR D OG1 4924 C CG2 . THR D 86 ? 0.6374 1.0592 0.8226 -0.1602 0.0076 -0.2388 87 THR D CG2 4925 N N . SER D 87 ? 0.6198 0.9061 0.6982 -0.1148 0.0211 -0.1923 88 SER D N 4926 C CA . SER D 87 ? 0.6177 0.8626 0.6604 -0.1180 0.0223 -0.1847 88 SER D CA 4927 C C . SER D 87 ? 0.6160 0.8613 0.6364 -0.1121 -0.0020 -0.1748 88 SER D C 4928 O O . SER D 87 ? 0.6242 0.8888 0.6492 -0.1065 -0.0253 -0.1720 88 SER D O 4929 C CB . SER D 87 ? 0.6215 0.8267 0.6442 -0.1068 0.0368 -0.1734 88 SER D CB 4930 O OG . SER D 87 ? 0.6414 0.8413 0.6712 -0.1146 0.0594 -0.1737 88 SER D OG 4931 N N . VAL D 88 ? 0.6151 0.8404 0.6116 -0.1145 0.0021 -0.1684 89 VAL D N 4932 C CA . VAL D 88 ? 0.6227 0.8479 0.5945 -0.1189 -0.0145 -0.1531 89 VAL D CA 4933 C C . VAL D 88 ? 0.6182 0.8156 0.5845 -0.1093 -0.0161 -0.1408 89 VAL D C 4934 O O . VAL D 88 ? 0.6090 0.7988 0.5796 -0.1043 -0.0013 -0.1462 89 VAL D O 4935 C CB . VAL D 88 ? 0.6325 0.8800 0.5876 -0.1355 -0.0049 -0.1610 89 VAL D CB 4936 C CG1 . VAL D 88 ? 0.6569 0.9137 0.5800 -0.1516 -0.0197 -0.1397 89 VAL D CG1 4937 C CG2 . VAL D 88 ? 0.6442 0.9123 0.6035 -0.1439 -0.0003 -0.1848 89 VAL D CG2 4938 N N . TYR D 89 ? 0.6362 0.8123 0.5915 -0.1048 -0.0392 -0.1259 90 TYR D N 4939 C CA . TYR D 89 ? 0.6423 0.7866 0.5911 -0.0974 -0.0469 -0.1191 90 TYR D CA 4940 C C . TYR D 89 ? 0.6651 0.8026 0.5968 -0.1219 -0.0598 -0.1009 90 TYR D C 4941 O O . TYR D 89 ? 0.6962 0.8296 0.6079 -0.1393 -0.0749 -0.0840 90 TYR D O 4942 C CB . TYR D 89 ? 0.6604 0.7763 0.6107 -0.0726 -0.0636 -0.1232 90 TYR D CB 4943 C CG . TYR D 89 ? 0.6394 0.7779 0.6102 -0.0547 -0.0427 -0.1415 90 TYR D CG 4944 C CD1 . TYR D 89 ? 0.6338 0.8041 0.6289 -0.0478 -0.0446 -0.1507 90 TYR D CD1 4945 C CD2 . TYR D 89 ? 0.6282 0.7608 0.5932 -0.0482 -0.0218 -0.1476 90 TYR D CD2 4946 C CE1 . TYR D 89 ? 0.6117 0.8159 0.6325 -0.0409 -0.0208 -0.1668 90 TYR D CE1 4947 C CE2 . TYR D 89 ? 0.6184 0.7719 0.5945 -0.0418 0.0018 -0.1583 90 TYR D CE2 4948 C CZ . TYR D 89 ? 0.6079 0.8014 0.6158 -0.0412 0.0049 -0.1684 90 TYR D CZ 4949 O OH . TYR D 89 ? 0.6042 0.8305 0.6296 -0.0439 0.0325 -0.1783 90 TYR D OH 4950 N N . PHE D 90 ? 0.6585 0.7985 0.5972 -0.1262 -0.0550 -0.1026 91 PHE D N 4951 C CA . PHE D 90 ? 0.6816 0.8311 0.6163 -0.1572 -0.0630 -0.0875 91 PHE D CA 4952 C C . PHE D 90 ? 0.7121 0.8173 0.6436 -0.1576 -0.0876 -0.0835 91 PHE D C 4953 O O . PHE D 90 ? 0.7031 0.7882 0.6376 -0.1299 -0.0905 -0.0990 91 PHE D O 4954 C CB . PHE D 90 ? 0.6535 0.8652 0.6129 -0.1650 -0.0389 -0.0996 91 PHE D CB 4955 C CG . PHE D 90 ? 0.6411 0.8956 0.5983 -0.1693 -0.0165 -0.1090 91 PHE D CG 4956 C CD1 . PHE D 90 ? 0.6134 0.8695 0.5815 -0.1436 -0.0017 -0.1310 91 PHE D CD1 4957 C CD2 . PHE D 90 ? 0.6691 0.9579 0.6067 -0.2026 -0.0110 -0.0963 91 PHE D CD2 4958 C CE1 . PHE D 90 ? 0.6085 0.8965 0.5726 -0.1474 0.0147 -0.1466 91 PHE D CE1 4959 C CE2 . PHE D 90 ? 0.6690 0.9990 0.5960 -0.2047 0.0085 -0.1114 91 PHE D CE2 4960 C CZ . PHE D 90 ? 0.6379 0.9660 0.5809 -0.1752 0.0197 -0.1401 91 PHE D CZ 4961 N N . CYS D 91 ? 0.7612 0.8493 0.6811 -0.1932 -0.1056 -0.0626 92 CYS D N 4962 C CA . CYS D 91 ? 0.8081 0.8487 0.7254 -0.2030 -0.1337 -0.0608 92 CYS D CA 4963 C C . CYS D 91 ? 0.8186 0.9072 0.7588 -0.2487 -0.1299 -0.0520 92 CYS D C 4964 O O . CYS D 91 ? 0.8410 0.9594 0.7748 -0.2902 -0.1198 -0.0297 92 CYS D O 4965 C CB . CYS D 91 ? 0.8803 0.8345 0.7634 -0.2061 -0.1684 -0.0439 92 CYS D CB 4966 S SG . CYS D 91 ? 0.9711 0.8433 0.8447 -0.2173 -0.2103 -0.0485 92 CYS D SG 4967 N N . ALA D 92 ? 0.8101 0.9144 0.7763 -0.2424 -0.1380 -0.0704 93 ALA D N 4968 C CA . ALA D 92 ? 0.8183 0.9890 0.8239 -0.2828 -0.1360 -0.0692 93 ALA D CA 4969 C C . ALA D 92 ? 0.8784 1.0013 0.8855 -0.3098 -0.1741 -0.0691 93 ALA D C 4970 O O . ALA D 92 ? 0.9147 0.9497 0.8891 -0.2863 -0.2022 -0.0773 93 ALA D O 4971 C CB . ALA D 92 ? 0.7599 1.0131 0.8086 -0.2526 -0.1160 -0.0949 93 ALA D CB 4972 N N . SER D 93 ? 0.8967 1.0832 0.9447 -0.3602 -0.1749 -0.0643 94 SER D N 4973 C CA . SER D 93 ? 0.9636 1.1112 1.0206 -0.3968 -0.2139 -0.0665 94 SER D CA 4974 C C . SER D 93 ? 0.9507 1.2148 1.0803 -0.4325 -0.2101 -0.0786 94 SER D C 4975 O O . SER D 93 ? 0.9094 1.2848 1.0808 -0.4438 -0.1734 -0.0774 94 SER D O 4976 C CB . SER D 93 ? 1.0570 1.1121 1.0730 -0.4506 -0.2347 -0.0316 94 SER D CB 4977 O OG . SER D 93 ? 1.0853 1.2117 1.1263 -0.5231 -0.2145 -0.0036 94 SER D OG 4978 N N . GLY D 94 ? 0.9938 1.2369 1.1408 -0.4484 -0.2499 -0.0951 95 GLY D N 4979 C CA . GLY D 94 ? 0.9883 1.3475 1.2142 -0.4804 -0.2565 -0.1122 95 GLY D CA 4980 C C . GLY D 94 ? 1.0683 1.3722 1.2982 -0.5166 -0.3096 -0.1245 95 GLY D C 4981 O O . GLY D 94 ? 1.1253 1.2953 1.2914 -0.5013 -0.3419 -0.1278 95 GLY D O 4982 N N . ASP D 95 ? 1.0779 1.4904 1.3870 -0.5638 -0.3199 -0.1366 96 ASP D N 4983 C CA . ASP D 95 ? 1.1607 1.5336 1.4841 -0.6101 -0.3737 -0.1516 96 ASP D CA 4984 C C . ASP D 95 ? 1.1418 1.5457 1.4825 -0.5533 -0.4113 -0.1964 96 ASP D C 4985 O O . ASP D 95 ? 1.2033 1.5008 1.4913 -0.5367 -0.4569 -0.2169 96 ASP D O 4986 C CB . ASP D 95 ? 1.1985 1.6757 1.6020 -0.7095 -0.3669 -0.1370 96 ASP D CB 4987 N N . ALA D 101 ? 0.8345 1.9080 1.5140 -0.3448 -0.2992 -0.2780 102 ALA D N 4988 C CA . ALA D 101 ? 0.8435 1.7803 1.4251 -0.3692 -0.2718 -0.2428 102 ALA D CA 4989 C C . ALA D 101 ? 0.8021 1.7829 1.3854 -0.3675 -0.2095 -0.2306 102 ALA D C 4990 O O . ALA D 101 ? 0.7615 1.7958 1.3683 -0.3050 -0.1909 -0.2497 102 ALA D O 4991 C CB . ALA D 101 ? 0.8533 1.6362 1.3316 -0.3094 -0.2958 -0.2383 102 ALA D CB 4992 N N . GLU D 102 ? 0.8266 1.7768 1.3789 -0.4359 -0.1817 -0.1993 103 GLU D N 4993 C CA . GLU D 102 ? 0.8025 1.7810 1.3355 -0.4414 -0.1255 -0.1847 103 GLU D CA 4994 C C . GLU D 102 ? 0.8151 1.6319 1.2380 -0.4350 -0.1229 -0.1528 103 GLU D C 4995 O O . GLU D 102 ? 0.8714 1.6107 1.2499 -0.4935 -0.1320 -0.1211 103 GLU D O 4996 C CB . GLU D 102 ? 0.8342 1.9288 1.4179 -0.5299 -0.0919 -0.1708 103 GLU D CB 4997 C CG . GLU D 102 ? 0.8325 2.1029 1.5404 -0.5519 -0.0973 -0.2030 103 GLU D CG 4998 C CD . GLU D 102 ? 0.8655 2.2811 1.6276 -0.6362 -0.0472 -0.1925 103 GLU D CD 4999 O OE1 . GLU D 102 ? 0.8682 2.2845 1.5797 -0.6484 0.0019 -0.1735 103 GLU D OE1 5000 O OE2 . GLU D 102 ? 0.8925 2.4288 1.7473 -0.6929 -0.0567 -0.2042 103 GLU D OE2 5001 N N . GLN D 103 ? 0.7710 1.5355 1.1531 -0.3641 -0.1140 -0.1617 106 GLN D N 5002 C CA . GLN D 103 ? 0.7766 1.4068 1.0679 -0.3514 -0.1122 -0.1377 106 GLN D CA 5003 C C . GLN D 103 ? 0.7828 1.4277 1.0453 -0.3847 -0.0721 -0.1149 106 GLN D C 5004 O O . GLN D 103 ? 0.7519 1.4815 1.0384 -0.3669 -0.0360 -0.1306 106 GLN D O 5005 C CB . GLN D 103 ? 0.7400 1.3120 0.9993 -0.2736 -0.1174 -0.1536 106 GLN D CB 5006 C CG . GLN D 103 ? 0.7568 1.2693 1.0010 -0.2443 -0.1609 -0.1648 106 GLN D CG 5007 C CD . GLN D 103 ? 0.7449 1.1676 0.9269 -0.1864 -0.1618 -0.1658 106 GLN D CD 5008 O OE1 . GLN D 103 ? 0.7373 1.1074 0.8766 -0.1816 -0.1398 -0.1523 106 GLN D OE1 5009 N NE2 . GLN D 103 ? 0.7551 1.1642 0.9303 -0.1454 -0.1884 -0.1805 106 GLN D NE2 5010 N N . PHE D 104 ? 0.8351 1.3926 1.0412 -0.4308 -0.0826 -0.0797 107 PHE D N 5011 C CA . PHE D 104 ? 0.8600 1.4131 1.0198 -0.4637 -0.0537 -0.0508 107 PHE D CA 5012 C C . PHE D 104 ? 0.8557 1.2942 0.9446 -0.4218 -0.0633 -0.0405 107 PHE D C 5013 O O . PHE D 104 ? 0.8813 1.2124 0.9382 -0.4071 -0.0985 -0.0340 107 PHE D O 5014 C CB . PHE D 104 ? 0.9438 1.4844 1.0884 -0.5512 -0.0605 -0.0118 107 PHE D CB 5015 C CG . PHE D 104 ? 0.9514 1.6362 1.1737 -0.6047 -0.0392 -0.0210 107 PHE D CG 5016 C CD1 . PHE D 104 ? 0.9516 1.7627 1.1904 -0.6347 0.0122 -0.0199 107 PHE D CD1 5017 C CD2 . PHE D 104 ? 0.9586 1.6644 1.2406 -0.6246 -0.0704 -0.0356 107 PHE D CD2 5018 C CE1 . PHE D 104 ? 0.9540 1.9208 1.2760 -0.6836 0.0370 -0.0334 107 PHE D CE1 5019 C CE2 . PHE D 104 ? 0.9599 1.8176 1.3283 -0.6753 -0.0517 -0.0477 107 PHE D CE2 5020 C CZ . PHE D 104 ? 0.9561 1.9498 1.3487 -0.7047 0.0044 -0.0467 107 PHE D CZ 5021 N N . PHE D 105 ? 0.8270 1.2974 0.8961 -0.4020 -0.0322 -0.0444 108 PHE D N 5022 C CA . PHE D 105 ? 0.8081 1.1993 0.8294 -0.3567 -0.0381 -0.0446 108 PHE D CA 5023 C C . PHE D 105 ? 0.8673 1.2038 0.8227 -0.3864 -0.0426 -0.0086 108 PHE D C 5024 O O . PHE D 105 ? 0.9203 1.2944 0.8565 -0.4415 -0.0287 0.0168 108 PHE D O 5025 C CB . PHE D 105 ? 0.7473 1.1965 0.7903 -0.3095 -0.0094 -0.0782 108 PHE D CB 5026 C CG . PHE D 105 ? 0.6970 1.1694 0.7897 -0.2665 -0.0149 -0.1091 108 PHE D CG 5027 C CD1 . PHE D 105 ? 0.6714 1.0734 0.7481 -0.2187 -0.0296 -0.1184 108 PHE D CD1 5028 C CD2 . PHE D 105 ? 0.6844 1.2541 0.8390 -0.2743 -0.0066 -0.1277 108 PHE D CD2 5029 C CE1 . PHE D 105 ? 0.6514 1.0640 0.7585 -0.1805 -0.0385 -0.1399 108 PHE D CE1 5030 C CE2 . PHE D 105 ? 0.6568 1.2425 0.8528 -0.2293 -0.0204 -0.1538 108 PHE D CE2 5031 C CZ . PHE D 105 ? 0.6448 1.1441 0.8097 -0.1829 -0.0377 -0.1569 108 PHE D CZ 5032 N N . GLY D 106 ? 0.8665 1.1195 0.7867 -0.3495 -0.0627 -0.0061 109 GLY D N 5033 C CA . GLY D 106 ? 0.9263 1.1204 0.7851 -0.3639 -0.0779 0.0256 109 GLY D CA 5034 C C . GLY D 106 ? 0.9018 1.1394 0.7419 -0.3448 -0.0549 0.0143 109 GLY D C 5035 O O . GLY D 106 ? 0.8400 1.1430 0.7156 -0.3191 -0.0267 -0.0202 109 GLY D O 5036 N N . PRO D 107 ? 0.9622 1.1561 0.7438 -0.3553 -0.0727 0.0423 110 PRO D N 5037 C CA . PRO D 107 ? 0.9598 1.1932 0.7114 -0.3462 -0.0583 0.0341 110 PRO D CA 5038 C C . PRO D 107 ? 0.8904 1.1272 0.6749 -0.2912 -0.0560 -0.0045 110 PRO D C 5039 O O . PRO D 107 ? 0.8739 1.1614 0.6541 -0.2835 -0.0356 -0.0274 110 PRO D O 5040 C CB . PRO D 107 ? 1.0550 1.2167 0.7350 -0.3652 -0.0954 0.0790 110 PRO D CB 5041 C CG . PRO D 107 ? 1.1208 1.2116 0.7889 -0.3990 -0.1206 0.1150 110 PRO D CG 5042 C CD . PRO D 107 ? 1.0500 1.1417 0.7871 -0.3731 -0.1165 0.0828 110 PRO D CD 5043 N N . GLY D 108 ? 0.8617 1.0454 0.6753 -0.2572 -0.0759 -0.0130 111 GLY D N 5044 C CA . GLY D 108 ? 0.8036 0.9922 0.6489 -0.2141 -0.0704 -0.0449 111 GLY D CA 5045 C C . GLY D 108 ? 0.8243 0.9841 0.6542 -0.1942 -0.0974 -0.0407 111 GLY D C 5046 O O . GLY D 108 ? 0.8738 1.0374 0.6622 -0.2105 -0.1110 -0.0232 111 GLY D O 5047 N N . THR D 109 ? 0.7923 0.9313 0.6551 -0.1585 -0.1053 -0.0579 112 THR D N 5048 C CA . THR D 109 ? 0.8049 0.9347 0.6737 -0.1326 -0.1308 -0.0621 112 THR D CA 5049 C C . THR D 109 ? 0.7531 0.9353 0.6594 -0.1193 -0.1093 -0.0938 112 THR D C 5050 O O . THR D 109 ? 0.7082 0.9016 0.6446 -0.1111 -0.0825 -0.1129 112 THR D O 5051 C CB . THR D 109 ? 0.8264 0.9034 0.7094 -0.1008 -0.1570 -0.0627 112 THR D CB 5052 O OG1 . THR D 109 ? 0.8825 0.8960 0.7309 -0.1184 -0.1798 -0.0351 112 THR D OG1 5053 C CG2 . THR D 109 ? 0.8525 0.9305 0.7487 -0.0689 -0.1890 -0.0685 112 THR D CG2 5054 N N . ARG D 110 ? 0.7692 0.9786 0.6692 -0.1207 -0.1249 -0.0971 113 ARG D N 5055 C CA . ARG D 110 ? 0.7325 0.9897 0.6721 -0.1149 -0.1118 -0.1274 113 ARG D CA 5056 C C . ARG D 110 ? 0.7276 0.9974 0.7123 -0.0841 -0.1310 -0.1383 113 ARG D C 5057 O O . ARG D 110 ? 0.7652 1.0384 0.7469 -0.0689 -0.1697 -0.1313 113 ARG D O 5058 C CB . ARG D 110 ? 0.7591 1.0501 0.6714 -0.1350 -0.1196 -0.1338 113 ARG D CB 5059 N N . LEU D 111 ? 0.6878 0.9680 0.7127 -0.0731 -0.1043 -0.1555 114 LEU D N 5060 C CA . LEU D 111 ? 0.6802 0.9949 0.7565 -0.0455 -0.1102 -0.1735 114 LEU D CA 5061 C C . LEU D 111 ? 0.6503 1.0273 0.7738 -0.0630 -0.0845 -0.1979 114 LEU D C 5062 O O . LEU D 111 ? 0.6282 0.9977 0.7522 -0.0819 -0.0482 -0.2021 114 LEU D O 5063 C CB . LEU D 111 ? 0.6767 0.9614 0.7556 -0.0226 -0.0974 -0.1754 114 LEU D CB 5064 C CG . LEU D 111 ? 0.6740 1.0045 0.8047 0.0093 -0.0927 -0.2008 114 LEU D CG 5065 C CD1 . LEU D 111 ? 0.7153 1.0418 0.8604 0.0498 -0.1402 -0.2047 114 LEU D CD1 5066 C CD2 . LEU D 111 ? 0.6696 0.9755 0.7866 0.0194 -0.0651 -0.2063 114 LEU D CD2 5067 N N . THR D 112 ? 0.6598 1.0940 0.8215 -0.0584 -0.1080 -0.2124 115 THR D N 5068 C CA . THR D 112 ? 0.6423 1.1457 0.8621 -0.0797 -0.0884 -0.2381 115 THR D CA 5069 C C . THR D 112 ? 0.6357 1.2044 0.9230 -0.0522 -0.0851 -0.2566 115 THR D C 5070 O O . THR D 112 ? 0.6580 1.2485 0.9660 -0.0134 -0.1231 -0.2612 115 THR D O 5071 C CB . THR D 112 ? 0.6631 1.2040 0.8880 -0.0988 -0.1179 -0.2495 115 THR D CB 5072 O OG1 . THR D 112 ? 0.6724 1.1668 0.8409 -0.1281 -0.1067 -0.2442 115 THR D OG1 5073 C CG2 . THR D 112 ? 0.6570 1.2835 0.9599 -0.1199 -0.1088 -0.2799 115 THR D CG2 5074 N N . VAL D 113 ? 0.6164 1.2152 0.9347 -0.0708 -0.0398 -0.2672 116 VAL D N 5075 C CA . VAL D 113 ? 0.6120 1.2921 0.9962 -0.0495 -0.0243 -0.2895 116 VAL D CA 5076 C C . VAL D 113 ? 0.6050 1.3840 1.0642 -0.0887 -0.0046 -0.3117 116 VAL D C 5077 O O . VAL D 113 ? 0.6078 1.3731 1.0586 -0.1377 0.0329 -0.3055 116 VAL D O 5078 C CB . VAL D 113 ? 0.6133 1.2607 0.9673 -0.0407 0.0158 -0.2834 116 VAL D CB 5079 C CG1 . VAL D 113 ? 0.6249 1.3527 1.0344 -0.0008 0.0237 -0.3117 116 VAL D CG1 5080 C CG2 . VAL D 113 ? 0.6182 1.1585 0.8942 -0.0217 -0.0006 -0.2595 116 VAL D CG2 5081 N N . LEU D 114 ? 0.6055 1.4814 1.1397 -0.0677 -0.0339 -0.3371 117 LEU D N 5082 C CA . LEU D 114 ? 0.6026 1.5862 1.2200 -0.1091 -0.0241 -0.3617 117 LEU D CA 5083 C C . LEU D 114 ? 0.5984 1.7097 1.3070 -0.1016 0.0099 -0.3895 117 LEU D C 5084 O O . LEU D 114 ? 0.6010 1.7336 1.3207 -0.0452 0.0093 -0.4005 117 LEU D O 5085 C CB . LEU D 114 ? 0.6138 1.6360 1.2588 -0.0998 -0.0853 -0.3748 117 LEU D CB 5086 N N . GLU D 115 ? 0.6000 1.7967 1.3734 -0.1614 0.0407 -0.4034 118 GLU D N 5087 C CA . GLU D 115 ? 0.6013 1.9476 1.4739 -0.1680 0.0794 -0.4324 118 GLU D CA 5088 C C . GLU D 115 ? 0.5934 2.0770 1.5746 -0.1204 0.0326 -0.4731 118 GLU D C 5089 O O . GLU D 115 ? 0.5944 2.1608 1.6282 -0.0629 0.0374 -0.4994 118 GLU D O 5090 C CB . GLU D 115 ? 0.6212 2.0079 1.5253 -0.2603 0.1281 -0.4284 118 GLU D CB 5091 N N . ASP D 116 ? 0.5937 2.0999 1.6058 -0.1401 -0.0163 -0.4815 119 ASP D N 5092 C CA . ASP D 116 ? 0.5961 2.2320 1.7104 -0.0962 -0.0719 -0.5185 119 ASP D CA 5093 C C . ASP D 116 ? 0.6118 2.1601 1.6638 -0.0550 -0.1522 -0.5046 119 ASP D C 5094 O O . ASP D 116 ? 0.6201 2.0942 1.6119 -0.0994 -0.1704 -0.4881 119 ASP D O 5095 C CB . ASP D 116 ? 0.5987 2.3858 1.8297 -0.1630 -0.0607 -0.5493 119 ASP D CB 5096 N N . LEU D 117 ? 0.8604 1.5733 1.0461 0.0477 0.1191 -0.4679 120 LEU D N 5097 C CA . LEU D 117 ? 0.8064 1.5176 1.0534 0.0854 0.0873 -0.4553 120 LEU D CA 5098 C C . LEU D 117 ? 0.7743 1.5653 1.0758 0.0792 0.0877 -0.4554 120 LEU D C 5099 O O . LEU D 117 ? 0.7388 1.5271 1.0810 0.1093 0.0620 -0.4405 120 LEU D O 5100 C CB . LEU D 117 ? 0.8081 1.5189 1.0931 0.1351 0.0795 -0.4771 120 LEU D CB 5101 C CG . LEU D 117 ? 0.8240 1.4488 1.0697 0.1426 0.0649 -0.4735 120 LEU D CG 5102 N N . LYS D 118 ? 0.7954 1.6612 1.0919 0.0355 0.1190 -0.4751 121 LYS D N 5103 C CA . LYS D 118 ? 0.7706 1.7394 1.1162 0.0157 0.1232 -0.4847 121 LYS D CA 5104 C C . LYS D 118 ? 0.7722 1.6777 1.0729 -0.0298 0.1210 -0.4549 121 LYS D C 5105 O O . LYS D 118 ? 0.7611 1.7458 1.0892 -0.0616 0.1281 -0.4649 121 LYS D O 5106 C CB . LYS D 118 ? 0.7975 1.8948 1.1612 -0.0223 0.1628 -0.5292 121 LYS D CB 5107 C CG . LYS D 118 ? 0.8676 1.9057 1.1407 -0.0857 0.2051 -0.5363 121 LYS D CG 5108 N N . ASN D 119 ? 0.7922 1.5633 1.0228 -0.0304 0.1118 -0.4214 122 ASN D N 5109 C CA . ASN D 119 ? 0.8066 1.4972 0.9838 -0.0610 0.1105 -0.3902 122 ASN D CA 5110 C C . ASN D 119 ? 0.7562 1.3942 0.9591 -0.0170 0.0681 -0.3598 122 ASN D C 5111 O O . ASN D 119 ? 0.7653 1.3368 0.9285 -0.0336 0.0642 -0.3334 122 ASN D O 5112 C CB . ASN D 119 ? 0.8928 1.4692 0.9504 -0.0933 0.1394 -0.3735 122 ASN D CB 5113 C CG . ASN D 119 ? 0.9699 1.5614 0.9705 -0.1660 0.1937 -0.3956 122 ASN D CG 5114 O OD1 . ASN D 119 ? 0.9706 1.6118 0.9877 -0.2131 0.2107 -0.4087 122 ASN D OD1 5115 N ND2 . ASN D 119 ? 1.0457 1.5944 0.9716 -0.1815 0.2245 -0.4029 122 ASN D ND2 5116 N N . VAL D 120 ? 0.7159 1.3766 0.9774 0.0360 0.0420 -0.3660 123 VAL D N 5117 C CA . VAL D 120 ? 0.6800 1.2861 0.9602 0.0720 0.0081 -0.3432 123 VAL D CA 5118 C C . VAL D 120 ? 0.6434 1.2982 0.9792 0.0856 -0.0086 -0.3370 123 VAL D C 5119 O O . VAL D 120 ? 0.6342 1.3814 1.0231 0.1078 -0.0076 -0.3573 123 VAL D O 5120 C CB . VAL D 120 ? 0.6825 1.2639 0.9775 0.1133 -0.0032 -0.3555 123 VAL D CB 5121 C CG1 . VAL D 120 ? 0.6594 1.1813 0.9661 0.1378 -0.0299 -0.3379 123 VAL D CG1 5122 C CG2 . VAL D 120 ? 0.7188 1.2633 0.9555 0.1000 0.0087 -0.3621 123 VAL D CG2 5123 N N . PHE D 121 ? 0.6270 1.2255 0.9466 0.0777 -0.0245 -0.3093 124 PHE D N 5124 C CA . PHE D 121 ? 0.5963 1.2291 0.9556 0.0886 -0.0422 -0.2992 124 PHE D CA 5125 C C . PHE D 121 ? 0.5796 1.1300 0.9341 0.1122 -0.0673 -0.2735 124 PHE D C 5126 O O . PHE D 121 ? 0.5853 1.0622 0.8984 0.0997 -0.0689 -0.2595 124 PHE D O 5127 C CB . PHE D 121 ? 0.6034 1.2657 0.9422 0.0340 -0.0265 -0.2974 124 PHE D CB 5128 C CG . PHE D 121 ? 0.6217 1.4002 0.9817 0.0033 -0.0013 -0.3310 124 PHE D CG 5129 C CD1 . PHE D 121 ? 0.6010 1.5109 1.0270 0.0209 -0.0121 -0.3493 124 PHE D CD1 5130 C CD2 . PHE D 121 ? 0.6721 1.4366 0.9814 -0.0424 0.0347 -0.3462 124 PHE D CD2 5131 C CE1 . PHE D 121 ? 0.6142 1.6621 1.0678 -0.0104 0.0117 -0.3882 124 PHE D CE1 5132 C CE2 . PHE D 121 ? 0.6926 1.5734 1.0210 -0.0817 0.0638 -0.3837 124 PHE D CE2 5133 C CZ . PHE D 121 ? 0.6585 1.6923 1.0655 -0.0677 0.0518 -0.4077 124 PHE D CZ 5134 N N . PRO D 122 ? 0.5681 1.1347 0.9591 0.1492 -0.0853 -0.2682 125 PRO D N 5135 C CA . PRO D 122 ? 0.5635 1.0542 0.9453 0.1623 -0.1038 -0.2452 125 PRO D CA 5136 C C . PRO D 122 ? 0.5452 1.0330 0.9134 0.1272 -0.1083 -0.2259 125 PRO D C 5137 O O . PRO D 122 ? 0.5472 1.0881 0.9106 0.0926 -0.0948 -0.2330 125 PRO D O 5138 C CB . PRO D 122 ? 0.5823 1.0914 0.9909 0.2162 -0.1144 -0.2454 125 PRO D CB 5139 C CG . PRO D 122 ? 0.5959 1.1928 1.0319 0.2406 -0.1032 -0.2707 125 PRO D CG 5140 C CD . PRO D 122 ? 0.5730 1.2342 1.0088 0.1865 -0.0873 -0.2840 125 PRO D CD 5141 N N . PRO D 123 ? 0.5400 0.9628 0.8961 0.1299 -0.1222 -0.2053 126 PRO D N 5142 C CA . PRO D 123 ? 0.5284 0.9473 0.8687 0.0982 -0.1236 -0.1892 126 PRO D CA 5143 C C . PRO D 123 ? 0.5232 0.9879 0.8887 0.1112 -0.1381 -0.1819 126 PRO D C 5144 O O . PRO D 123 ? 0.5379 1.0003 0.9201 0.1558 -0.1509 -0.1788 126 PRO D O 5145 C CB . PRO D 123 ? 0.5277 0.8627 0.8399 0.0947 -0.1293 -0.1737 126 PRO D CB 5146 C CG . PRO D 123 ? 0.5372 0.8413 0.8606 0.1231 -0.1350 -0.1831 126 PRO D CG 5147 C CD . PRO D 123 ? 0.5527 0.9002 0.8999 0.1494 -0.1302 -0.2005 126 PRO D CD 5148 N N . GLU D 124 ? 0.5186 1.0189 0.8754 0.0730 -0.1330 -0.1802 127 GLU D N 5149 C CA . GLU D 124 ? 0.5155 1.0596 0.8868 0.0782 -0.1487 -0.1721 127 GLU D CA 5150 C C . GLU D 124 ? 0.5169 0.9688 0.8560 0.0625 -0.1530 -0.1487 127 GLU D C 5151 O O . GLU D 124 ? 0.5248 0.9290 0.8279 0.0241 -0.1367 -0.1455 127 GLU D O 5152 C CB . GLU D 124 ? 0.5168 1.1684 0.8965 0.0339 -0.1366 -0.1931 127 GLU D CB 5153 C CG . GLU D 124 ? 0.5134 1.2917 0.9345 0.0485 -0.1324 -0.2227 127 GLU D CG 5154 N N . VAL D 125 ? 0.5241 0.9432 0.8667 0.0954 -0.1713 -0.1323 128 VAL D N 5155 C CA . VAL D 125 ? 0.5268 0.8623 0.8422 0.0817 -0.1738 -0.1133 128 VAL D CA 5156 C C . VAL D 125 ? 0.5336 0.8949 0.8431 0.0729 -0.1845 -0.1019 128 VAL D C 5157 O O . VAL D 125 ? 0.5491 0.9721 0.8741 0.1039 -0.1993 -0.1013 128 VAL D O 5158 C CB . VAL D 125 ? 0.5450 0.8025 0.8540 0.1112 -0.1781 -0.1067 128 VAL D CB 5159 C CG1 . VAL D 125 ? 0.5421 0.7332 0.8281 0.0892 -0.1764 -0.0949 128 VAL D CG1 5160 C CG2 . VAL D 125 ? 0.5421 0.7889 0.8575 0.1188 -0.1685 -0.1235 128 VAL D CG2 5161 N N . ALA D 126 ? 0.5318 0.8492 0.8140 0.0364 -0.1769 -0.0935 129 ALA D N 5162 C CA . ALA D 126 ? 0.5422 0.8815 0.8124 0.0187 -0.1840 -0.0856 129 ALA D CA 5163 C C . ALA D 126 ? 0.5481 0.8017 0.7862 -0.0007 -0.1777 -0.0708 129 ALA D C 5164 O O . ALA D 126 ? 0.5561 0.7674 0.7694 -0.0269 -0.1588 -0.0734 129 ALA D O 5165 C CB . ALA D 126 ? 0.5443 0.9646 0.8126 -0.0259 -0.1716 -0.1054 129 ALA D CB 5166 N N . VAL D 127 ? 0.5584 0.7829 0.7888 0.0159 -0.1908 -0.0552 130 VAL D N 5167 C CA . VAL D 127 ? 0.5600 0.7160 0.7631 -0.0042 -0.1834 -0.0446 130 VAL D CA 5168 C C . VAL D 127 ? 0.5675 0.7463 0.7478 -0.0400 -0.1793 -0.0443 130 VAL D C 5169 O O . VAL D 127 ? 0.5807 0.8197 0.7634 -0.0367 -0.1938 -0.0431 130 VAL D O 5170 C CB . VAL D 127 ? 0.5862 0.6856 0.7789 0.0186 -0.1910 -0.0310 130 VAL D CB 5171 C CG1 . VAL D 127 ? 0.5944 0.6464 0.7605 -0.0077 -0.1830 -0.0230 130 VAL D CG1 5172 C CG2 . VAL D 127 ? 0.5879 0.6482 0.7917 0.0352 -0.1849 -0.0390 130 VAL D CG2 5173 N N . PHE D 128 ? 0.5689 0.7009 0.7207 -0.0703 -0.1584 -0.0468 131 PHE D N 5174 C CA . PHE D 128 ? 0.5901 0.7199 0.7069 -0.1111 -0.1462 -0.0497 131 PHE D CA 5175 C C . PHE D 128 ? 0.6016 0.6779 0.6999 -0.1103 -0.1475 -0.0359 131 PHE D C 5176 O O . PHE D 128 ? 0.5967 0.6222 0.6963 -0.0932 -0.1426 -0.0306 131 PHE D O 5177 C CB . PHE D 128 ? 0.6170 0.7046 0.6928 -0.1425 -0.1136 -0.0609 131 PHE D CB 5178 C CG . PHE D 128 ? 0.6094 0.7472 0.6926 -0.1571 -0.1049 -0.0782 131 PHE D CG 5179 C CD1 . PHE D 128 ? 0.5728 0.7250 0.6878 -0.1230 -0.1134 -0.0782 131 PHE D CD1 5180 C CD2 . PHE D 128 ? 0.6423 0.8177 0.6981 -0.2123 -0.0847 -0.0994 131 PHE D CD2 5181 C CE1 . PHE D 128 ? 0.5771 0.7788 0.6981 -0.1387 -0.1029 -0.0961 131 PHE D CE1 5182 C CE2 . PHE D 128 ? 0.6433 0.8737 0.7052 -0.2346 -0.0718 -0.1209 131 PHE D CE2 5183 C CZ . PHE D 128 ? 0.6105 0.8531 0.7058 -0.1952 -0.0813 -0.1177 131 PHE D CZ 5184 N N . GLU D 129 ? 0.6209 0.7217 0.7021 -0.1307 -0.1538 -0.0336 132 GLU D N 5185 C CA . GLU D 129 ? 0.6369 0.6924 0.6971 -0.1317 -0.1556 -0.0205 132 GLU D CA 5186 C C . GLU D 129 ? 0.6601 0.6614 0.6790 -0.1662 -0.1281 -0.0261 132 GLU D C 5187 O O . GLU D 129 ? 0.6825 0.6832 0.6742 -0.1984 -0.1080 -0.0400 132 GLU D O 5188 C CB . GLU D 129 ? 0.6596 0.7666 0.7127 -0.1258 -0.1788 -0.0118 132 GLU D CB 5189 C CG . GLU D 129 ? 0.6689 0.7917 0.7412 -0.0734 -0.2021 0.0016 132 GLU D CG 5190 C CD . GLU D 129 ? 0.7216 0.8846 0.7686 -0.0503 -0.2251 0.0160 132 GLU D CD 5191 O OE1 . GLU D 129 ? 0.7365 0.9476 0.7635 -0.0809 -0.2277 0.0102 132 GLU D OE1 5192 O OE2 . GLU D 129 ? 0.7579 0.8998 0.7957 0.0012 -0.2386 0.0328 132 GLU D OE2 5193 N N . PRO D 130 ? 0.6663 0.6165 0.6730 -0.1614 -0.1221 -0.0179 133 PRO D N 5194 C CA . PRO D 130 ? 0.6955 0.5900 0.6623 -0.1804 -0.0942 -0.0229 133 PRO D CA 5195 C C . PRO D 130 ? 0.7384 0.6327 0.6602 -0.2256 -0.0818 -0.0308 133 PRO D C 5196 O O . PRO D 130 ? 0.7402 0.6873 0.6649 -0.2396 -0.1016 -0.0287 133 PRO D O 5197 C CB . PRO D 130 ? 0.6906 0.5625 0.6641 -0.1693 -0.0962 -0.0157 133 PRO D CB 5198 C CG . PRO D 130 ? 0.6671 0.5601 0.6791 -0.1439 -0.1167 -0.0098 133 PRO D CG 5199 C CD . PRO D 130 ? 0.6604 0.5989 0.6830 -0.1388 -0.1367 -0.0059 133 PRO D CD 5200 N N . SER D 131 ? 0.7843 0.6170 0.6557 -0.2455 -0.0472 -0.0409 134 SER D N 5201 C CA . SER D 131 ? 0.8420 0.6580 0.6577 -0.2986 -0.0256 -0.0548 134 SER D CA 5202 C C . SER D 131 ? 0.8602 0.6461 0.6550 -0.3042 -0.0212 -0.0495 134 SER D C 5203 O O . SER D 131 ? 0.8575 0.5986 0.6544 -0.2725 -0.0118 -0.0423 134 SER D O 5204 C CB . SER D 131 ? 0.9171 0.6473 0.6647 -0.3186 0.0197 -0.0682 134 SER D CB 5205 O OG . SER D 131 ? 0.9461 0.5932 0.6672 -0.2759 0.0404 -0.0585 134 SER D OG 5206 N N . GLU D 132 ? 0.8834 0.7068 0.6580 -0.3450 -0.0277 -0.0563 135 GLU D N 5207 C CA . GLU D 132 ? 0.9122 0.7062 0.6570 -0.3582 -0.0207 -0.0532 135 GLU D CA 5208 C C . GLU D 132 ? 0.9707 0.6634 0.6614 -0.3618 0.0244 -0.0621 135 GLU D C 5209 O O . GLU D 132 ? 0.9746 0.6367 0.6644 -0.3416 0.0313 -0.0557 135 GLU D O 5210 C CB . GLU D 132 ? 0.9409 0.7963 0.6591 -0.4060 -0.0316 -0.0639 135 GLU D CB 5211 N N . ALA D 133 ? 1.0291 0.6660 0.6675 -0.3851 0.0588 -0.0779 136 ALA D N 5212 C CA . ALA D 133 ? 1.1096 0.6278 0.6764 -0.3744 0.1074 -0.0835 136 ALA D CA 5213 C C . ALA D 133 ? 1.0787 0.5764 0.6758 -0.2990 0.1048 -0.0675 136 ALA D C 5214 O O . ALA D 133 ? 1.1223 0.5667 0.6862 -0.2758 0.1294 -0.0688 136 ALA D O 5215 C CB . ALA D 133 ? 1.1964 0.6401 0.6905 -0.4059 0.1476 -0.0996 136 ALA D CB 5216 N N . GLU D 134 ? 1.0087 0.5607 0.6691 -0.2612 0.0760 -0.0567 137 GLU D N 5217 C CA . GLU D 134 ? 0.9732 0.5407 0.6733 -0.1964 0.0681 -0.0482 137 GLU D CA 5218 C C . GLU D 134 ? 0.9254 0.5463 0.6726 -0.1951 0.0506 -0.0471 137 GLU D C 5219 O O . GLU D 134 ? 0.9327 0.5549 0.6845 -0.1601 0.0630 -0.0516 137 GLU D O 5220 C CB . GLU D 134 ? 0.9142 0.5316 0.6677 -0.1666 0.0422 -0.0415 137 GLU D CB 5221 C CG . GLU D 134 ? 0.8870 0.5349 0.6765 -0.1033 0.0358 -0.0396 137 GLU D CG 5222 C CD . GLU D 134 ? 0.8211 0.5333 0.6727 -0.0851 0.0056 -0.0366 137 GLU D CD 5223 O OE1 . GLU D 134 ? 0.8320 0.5282 0.6694 -0.0935 0.0052 -0.0337 137 GLU D OE1 5224 O OE2 . GLU D 134 ? 0.7599 0.5376 0.6703 -0.0676 -0.0133 -0.0410 137 GLU D OE2 5225 N N . ILE D 135 ? 0.8872 0.5538 0.6620 -0.2315 0.0244 -0.0425 138 ILE D N 5226 C CA . ILE D 135 ? 0.8662 0.5624 0.6665 -0.2378 0.0132 -0.0397 138 ILE D CA 5227 C C . ILE D 135 ? 0.9266 0.5807 0.6775 -0.2573 0.0424 -0.0484 138 ILE D C 5228 O O . ILE D 135 ? 0.9236 0.5907 0.6883 -0.2498 0.0499 -0.0533 138 ILE D O 5229 C CB . ILE D 135 ? 0.8399 0.5750 0.6582 -0.2605 -0.0191 -0.0274 138 ILE D CB 5230 C CG1 . ILE D 135 ? 0.7865 0.5590 0.6517 -0.2348 -0.0439 -0.0209 138 ILE D CG1 5231 C CG2 . ILE D 135 ? 0.8444 0.5821 0.6670 -0.2682 -0.0232 -0.0219 138 ILE D CG2 5232 C CD1 . ILE D 135 ? 0.7666 0.5784 0.6359 -0.2447 -0.0724 -0.0105 138 ILE D CD1 5233 N N . SER D 136 ? 0.9938 0.5972 0.6832 -0.2867 0.0637 -0.0550 139 SER D N 5234 C CA . SER D 136 ? 1.0672 0.6202 0.6983 -0.3111 0.0951 -0.0659 139 SER D CA 5235 C C . SER D 136 ? 1.1322 0.6147 0.7192 -0.2712 0.1367 -0.0753 139 SER D C 5236 O O . SER D 136 ? 1.2093 0.6306 0.7337 -0.2871 0.1710 -0.0865 139 SER D O 5237 C CB . SER D 136 ? 1.1175 0.6529 0.6940 -0.3724 0.1013 -0.0744 139 SER D CB 5238 O OG . SER D 136 ? 1.0828 0.6943 0.6908 -0.3963 0.0618 -0.0648 139 SER D OG 5239 N N . HIS D 137 ? 1.1148 0.6050 0.7270 -0.2139 0.1346 -0.0708 140 HIS D N 5240 C CA . HIS D 137 ? 1.1937 0.6178 0.7526 -0.1567 0.1723 -0.0758 140 HIS D CA 5241 C C . HIS D 137 ? 1.1500 0.6530 0.7695 -0.0862 0.1604 -0.0774 140 HIS D C 5242 O O . HIS D 137 ? 1.2086 0.6889 0.7931 -0.0275 0.1880 -0.0839 140 HIS D O 5243 C CB . HIS D 137 ? 1.2696 0.5971 0.7546 -0.1512 0.1963 -0.0718 140 HIS D CB 5244 C CG . HIS D 137 ? 1.3710 0.6099 0.7812 -0.0763 0.2359 -0.0701 140 HIS D CG 5245 N ND1 . HIS D 137 ? 1.4494 0.6336 0.8037 -0.0458 0.2722 -0.0783 140 HIS D ND1 5246 C CD2 . HIS D 137 ? 1.4168 0.6077 0.7885 -0.0177 0.2462 -0.0594 140 HIS D CD2 5247 C CE1 . HIS D 137 ? 1.5488 0.6558 0.8321 0.0362 0.3024 -0.0715 140 HIS D CE1 5248 N NE2 . HIS D 137 ? 1.5261 0.6321 0.8147 0.0543 0.2871 -0.0587 140 HIS D NE2 5249 N N . THR D 138 ? 1.0569 0.6572 0.7625 -0.0912 0.1216 -0.0747 141 THR D N 5250 C CA . THR D 138 ? 1.0153 0.7092 0.7823 -0.0366 0.1091 -0.0836 141 THR D CA 5251 C C . THR D 138 ? 0.9478 0.7373 0.7896 -0.0706 0.0892 -0.0954 141 THR D C 5252 O O . THR D 138 ? 0.9256 0.8062 0.8136 -0.0415 0.0896 -0.1149 141 THR D O 5253 C CB . THR D 138 ? 0.9855 0.6965 0.7727 -0.0037 0.0890 -0.0744 141 THR D CB 5254 O OG1 . THR D 138 ? 0.9312 0.6431 0.7456 -0.0565 0.0630 -0.0642 141 THR D OG1 5255 C CG2 . THR D 138 ? 1.0813 0.6903 0.7800 0.0422 0.1173 -0.0642 141 THR D CG2 5256 N N . GLN D 139 ? 0.9307 0.7000 0.7758 -0.1319 0.0746 -0.0857 142 GLN D N 5257 C CA . GLN D 139 ? 0.8923 0.7153 0.7846 -0.1682 0.0594 -0.0911 142 GLN D CA 5258 C C . GLN D 139 ? 0.8377 0.7200 0.7868 -0.1508 0.0371 -0.0949 142 GLN D C 5259 O O . GLN D 139 ? 0.8166 0.7629 0.8073 -0.1630 0.0376 -0.1139 142 GLN D O 5260 C CB . GLN D 139 ? 0.9126 0.7783 0.8132 -0.1788 0.0828 -0.1138 142 GLN D CB 5261 C CG . GLN D 139 ? 0.9861 0.7955 0.8279 -0.1857 0.1104 -0.1148 142 GLN D CG 5262 C CD . GLN D 139 ? 1.0336 0.7606 0.8219 -0.2295 0.1038 -0.0936 142 GLN D CD 5263 O OE1 . GLN D 139 ? 1.0375 0.7603 0.8246 -0.2727 0.0887 -0.0836 142 GLN D OE1 5264 N NE2 . GLN D 139 ? 1.0795 0.7408 0.8148 -0.2183 0.1175 -0.0887 142 GLN D NE2 5265 N N . LYS D 140 ? 0.8243 0.6833 0.7692 -0.1288 0.0221 -0.0806 143 LYS D N 5266 C CA . LYS D 140 ? 0.7775 0.6797 0.7678 -0.1138 0.0001 -0.0816 143 LYS D CA 5267 C C . LYS D 140 ? 0.7722 0.6267 0.7448 -0.1201 -0.0163 -0.0605 143 LYS D C 5268 O O . LYS D 140 ? 0.8065 0.6070 0.7317 -0.1245 -0.0059 -0.0513 143 LYS D O 5269 C CB . LYS D 140 ? 0.7692 0.7304 0.7791 -0.0561 0.0039 -0.0962 143 LYS D CB 5270 C CG . LYS D 140 ? 0.7659 0.8197 0.8094 -0.0441 0.0167 -0.1261 143 LYS D CG 5271 C CD . LYS D 140 ? 0.7630 0.8964 0.8226 0.0264 0.0151 -0.1403 143 LYS D CD 5272 C CE . LYS D 140 ? 0.8303 0.8908 0.8200 0.0874 0.0318 -0.1223 143 LYS D CE 5273 N NZ . LYS D 140 ? 0.8861 0.9139 0.8373 0.0900 0.0599 -0.1265 143 LYS D NZ 5274 N N . ALA D 141 ? 0.7354 0.6127 0.7427 -0.1242 -0.0379 -0.0573 144 ALA D N 5275 C CA . ALA D 141 ? 0.7234 0.5803 0.7247 -0.1265 -0.0546 -0.0421 144 ALA D CA 5276 C C . ALA D 141 ? 0.6917 0.5812 0.7247 -0.0950 -0.0650 -0.0469 144 ALA D C 5277 O O . ALA D 141 ? 0.6699 0.6036 0.7397 -0.0853 -0.0691 -0.0608 144 ALA D O 5278 C CB . ALA D 141 ? 0.7242 0.5716 0.7258 -0.1529 -0.0712 -0.0303 144 ALA D CB 5279 N N . THR D 142 ? 0.6957 0.5654 0.7094 -0.0855 -0.0658 -0.0394 145 THR D N 5280 C CA . THR D 142 ? 0.6722 0.5671 0.7076 -0.0572 -0.0746 -0.0424 145 THR D CA 5281 C C . THR D 142 ? 0.6507 0.5527 0.7008 -0.0723 -0.0918 -0.0355 145 THR D C 5282 O O . THR D 142 ? 0.6727 0.5580 0.6974 -0.0959 -0.0895 -0.0295 145 THR D O 5283 C CB . THR D 142 ? 0.7159 0.5752 0.7039 -0.0268 -0.0551 -0.0405 145 THR D CB 5284 O OG1 . THR D 142 ? 0.7599 0.6053 0.7198 -0.0033 -0.0359 -0.0446 145 THR D OG1 5285 C CG2 . THR D 142 ? 0.6963 0.5893 0.7033 0.0092 -0.0645 -0.0444 145 THR D CG2 5286 N N . LEU D 143 ? 0.6142 0.5497 0.7042 -0.0596 -0.1072 -0.0404 146 LEU D N 5287 C CA . LEU D 143 ? 0.5952 0.5452 0.7004 -0.0603 -0.1220 -0.0361 146 LEU D CA 5288 C C . LEU D 143 ? 0.5841 0.5493 0.6951 -0.0387 -0.1202 -0.0423 146 LEU D C 5289 O O . LEU D 143 ? 0.5744 0.5573 0.6988 -0.0164 -0.1193 -0.0519 146 LEU D O 5290 C CB . LEU D 143 ? 0.5898 0.5451 0.7195 -0.0587 -0.1356 -0.0359 146 LEU D CB 5291 C CG . LEU D 143 ? 0.6191 0.5466 0.7276 -0.0758 -0.1377 -0.0246 146 LEU D CG 5292 C CD1 . LEU D 143 ? 0.6375 0.5439 0.7455 -0.0878 -0.1254 -0.0344 146 LEU D CD1 5293 C CD2 . LEU D 143 ? 0.6390 0.5667 0.7461 -0.0609 -0.1542 -0.0135 146 LEU D CD2 5294 N N . VAL D 144 ? 0.5885 0.5565 0.6873 -0.0480 -0.1187 -0.0400 147 VAL D N 5295 C CA . VAL D 144 ? 0.5899 0.5613 0.6808 -0.0334 -0.1120 -0.0450 147 VAL D CA 5296 C C . VAL D 144 ? 0.5629 0.5803 0.6941 -0.0296 -0.1288 -0.0500 147 VAL D C 5297 O O . VAL D 144 ? 0.5589 0.6037 0.7048 -0.0416 -0.1397 -0.0479 147 VAL D O 5298 C CB . VAL D 144 ? 0.6408 0.5667 0.6700 -0.0546 -0.0851 -0.0438 147 VAL D CB 5299 C CG1 . VAL D 144 ? 0.6542 0.5774 0.6658 -0.0492 -0.0746 -0.0488 147 VAL D CG1 5300 C CG2 . VAL D 144 ? 0.6829 0.5460 0.6591 -0.0407 -0.0637 -0.0380 147 VAL D CG2 5301 N N . CYS D 145 ? 0.5521 0.5836 0.6981 -0.0070 -0.1312 -0.0574 148 CYS D N 5302 C CA . CYS D 145 ? 0.5380 0.6075 0.7159 0.0005 -0.1419 -0.0646 148 CYS D CA 5303 C C . CYS D 145 ? 0.5535 0.6269 0.7103 0.0008 -0.1284 -0.0705 148 CYS D C 5304 O O . CYS D 145 ? 0.5784 0.6204 0.6995 0.0134 -0.1159 -0.0688 148 CYS D O 5305 C CB . CYS D 145 ? 0.5216 0.5979 0.7302 0.0196 -0.1526 -0.0730 148 CYS D CB 5306 S SG . CYS D 145 ? 0.5329 0.6381 0.7707 0.0356 -0.1621 -0.0807 148 CYS D SG 5307 N N . LEU D 146 ? 0.5504 0.6650 0.7232 -0.0093 -0.1295 -0.0780 149 LEU D N 5308 C CA . LEU D 146 ? 0.5756 0.6925 0.7227 -0.0193 -0.1110 -0.0866 149 LEU D CA 5309 C C . LEU D 146 ? 0.5561 0.7341 0.7469 -0.0058 -0.1211 -0.1001 149 LEU D C 5310 O O . LEU D 146 ? 0.5456 0.7848 0.7695 -0.0097 -0.1306 -0.1068 149 LEU D O 5311 C CB . LEU D 146 ? 0.6144 0.7237 0.7208 -0.0648 -0.0879 -0.0908 149 LEU D CB 5312 C CG . LEU D 146 ? 0.6868 0.7137 0.7093 -0.0813 -0.0514 -0.0886 149 LEU D CG 5313 C CD1 . LEU D 146 ? 0.7143 0.6619 0.6916 -0.0616 -0.0451 -0.0713 149 LEU D CD1 5314 C CD2 . LEU D 146 ? 0.7378 0.7686 0.7214 -0.1427 -0.0210 -0.1049 149 LEU D CD2 5315 N N . ALA D 147 ? 0.5586 0.7271 0.7472 0.0153 -0.1196 -0.1052 150 ALA D N 5316 C CA . ALA D 147 ? 0.5468 0.7635 0.7686 0.0287 -0.1239 -0.1203 150 ALA D CA 5317 C C . ALA D 147 ? 0.5820 0.7983 0.7655 0.0092 -0.0995 -0.1287 150 ALA D C 5318 O O . ALA D 147 ? 0.6156 0.7810 0.7499 0.0166 -0.0874 -0.1228 150 ALA D O 5319 C CB . ALA D 147 ? 0.5337 0.7392 0.7736 0.0579 -0.1356 -0.1256 150 ALA D CB 5320 N N . THR D 148 ? 0.5859 0.8625 0.7851 -0.0146 -0.0901 -0.1436 151 THR D N 5321 C CA . THR D 148 ? 0.6364 0.9059 0.7868 -0.0512 -0.0570 -0.1555 151 THR D CA 5322 C C . THR D 148 ? 0.6276 0.9813 0.8146 -0.0536 -0.0521 -0.1802 151 THR D C 5323 O O . THR D 148 ? 0.5859 1.0141 0.8388 -0.0239 -0.0748 -0.1888 151 THR D O 5324 C CB . THR D 148 ? 0.6765 0.9373 0.7873 -0.1064 -0.0328 -0.1599 151 THR D CB 5325 O OG1 . THR D 148 ? 0.6412 1.0161 0.8144 -0.1196 -0.0471 -0.1772 151 THR D OG1 5326 C CG2 . THR D 148 ? 0.6962 0.8687 0.7644 -0.1035 -0.0329 -0.1369 151 THR D CG2 5327 N N . GLY D 149 ? 0.6816 1.0138 0.8149 -0.0865 -0.0182 -0.1913 152 GLY D N 5328 C CA . GLY D 149 ? 0.6828 1.0973 0.8420 -0.0992 -0.0049 -0.2193 152 GLY D CA 5329 C C . GLY D 149 ? 0.6427 1.0837 0.8491 -0.0455 -0.0276 -0.2222 152 GLY D C 5330 O O . GLY D 149 ? 0.6070 1.1393 0.8804 -0.0223 -0.0427 -0.2382 152 GLY D O 5331 N N . PHE D 150 ? 0.6614 1.0234 0.8259 -0.0228 -0.0282 -0.2084 153 PHE D N 5332 C CA . PHE D 150 ? 0.6356 1.0119 0.8334 0.0192 -0.0459 -0.2151 153 PHE D CA 5333 C C . PHE D 150 ? 0.6836 1.0113 0.8187 0.0222 -0.0302 -0.2146 153 PHE D C 5334 O O . PHE D 150 ? 0.7333 0.9861 0.7928 0.0162 -0.0174 -0.1959 153 PHE D O 5335 C CB . PHE D 150 ? 0.5976 0.9485 0.8267 0.0534 -0.0763 -0.2017 153 PHE D CB 5336 C CG . PHE D 150 ? 0.6116 0.8921 0.7923 0.0594 -0.0804 -0.1821 153 PHE D CG 5337 C CD1 . PHE D 150 ? 0.6319 0.8654 0.7677 0.0408 -0.0705 -0.1634 153 PHE D CD1 5338 C CD2 . PHE D 150 ? 0.6068 0.8769 0.7855 0.0852 -0.0930 -0.1863 153 PHE D CD2 5339 C CE1 . PHE D 150 ? 0.6501 0.8274 0.7406 0.0595 -0.0743 -0.1459 153 PHE D CE1 5340 C CE2 . PHE D 150 ? 0.6160 0.8512 0.7560 0.0986 -0.0993 -0.1725 153 PHE D CE2 5341 C CZ . PHE D 150 ? 0.6336 0.8224 0.7300 0.0916 -0.0906 -0.1507 153 PHE D CZ 5342 N N . TYR D 151 ? 0.6787 1.0466 0.8382 0.0376 -0.0304 -0.2347 154 TYR D N 5343 C CA . TYR D 151 ? 0.7246 1.0631 0.8275 0.0427 -0.0172 -0.2384 154 TYR D CA 5344 C C . TYR D 151 ? 0.6991 1.0807 0.8502 0.0699 -0.0306 -0.2611 154 TYR D C 5345 O O . TYR D 151 ? 0.6716 1.1095 0.8828 0.0760 -0.0318 -0.2794 154 TYR D O 5346 C CB . TYR D 151 ? 0.7852 1.1227 0.8359 0.0019 0.0220 -0.2481 154 TYR D CB 5347 C CG . TYR D 151 ? 0.8561 1.1472 0.8257 0.0061 0.0411 -0.2474 154 TYR D CG 5348 C CD1 . TYR D 151 ? 0.9299 1.1238 0.7965 0.0179 0.0501 -0.2192 154 TYR D CD1 5349 C CD2 . TYR D 151 ? 0.8599 1.2029 0.8471 0.0044 0.0517 -0.2740 154 TYR D CD2 5350 C CE1 . TYR D 151 ? 1.0128 1.1620 0.7911 0.0308 0.0668 -0.2150 154 TYR D CE1 5351 C CE2 . TYR D 151 ? 0.9347 1.2349 0.8396 0.0079 0.0697 -0.2729 154 TYR D CE2 5352 C CZ . TYR D 151 ? 1.0117 1.2148 0.8097 0.0224 0.0761 -0.2420 154 TYR D CZ 5353 O OH . TYR D 151 ? 1.0915 1.2500 0.7949 0.0351 0.0927 -0.2374 154 TYR D OH 5354 N N . PRO D 152 ? 0.7168 1.0752 0.8369 0.0895 -0.0396 -0.2622 155 PRO D N 5355 C CA . PRO D 152 ? 0.7571 1.0665 0.8044 0.1009 -0.0430 -0.2413 155 PRO D CA 5356 C C . PRO D 152 ? 0.7266 1.0209 0.7930 0.1147 -0.0666 -0.2252 155 PRO D C 5357 O O . PRO D 152 ? 0.6780 0.9871 0.8068 0.1095 -0.0777 -0.2284 155 PRO D O 5358 C CB . PRO D 152 ? 0.7745 1.1086 0.8067 0.1191 -0.0493 -0.2605 155 PRO D CB 5359 C CG . PRO D 152 ? 0.7295 1.1035 0.8401 0.1193 -0.0590 -0.2881 155 PRO D CG 5360 C CD . PRO D 152 ? 0.7029 1.0914 0.8596 0.1068 -0.0480 -0.2889 155 PRO D CD 5361 N N . ASP D 153 ? 0.7641 1.0314 0.7721 0.1370 -0.0731 -0.2082 156 ASP D N 5362 C CA . ASP D 153 ? 0.7395 1.0048 0.7650 0.1509 -0.0931 -0.1965 156 ASP D CA 5363 C C . ASP D 153 ? 0.7034 1.0283 0.7775 0.1600 -0.1165 -0.2217 156 ASP D C 5364 O O . ASP D 153 ? 0.7249 1.0871 0.7698 0.1834 -0.1276 -0.2292 156 ASP D O 5365 C CB . ASP D 153 ? 0.8026 1.0138 0.7414 0.1769 -0.0863 -0.1667 156 ASP D CB 5366 C CG . ASP D 153 ? 0.8824 1.0900 0.7395 0.2121 -0.0824 -0.1631 156 ASP D CG 5367 O OD1 . ASP D 153 ? 0.9115 1.1220 0.7508 0.1998 -0.0685 -0.1750 156 ASP D OD1 5368 O OD2 . ASP D 153 ? 0.9276 1.1346 0.7344 0.2573 -0.0932 -0.1483 156 ASP D OD2 5369 N N . HIS D 154 ? 0.6627 0.9958 0.8035 0.1405 -0.1209 -0.2366 157 HIS D N 5370 C CA . HIS D 154 ? 0.6496 1.0149 0.8290 0.1325 -0.1309 -0.2667 157 HIS D CA 5371 C C . HIS D 154 ? 0.6243 0.9602 0.8445 0.1184 -0.1341 -0.2621 157 HIS D C 5372 O O . HIS D 154 ? 0.6305 0.9415 0.8782 0.1104 -0.1269 -0.2737 157 HIS D O 5373 C CB . HIS D 154 ? 0.6630 1.0368 0.8557 0.1248 -0.1199 -0.2953 157 HIS D CB 5374 C CG . HIS D 154 ? 0.6943 1.1111 0.8503 0.1324 -0.1201 -0.3136 157 HIS D CG 5375 N ND1 . HIS D 154 ? 0.7088 1.1685 0.8716 0.1202 -0.1239 -0.3516 157 HIS D ND1 5376 C CD2 . HIS D 154 ? 0.7248 1.1455 0.8274 0.1486 -0.1145 -0.3006 157 HIS D CD2 5377 C CE1 . HIS D 154 ? 0.7380 1.2405 0.8597 0.1329 -0.1257 -0.3609 157 HIS D CE1 5378 N NE2 . HIS D 154 ? 0.7519 1.2244 0.8325 0.1535 -0.1197 -0.3276 157 HIS D NE2 5379 N N . VAL D 155 ? 0.6080 0.9401 0.8230 0.1210 -0.1428 -0.2438 158 VAL D N 5380 C CA . VAL D 155 ? 0.5858 0.8856 0.8295 0.1068 -0.1448 -0.2361 158 VAL D CA 5381 C C . VAL D 155 ? 0.5780 0.9040 0.8266 0.0985 -0.1528 -0.2452 158 VAL D C 5382 O O . VAL D 155 ? 0.5809 0.9563 0.8089 0.1158 -0.1609 -0.2461 158 VAL D O 5383 C CB . VAL D 155 ? 0.5734 0.8382 0.8121 0.1090 -0.1425 -0.2038 158 VAL D CB 5384 C CG1 . VAL D 155 ? 0.5766 0.8374 0.8287 0.1093 -0.1338 -0.2040 158 VAL D CG1 5385 C CG2 . VAL D 155 ? 0.5898 0.8501 0.7816 0.1217 -0.1402 -0.1831 158 VAL D CG2 5386 N N . GLU D 156 ? 0.5783 0.8725 0.8481 0.0754 -0.1485 -0.2525 159 GLU D N 5387 C CA . GLU D 156 ? 0.5754 0.8944 0.8530 0.0562 -0.1502 -0.2653 159 GLU D CA 5388 C C . GLU D 156 ? 0.5726 0.8260 0.8549 0.0444 -0.1459 -0.2440 159 GLU D C 5389 O O . GLU D 156 ? 0.6056 0.7981 0.8862 0.0280 -0.1339 -0.2502 159 GLU D O 5390 C CB . GLU D 156 ? 0.6066 0.9556 0.8906 0.0219 -0.1399 -0.3126 159 GLU D CB 5391 N N . LEU D 157 ? 0.5472 0.8044 0.8243 0.0567 -0.1533 -0.2179 160 LEU D N 5392 C CA . LEU D 157 ? 0.5444 0.7468 0.8214 0.0474 -0.1512 -0.1951 160 LEU D CA 5393 C C . LEU D 157 ? 0.5553 0.7619 0.8370 0.0192 -0.1449 -0.2106 160 LEU D C 5394 O O . LEU D 157 ? 0.5406 0.8113 0.8271 0.0210 -0.1486 -0.2218 160 LEU D O 5395 C CB . LEU D 157 ? 0.5255 0.7210 0.7861 0.0659 -0.1561 -0.1637 160 LEU D CB 5396 C CG . LEU D 157 ? 0.5216 0.6736 0.7780 0.0560 -0.1555 -0.1402 160 LEU D CG 5397 N N . SER D 158 ? 0.5912 0.7296 0.8645 -0.0035 -0.1329 -0.2119 161 SER D N 5398 C CA . SER D 158 ? 0.6200 0.7441 0.8865 -0.0401 -0.1195 -0.2262 161 SER D CA 5399 C C . SER D 158 ? 0.6379 0.6860 0.8837 -0.0406 -0.1173 -0.1946 161 SER D C 5400 O O . SER D 158 ? 0.6527 0.6465 0.8849 -0.0176 -0.1217 -0.1703 161 SER D O 5401 C CB . SER D 158 ? 0.6835 0.7815 0.9353 -0.0812 -0.0957 -0.2666 161 SER D CB 5402 O OG . SER D 158 ? 0.7466 0.7363 0.9646 -0.0740 -0.0826 -0.2561 161 SER D OG 5403 N N . TRP D 159 ? 0.6393 0.6973 0.8829 -0.0640 -0.1111 -0.1973 162 TRP D N 5404 C CA . TRP D 159 ? 0.6655 0.6534 0.8824 -0.0703 -0.1069 -0.1708 162 TRP D CA 5405 C C . TRP D 159 ? 0.7540 0.6533 0.9283 -0.1075 -0.0795 -0.1845 162 TRP D C 5406 O O . TRP D 159 ? 0.7869 0.6993 0.9586 -0.1477 -0.0584 -0.2239 162 TRP D O 5407 C CB . TRP D 159 ? 0.6292 0.6645 0.8574 -0.0754 -0.1107 -0.1655 162 TRP D CB 5408 C CG . TRP D 159 ? 0.5877 0.6560 0.8257 -0.0396 -0.1284 -0.1419 162 TRP D CG 5409 C CD1 . TRP D 159 ? 0.5617 0.6970 0.8133 -0.0157 -0.1353 -0.1490 162 TRP D CD1 5410 C CD2 . TRP D 159 ? 0.5836 0.6135 0.8056 -0.0262 -0.1367 -0.1095 162 TRP D CD2 5411 N NE1 . TRP D 159 ? 0.5551 0.6725 0.7899 0.0074 -0.1413 -0.1221 162 TRP D NE1 5412 C CE2 . TRP D 159 ? 0.5562 0.6191 0.7785 -0.0046 -0.1422 -0.1014 162 TRP D CE2 5413 C CE3 . TRP D 159 ? 0.6090 0.5828 0.8089 -0.0296 -0.1386 -0.0884 162 TRP D CE3 5414 C CZ2 . TRP D 159 ? 0.5494 0.5905 0.7530 -0.0007 -0.1448 -0.0792 162 TRP D CZ2 5415 C CZ3 . TRP D 159 ? 0.5930 0.5711 0.7853 -0.0191 -0.1485 -0.0665 162 TRP D CZ3 5416 C CH2 . TRP D 159 ? 0.5604 0.5718 0.7560 -0.0118 -0.1493 -0.0651 162 TRP D CH2 5417 N N . TRP D 160 ? 0.8047 0.6124 0.9363 -0.0956 -0.0769 -0.1536 163 TRP D N 5418 C CA . TRP D 160 ? 0.9218 0.6075 0.9850 -0.1206 -0.0458 -0.1575 163 TRP D CA 5419 C C . TRP D 160 ? 0.9647 0.5865 0.9836 -0.1231 -0.0422 -0.1280 163 TRP D C 5420 O O . TRP D 160 ? 0.9392 0.5674 0.9592 -0.0816 -0.0668 -0.0924 163 TRP D O 5421 C CB . TRP D 160 ? 0.9897 0.5934 1.0154 -0.0837 -0.0407 -0.1486 163 TRP D CB 5422 C CG . TRP D 160 ? 0.9771 0.6182 1.0280 -0.0960 -0.0328 -0.1856 163 TRP D CG 5423 C CD1 . TRP D 160 ? 0.8790 0.6250 0.9912 -0.0714 -0.0580 -0.1912 163 TRP D CD1 5424 C CD2 . TRP D 160 ? 1.0741 0.6433 1.0795 -0.1416 0.0065 -0.2248 163 TRP D CD2 5425 N NE1 . TRP D 160 ? 0.9063 0.6605 1.0194 -0.0937 -0.0415 -0.2296 163 TRP D NE1 5426 C CE2 . TRP D 160 ? 1.0248 0.6747 1.0749 -0.1400 -0.0013 -0.2535 163 TRP D CE2 5427 C CE3 . TRP D 160 ? 1.2125 0.6480 1.1332 -0.1894 0.0529 -0.2408 163 TRP D CE3 5428 C CZ2 . TRP D 160 ? 1.1001 0.7140 1.1201 -0.1860 0.0328 -0.3005 163 TRP D CZ2 5429 C CZ3 . TRP D 160 ? 1.3005 0.6878 1.1849 -0.2404 0.0922 -0.2889 163 TRP D CZ3 5430 C CH2 . TRP D 160 ? 1.2401 0.7229 1.1779 -0.2391 0.0806 -0.3197 163 TRP D CH2 5431 N N . VAL D 161 ? 1.0364 0.6051 1.0146 -0.1777 -0.0093 -0.1474 164 VAL D N 5432 C CA . VAL D 161 ? 1.0970 0.5917 1.0195 -0.1880 0.0010 -0.1227 164 VAL D CA 5433 C C . VAL D 161 ? 1.2697 0.5889 1.0806 -0.2039 0.0419 -0.1183 164 VAL D C 5434 O O . VAL D 161 ? 1.3493 0.6174 1.1248 -0.2662 0.0844 -0.1573 164 VAL D O 5435 C CB . VAL D 161 ? 1.0494 0.6225 1.0051 -0.2393 0.0104 -0.1466 164 VAL D CB 5436 C CG1 . VAL D 161 ? 1.1312 0.6128 1.0172 -0.2611 0.0298 -0.1267 164 VAL D CG1 5437 C CG2 . VAL D 161 ? 0.9181 0.6264 0.9545 -0.2083 -0.0258 -0.1398 164 VAL D CG2 5438 N N . ASN D 162 ? 1.3401 0.5682 1.0880 -0.1463 0.0314 -0.0726 165 ASN D N 5439 C CA . ASN D 162 ? 1.5308 0.5662 1.1463 -0.1406 0.0700 -0.0554 165 ASN D CA 5440 C C . ASN D 162 ? 1.6492 0.5729 1.2067 -0.1491 0.1081 -0.0797 165 ASN D C 5441 O O . ASN D 162 ? 1.8372 0.5707 1.2638 -0.1437 0.1500 -0.0670 165 ASN D O 5442 C CB . ASN D 162 ? 1.6111 0.5739 1.1630 -0.2072 0.1070 -0.0627 165 ASN D CB 5443 C CG . ASN D 162 ? 1.5604 0.5670 1.1192 -0.1828 0.0772 -0.0259 165 ASN D CG 5444 O OD1 . ASN D 162 ? 1.5998 0.5648 1.1127 -0.1129 0.0537 0.0191 165 ASN D OD1 5445 N ND2 . ASN D 162 ? 1.4779 0.5755 1.0905 -0.2392 0.0795 -0.0481 165 ASN D ND2 5446 N N . GLY D 163 ? 1.5563 0.5858 1.1985 -0.1608 0.0971 -0.1141 166 GLY D N 5447 C CA . GLY D 163 ? 1.6604 0.5996 1.2553 -0.1783 0.1344 -0.1455 166 GLY D CA 5448 C C . GLY D 163 ? 1.6079 0.6451 1.2634 -0.2648 0.1535 -0.2096 166 GLY D C 5449 O O . GLY D 163 ? 1.6760 0.6654 1.3043 -0.2918 0.1837 -0.2455 166 GLY D O 5450 N N . LYS D 164 ? 1.4949 0.6752 1.2289 -0.3049 0.1366 -0.2259 167 LYS D N 5451 C CA . LYS D 164 ? 1.4298 0.7502 1.2347 -0.3735 0.1450 -0.2868 167 LYS D CA 5452 C C . LYS D 164 ? 1.2463 0.7614 1.1723 -0.3291 0.0885 -0.2801 167 LYS D C 5453 O O . LYS D 164 ? 1.1716 0.7184 1.1258 -0.2773 0.0531 -0.2366 167 LYS D O 5454 C CB . LYS D 164 ? 1.4775 0.8049 1.2599 -0.4591 0.1822 -0.3203 167 LYS D CB 5455 C CG . LYS D 164 ? 1.6780 0.8254 1.3359 -0.5362 0.2547 -0.3517 167 LYS D CG 5456 N N . GLU D 165 ? 1.1922 0.8304 1.1781 -0.3511 0.0837 -0.3246 168 GLU D N 5457 C CA . GLU D 165 ? 1.0495 0.8515 1.1289 -0.3038 0.0361 -0.3182 168 GLU D CA 5458 C C . GLU D 165 ? 0.9760 0.9238 1.1115 -0.3265 0.0274 -0.3402 168 GLU D C 5459 O O . GLU D 165 ? 0.9992 1.0237 1.1461 -0.3884 0.0515 -0.3952 168 GLU D O 5460 C CB . GLU D 165 ? 1.0359 0.8948 1.1407 -0.3015 0.0325 -0.3502 168 GLU D CB 5461 C CG . GLU D 165 ? 0.9215 0.9112 1.0977 -0.2416 -0.0133 -0.3345 168 GLU D CG 5462 C CD . GLU D 165 ? 0.9179 0.9962 1.1204 -0.2511 -0.0151 -0.3765 168 GLU D CD 5463 O OE1 . GLU D 165 ? 1.0064 1.0111 1.1685 -0.2869 0.0146 -0.4057 168 GLU D OE1 5464 O OE2 . GLU D 165 ? 0.8367 1.0507 1.0903 -0.2205 -0.0441 -0.3802 168 GLU D OE2 5465 N N . VAL D 166 ? 0.8967 0.8877 1.0639 -0.2767 -0.0044 -0.3010 169 VAL D N 5466 C CA . VAL D 166 ? 0.8384 0.9558 1.0504 -0.2814 -0.0122 -0.3157 169 VAL D CA 5467 C C . VAL D 166 ? 0.7594 1.0346 1.0310 -0.2465 -0.0376 -0.3361 169 VAL D C 5468 O O . VAL D 166 ? 0.7213 0.9983 1.0031 -0.1968 -0.0616 -0.3143 169 VAL D O 5469 C CB . VAL D 166 ? 0.8068 0.8898 1.0123 -0.2467 -0.0279 -0.2682 169 VAL D CB 5470 C CG1 . VAL D 166 ? 0.8914 0.8718 1.0423 -0.2927 0.0015 -0.2628 169 VAL D CG1 5471 C CG2 . VAL D 166 ? 0.7711 0.7995 0.9712 -0.1873 -0.0560 -0.2196 169 VAL D CG2 5472 N N . HIS D 167 ? 0.7448 1.1566 1.0504 -0.2703 -0.0306 -0.3792 170 HIS D N 5473 C CA . HIS D 167 ? 0.6826 1.2575 1.0355 -0.2219 -0.0563 -0.3957 170 HIS D CA 5474 C C . HIS D 167 ? 0.6419 1.2784 1.0097 -0.1764 -0.0681 -0.3769 170 HIS D C 5475 O O . HIS D 167 ? 0.6063 1.2991 0.9825 -0.1048 -0.0926 -0.3574 170 HIS D O 5476 C CB . HIS D 167 ? 0.7019 1.4239 1.0844 -0.2714 -0.0427 -0.4673 170 HIS D CB 5477 C CG . HIS D 167 ? 0.7606 1.4235 1.1212 -0.3170 -0.0267 -0.4924 170 HIS D CG 5478 N ND1 . HIS D 167 ? 0.7486 1.3545 1.0993 -0.2721 -0.0467 -0.4641 170 HIS D ND1 5479 C CD2 . HIS D 167 ? 0.8461 1.4938 1.1855 -0.4070 0.0126 -0.5471 170 HIS D CD2 5480 C CE1 . HIS D 167 ? 0.8144 1.3720 1.1413 -0.3256 -0.0225 -0.4981 170 HIS D CE1 5481 N NE2 . HIS D 167 ? 0.8812 1.4549 1.1957 -0.4095 0.0153 -0.5488 170 HIS D NE2 5482 N N . SER D 168 ? 0.6621 1.2738 1.0214 -0.2169 -0.0464 -0.3823 171 SER D N 5483 C CA . SER D 168 ? 0.6346 1.2995 1.0038 -0.1782 -0.0515 -0.3694 171 SER D CA 5484 C C . SER D 168 ? 0.6204 1.1580 0.9547 -0.1289 -0.0658 -0.3058 171 SER D C 5485 O O . SER D 168 ? 0.6424 1.0443 0.9435 -0.1537 -0.0604 -0.2762 171 SER D O 5486 C CB . SER D 168 ? 0.6703 1.3568 1.0407 -0.2451 -0.0196 -0.4012 171 SER D CB 5487 O OG . SER D 168 ? 0.6473 1.4097 1.0327 -0.2041 -0.0229 -0.3974 171 SER D OG 5488 N N . GLY D 169 ? 0.5963 1.1801 0.9301 -0.0578 -0.0813 -0.2876 172 GLY D N 5489 C CA . GLY D 169 ? 0.5957 1.0670 0.8886 -0.0182 -0.0878 -0.2358 172 GLY D CA 5490 C C . GLY D 169 ? 0.5853 0.9977 0.8580 0.0169 -0.1045 -0.2069 172 GLY D C 5491 O O . GLY D 169 ? 0.5923 0.9115 0.8279 0.0358 -0.1058 -0.1699 172 GLY D O 5492 N N . VAL D 170 ? 0.5731 1.0461 0.8677 0.0196 -0.1143 -0.2286 173 VAL D N 5493 C CA . VAL D 170 ? 0.5665 0.9877 0.8438 0.0440 -0.1270 -0.2065 173 VAL D CA 5494 C C . VAL D 170 ? 0.5758 1.0489 0.8317 0.1147 -0.1376 -0.1998 173 VAL D C 5495 O O . VAL D 170 ? 0.5761 1.1729 0.8500 0.1427 -0.1435 -0.2287 173 VAL D O 5496 C CB . VAL D 170 ? 0.5617 0.9875 0.8617 0.0035 -0.1280 -0.2300 173 VAL D CB 5497 C CG1 . VAL D 170 ? 0.5582 0.9112 0.8397 0.0220 -0.1375 -0.2029 173 VAL D CG1 5498 C CG2 . VAL D 170 ? 0.5852 0.9525 0.8867 -0.0602 -0.1104 -0.2402 173 VAL D CG2 5499 N N . CYS D 171 ? 0.5941 0.9727 0.8036 0.1426 -0.1375 -0.1629 174 CYS D N 5500 C CA . CYS D 171 ? 0.6297 1.0118 0.7933 0.2065 -0.1412 -0.1491 174 CYS D CA 5501 C C . CYS D 171 ? 0.6262 0.9409 0.7763 0.1914 -0.1437 -0.1343 174 CYS D C 5502 O O . CYS D 171 ? 0.6133 0.8521 0.7670 0.1508 -0.1387 -0.1203 174 CYS D O 5503 C CB . CYS D 171 ? 0.6889 0.9993 0.7851 0.2516 -0.1253 -0.1206 174 CYS D CB 5504 S SG . CYS D 171 ? 0.7754 0.9421 0.7722 0.2817 -0.1077 -0.0807 174 CYS D SG 5505 N N . THR D 172 ? 0.6419 0.9976 0.7775 0.2259 -0.1521 -0.1400 175 THR D N 5506 C CA . THR D 172 ? 0.6469 0.9479 0.7669 0.2146 -0.1516 -0.1291 175 THR D CA 5507 C C . THR D 172 ? 0.7117 0.9961 0.7592 0.2754 -0.1477 -0.1130 175 THR D C 5508 O O . THR D 172 ? 0.7388 1.0991 0.7693 0.3299 -0.1560 -0.1216 175 THR D O 5509 C CB . THR D 172 ? 0.6031 0.9625 0.7819 0.1774 -0.1631 -0.1594 175 THR D CB 5510 O OG1 . THR D 172 ? 0.5744 0.9177 0.7963 0.1255 -0.1602 -0.1694 175 THR D OG1 5511 C CG2 . THR D 172 ? 0.6061 0.9161 0.7703 0.1709 -0.1611 -0.1497 175 THR D CG2 5512 N N . ASP D 173 ? 0.7467 0.9357 0.7458 0.2667 -0.1330 -0.0912 176 ASP D N 5513 C CA . ASP D 173 ? 0.8343 0.9709 0.7416 0.3165 -0.1200 -0.0720 176 ASP D CA 5514 C C . ASP D 173 ? 0.8407 1.0776 0.7494 0.3631 -0.1397 -0.0886 176 ASP D C 5515 O O . ASP D 173 ? 0.7764 1.0978 0.7560 0.3322 -0.1574 -0.1173 176 ASP D O 5516 C CB . ASP D 173 ? 0.8573 0.9045 0.7329 0.2767 -0.1005 -0.0601 176 ASP D CB 5517 C CG . ASP D 173 ? 0.8914 0.8380 0.7330 0.2390 -0.0748 -0.0437 176 ASP D CG 5518 O OD1 . ASP D 173 ? 0.9329 0.8401 0.7390 0.2586 -0.0645 -0.0324 176 ASP D OD1 5519 O OD2 . ASP D 173 ? 0.8919 0.8082 0.7419 0.1887 -0.0638 -0.0457 176 ASP D OD2 5520 N N . PRO D 174 ? 0.9311 1.1559 0.7521 0.4409 -0.1347 -0.0714 177 PRO D N 5521 C CA . PRO D 174 ? 0.9519 1.2738 0.7596 0.4908 -0.1540 -0.0848 177 PRO D CA 5522 C C . PRO D 174 ? 0.9482 1.2343 0.7492 0.4552 -0.1493 -0.0867 177 PRO D C 5523 O O . PRO D 174 ? 0.8846 1.2703 0.7587 0.4248 -0.1689 -0.1190 177 PRO D O 5524 C CB . PRO D 174 ? 1.0858 1.3493 0.7665 0.5897 -0.1408 -0.0526 177 PRO D CB 5525 C CG . PRO D 174 ? 1.1480 1.2400 0.7595 0.5748 -0.1040 -0.0207 177 PRO D CG 5526 C CD . PRO D 174 ? 1.0326 1.1529 0.7543 0.4923 -0.1099 -0.0399 177 PRO D CD 5527 N N . GLN D 175 ? 1.0253 1.1671 0.7361 0.4523 -0.1186 -0.0562 178 GLN D N 5528 C CA . GLN D 175 ? 1.0310 1.1346 0.7260 0.4176 -0.1076 -0.0582 178 GLN D CA 5529 C C . GLN D 175 ? 1.0300 1.0209 0.7161 0.3510 -0.0770 -0.0472 178 GLN D C 5530 O O . GLN D 175 ? 1.0886 0.9830 0.7171 0.3506 -0.0528 -0.0266 178 GLN D O 5531 C CB . GLN D 175 ? 1.1573 1.2125 0.7265 0.4845 -0.0956 -0.0373 178 GLN D CB 5532 C CG . GLN D 175 ? 1.1489 1.3477 0.7303 0.5477 -0.1302 -0.0551 178 GLN D CG 5533 N N . PRO D 176 ? 0.9700 0.9821 0.7113 0.2954 -0.0766 -0.0646 179 PRO D N 5534 C CA . PRO D 176 ? 0.9626 0.9102 0.7089 0.2314 -0.0512 -0.0631 179 PRO D CA 5535 C C . PRO D 176 ? 1.0907 0.9005 0.7064 0.2252 -0.0048 -0.0405 179 PRO D C 5536 O O . PRO D 176 ? 1.1972 0.9448 0.7056 0.2738 0.0105 -0.0231 179 PRO D O 5537 C CB . PRO D 176 ? 0.9032 0.9173 0.7146 0.2001 -0.0602 -0.0875 179 PRO D CB 5538 C CG . PRO D 176 ? 0.8422 0.9578 0.7199 0.2262 -0.0947 -0.1071 179 PRO D CG 5539 C CD . PRO D 176 ? 0.9075 1.0239 0.7177 0.2900 -0.1010 -0.0929 179 PRO D CD 5540 N N . LEU D 177 ? 1.0922 0.8531 0.7088 0.1641 0.0199 -0.0428 180 LEU D N 5541 C CA . LEU D 177 ? 1.2243 0.8500 0.7156 0.1335 0.0737 -0.0312 180 LEU D CA 5542 C C . LEU D 177 ? 1.2213 0.8712 0.7267 0.0735 0.0931 -0.0528 180 LEU D C 5543 O O . LEU D 177 ? 1.1144 0.8671 0.7316 0.0310 0.0747 -0.0767 180 LEU D O 5544 C CB . LEU D 177 ? 1.2441 0.8105 0.7201 0.0936 0.0943 -0.0282 180 LEU D CB 5545 N N . LYS D 178 ? 1.3500 0.9054 0.7352 0.0754 0.1320 -0.0443 181 LYS D N 5546 C CA . LYS D 178 ? 1.3686 0.9409 0.7521 0.0124 0.1599 -0.0678 181 LYS D CA 5547 C C . LYS D 178 ? 1.4196 0.9450 0.7732 -0.0747 0.2050 -0.0839 181 LYS D C 5548 O O . LYS D 178 ? 1.5535 0.9313 0.7800 -0.0874 0.2494 -0.0682 181 LYS D O 5549 C CB . LYS D 178 ? 1.5074 0.9817 0.7557 0.0391 0.1923 -0.0533 181 LYS D CB 5550 N N . GLU D 179 ? 1.3219 0.9761 0.7875 -0.1326 0.1951 -0.1178 182 GLU D N 5551 C CA . GLU D 179 ? 1.3556 1.0147 0.8138 -0.2222 0.2323 -0.1439 182 GLU D CA 5552 C C . GLU D 179 ? 1.5212 1.0689 0.8400 -0.2928 0.3072 -0.1578 182 GLU D C 5553 O O . GLU D 179 ? 1.5948 1.1043 0.8644 -0.3735 0.3522 -0.1788 182 GLU D O 5554 C CB . GLU D 179 ? 1.2104 1.0617 0.8270 -0.2501 0.1971 -0.1774 182 GLU D CB 5555 C CG . GLU D 179 ? 1.0921 1.0220 0.8194 -0.2053 0.1396 -0.1666 182 GLU D CG 5556 C CD . GLU D 179 ? 0.9918 1.0934 0.8527 -0.2196 0.1082 -0.1948 182 GLU D CD 5557 O OE1 . GLU D 179 ? 0.9664 1.1521 0.8721 -0.2205 0.1065 -0.2159 182 GLU D OE1 5558 O OE2 . GLU D 179 ? 0.9444 1.0954 0.8595 -0.2235 0.0856 -0.1950 182 GLU D OE2 5559 N N . GLN D 180 ? 1.5916 1.0856 0.8399 -0.2687 0.3241 -0.1492 183 GLN D N 5560 C CA . GLN D 180 ? 1.7754 1.1359 0.8670 -0.3328 0.4018 -0.1586 183 GLN D CA 5561 C C . GLN D 180 ? 1.9151 1.1122 0.8555 -0.2590 0.4188 -0.1170 183 GLN D C 5562 O O . GLN D 180 ? 1.8843 1.1331 0.8455 -0.2215 0.3993 -0.1153 183 GLN D O 5563 C CB . GLN D 180 ? 1.7326 1.2304 0.8950 -0.4053 0.4172 -0.2061 183 GLN D CB 5564 C CG . GLN D 180 ? 1.6783 1.3024 0.9226 -0.5008 0.4311 -0.2540 183 GLN D CG 5565 N N . PRO D 181 ? 2.0776 1.0769 0.8588 -0.2316 0.4557 -0.0833 184 PRO D N 5566 C CA . PRO D 181 ? 2.2370 1.0719 0.8533 -0.1450 0.4729 -0.0388 184 PRO D CA 5567 C C . PRO D 181 ? 2.4265 1.1285 0.8812 -0.1929 0.5450 -0.0433 184 PRO D C 5568 O O . PRO D 181 ? 2.5238 1.1469 0.8749 -0.1174 0.5457 -0.0120 184 PRO D O 5569 C CB . PRO D 181 ? 2.3717 1.0281 0.8591 -0.1123 0.5024 -0.0077 184 PRO D CB 5570 C CG . PRO D 181 ? 2.2218 0.9964 0.8548 -0.1614 0.4742 -0.0327 184 PRO D CG 5571 C CD . PRO D 181 ? 2.1186 1.0453 0.8686 -0.2673 0.4781 -0.0838 184 PRO D CD 5572 N N . ALA D 182 ? 2.4865 1.1722 0.9164 -0.3194 0.6062 -0.0847 185 ALA D N 5573 C CA . ALA D 182 ? 2.6755 1.2365 0.9495 -0.3866 0.6851 -0.0975 185 ALA D CA 5574 C C . ALA D 182 ? 2.5459 1.2971 0.9476 -0.4100 0.6578 -0.1304 185 ALA D C 5575 O O . ALA D 182 ? 2.6596 1.3692 0.9803 -0.4944 0.7217 -0.1588 185 ALA D O 5576 C CB . ALA D 182 ? 2.8259 1.2765 0.9967 -0.5239 0.7747 -0.1344 185 ALA D CB 5577 N N . LEU D 183 ? 2.3214 1.2733 0.9144 -0.3379 0.5681 -0.1288 186 LEU D N 5578 C CA . LEU D 183 ? 2.1937 1.3235 0.9123 -0.3409 0.5356 -0.1570 186 LEU D CA 5579 C C . LEU D 183 ? 2.1021 1.2900 0.8744 -0.2207 0.4646 -0.1255 186 LEU D C 5580 O O . LEU D 183 ? 2.1181 1.2397 0.8516 -0.1357 0.4347 -0.0856 186 LEU D O 5581 C CB . LEU D 183 ? 1.9987 1.3577 0.9248 -0.4011 0.5036 -0.2073 186 LEU D CB 5582 C CG . LEU D 183 ? 2.0533 1.4425 0.9693 -0.5324 0.5666 -0.2582 186 LEU D CG 5583 C CD1 . LEU D 183 ? 1.8486 1.4812 0.9765 -0.5546 0.5162 -0.2976 186 LEU D CD1 5584 C CD2 . LEU D 183 ? 2.1767 1.5401 1.0053 -0.6047 0.6322 -0.2884 186 LEU D CD2 5585 N N . ASN D 184 ? 2.0136 1.3329 0.8733 -0.2169 0.4407 -0.1483 187 ASN D N 5586 C CA . ASN D 184 ? 1.9242 1.3193 0.8426 -0.1200 0.3769 -0.1307 187 ASN D CA 5587 C C . ASN D 184 ? 1.6952 1.2954 0.8326 -0.1044 0.3077 -0.1560 187 ASN D C 5588 O O . ASN D 184 ? 1.6127 1.2485 0.8103 -0.0398 0.2553 -0.1374 187 ASN D O 5589 C CB . ASN D 184 ? 2.0078 1.3835 0.8481 -0.1165 0.3997 -0.1355 187 ASN D CB 5590 C CG . ASN D 184 ? 2.2560 1.4036 0.8532 -0.1054 0.4630 -0.0992 187 ASN D CG 5591 N N . ASP D 185 ? 1.6075 1.3374 0.8539 -0.1630 0.3122 -0.1994 188 ASP D N 5592 C CA . ASP D 185 ? 1.4171 1.3243 0.8518 -0.1445 0.2555 -0.2241 188 ASP D CA 5593 C C . ASP D 185 ? 1.3213 1.2806 0.8494 -0.1587 0.2329 -0.2267 188 ASP D C 5594 O O . ASP D 185 ? 1.1956 1.2929 0.8629 -0.1594 0.2015 -0.2515 188 ASP D O 5595 C CB . ASP D 185 ? 1.3784 1.4059 0.8852 -0.1859 0.2700 -0.2686 188 ASP D CB 5596 C CG . ASP D 185 ? 1.4912 1.4849 0.9191 -0.2778 0.3408 -0.2934 188 ASP D CG 5597 O OD1 . ASP D 185 ? 1.5557 1.4811 0.9282 -0.3274 0.3726 -0.2897 188 ASP D OD1 5598 O OD2 . ASP D 185 ? 1.5272 1.5643 0.9455 -0.3067 0.3686 -0.3210 188 ASP D OD2 5599 N N . SER D 186 ? 1.3914 1.2318 0.8320 -0.1632 0.2504 -0.1996 189 SER D N 5600 C CA . SER D 186 ? 1.3225 1.1911 0.8268 -0.1810 0.2352 -0.1997 189 SER D CA 5601 C C . SER D 186 ? 1.1633 1.1406 0.8087 -0.1257 0.1683 -0.1967 189 SER D C 5602 O O . SER D 186 ? 1.1279 1.1146 0.7914 -0.0632 0.1333 -0.1834 189 SER D O 5603 C CB . SER D 186 ? 1.4465 1.1447 0.8141 -0.1765 0.2643 -0.1658 189 SER D CB 5604 O OG . SER D 186 ? 1.3685 1.0933 0.8010 -0.1750 0.2389 -0.1605 189 SER D OG 5605 N N . ARG D 187 ? 1.0800 1.1377 0.8155 -0.1531 0.1543 -0.2114 190 ARG D N 5606 C CA . ARG D 187 ? 0.9558 1.0873 0.8023 -0.1074 0.0996 -0.2054 190 ARG D CA 5607 C C . ARG D 187 ? 0.9734 1.0142 0.7748 -0.0818 0.0889 -0.1732 190 ARG D C 5608 O O . ARG D 187 ? 1.0761 1.0080 0.7723 -0.1071 0.1258 -0.1596 190 ARG D O 5609 C CB . ARG D 187 ? 0.8781 1.1356 0.8289 -0.1369 0.0885 -0.2322 190 ARG D CB 5610 C CG . ARG D 187 ? 0.8469 1.2201 0.8614 -0.1437 0.0916 -0.2662 190 ARG D CG 5611 C CD . ARG D 187 ? 0.7627 1.2700 0.8930 -0.1283 0.0611 -0.2840 190 ARG D CD 5612 N NE . ARG D 187 ? 0.7739 1.3473 0.9144 -0.1844 0.0785 -0.3027 190 ARG D NE 5613 N N . TYR D 188 ? 0.8867 0.9663 0.7601 -0.0337 0.0436 -0.1636 191 TYR D N 5614 C CA . TYR D 188 ? 0.8981 0.9107 0.7374 -0.0023 0.0310 -0.1366 191 TYR D CA 5615 C C . TYR D 188 ? 0.8369 0.8792 0.7379 -0.0179 0.0141 -0.1354 191 TYR D C 5616 O O . TYR D 188 ? 0.7919 0.9087 0.7567 -0.0510 0.0115 -0.1541 191 TYR D O 5617 C CB . TYR D 188 ? 0.8668 0.8999 0.7246 0.0583 -0.0022 -0.1296 191 TYR D CB 5618 C CG . TYR D 188 ? 0.9493 0.9397 0.7203 0.0861 0.0120 -0.1232 191 TYR D CG 5619 C CD1 . TYR D 188 ? 1.0504 0.9454 0.7080 0.1236 0.0264 -0.0956 191 TYR D CD1 5620 C CD2 . TYR D 188 ? 0.9388 0.9820 0.7329 0.0826 0.0116 -0.1437 191 TYR D CD2 5621 C CE1 . TYR D 188 ? 1.1382 0.9921 0.7024 0.1598 0.0381 -0.0859 191 TYR D CE1 5622 C CE2 . TYR D 188 ? 1.0218 1.0271 0.7288 0.1093 0.0241 -0.1371 191 TYR D CE2 5623 C CZ . TYR D 188 ? 1.1220 1.0332 0.7120 0.1495 0.0361 -0.1069 191 TYR D CZ 5624 O OH . TYR D 188 ? 1.2156 1.0871 0.7062 0.1860 0.0472 -0.0967 191 TYR D OH 5625 N N . ALA D 189 ? 0.8415 0.8324 0.7186 0.0102 0.0031 -0.1141 192 ALA D N 5626 C CA . ALA D 189 ? 0.7876 0.7978 0.7150 0.0015 -0.0143 -0.1101 192 ALA D CA 5627 C C . ALA D 189 ? 0.7731 0.7624 0.6988 0.0498 -0.0365 -0.0935 192 ALA D C 5628 O O . ALA D 189 ? 0.8337 0.7731 0.6902 0.0869 -0.0287 -0.0807 192 ALA D O 5629 C CB . ALA D 189 ? 0.8501 0.8027 0.7188 -0.0486 0.0197 -0.1086 192 ALA D CB 5630 N N . LEU D 190 ? 0.7028 0.7361 0.6994 0.0516 -0.0627 -0.0951 193 LEU D N 5631 C CA . LEU D 190 ? 0.6818 0.7182 0.6895 0.0875 -0.0821 -0.0878 193 LEU D CA 5632 C C . LEU D 190 ? 0.6531 0.6862 0.6899 0.0706 -0.0895 -0.0821 193 LEU D C 5633 O O . LEU D 190 ? 0.6167 0.6805 0.7008 0.0430 -0.0968 -0.0881 193 LEU D O 5634 C CB . LEU D 190 ? 0.6271 0.7334 0.6953 0.1081 -0.1074 -0.1051 193 LEU D CB 5635 C CG . LEU D 190 ? 0.6159 0.7532 0.6898 0.1412 -0.1233 -0.1091 193 LEU D CG 5636 C CD1 . LEU D 190 ? 0.6717 0.8035 0.6784 0.1842 -0.1179 -0.1034 193 LEU D CD1 5637 C CD2 . LEU D 190 ? 0.5662 0.7660 0.7092 0.1326 -0.1418 -0.1342 193 LEU D CD2 5638 N N . SER D 191 ? 0.6770 0.6783 0.6815 0.0930 -0.0877 -0.0708 194 SER D N 5639 C CA . SER D 191 ? 0.6575 0.6513 0.6814 0.0780 -0.0920 -0.0657 194 SER D CA 5640 C C . SER D 191 ? 0.6195 0.6604 0.6854 0.1016 -0.1122 -0.0727 194 SER D C 5641 O O . SER D 191 ? 0.6254 0.7028 0.6887 0.1357 -0.1194 -0.0805 194 SER D O 5642 C CB . SER D 191 ? 0.7356 0.6431 0.6766 0.0741 -0.0630 -0.0505 194 SER D CB 5643 O OG . SER D 191 ? 0.7860 0.6660 0.6758 0.1268 -0.0576 -0.0410 194 SER D OG 5644 N N . SER D 192 ? 0.5891 0.6361 0.6891 0.0799 -0.1193 -0.0730 195 SER D N 5645 C CA . SER D 192 ? 0.5649 0.6532 0.6993 0.0876 -0.1306 -0.0842 195 SER D CA 5646 C C . SER D 192 ? 0.5630 0.6249 0.6974 0.0659 -0.1264 -0.0762 195 SER D C 5647 O O . SER D 192 ? 0.5681 0.5954 0.6942 0.0399 -0.1227 -0.0654 195 SER D O 5648 C CB . SER D 192 ? 0.5313 0.6648 0.7195 0.0749 -0.1444 -0.1043 195 SER D CB 5649 O OG . SER D 192 ? 0.5267 0.7079 0.7385 0.0736 -0.1479 -0.1242 195 SER D OG 5650 N N . ARG D 193 ? 0.5596 0.6515 0.7043 0.0751 -0.1270 -0.0854 196 ARG D N 5651 C CA . ARG D 193 ? 0.5670 0.6323 0.7012 0.0593 -0.1188 -0.0785 196 ARG D CA 5652 C C . ARG D 193 ? 0.5440 0.6551 0.7181 0.0408 -0.1226 -0.0976 196 ARG D C 5653 O O . ARG D 193 ? 0.5360 0.7180 0.7343 0.0532 -0.1259 -0.1210 196 ARG D O 5654 C CB . ARG D 193 ? 0.6166 0.6515 0.6941 0.0939 -0.1020 -0.0684 196 ARG D CB 5655 C CG . ARG D 193 ? 0.6691 0.6204 0.6843 0.0886 -0.0844 -0.0498 196 ARG D CG 5656 C CD . ARG D 193 ? 0.7557 0.6638 0.6968 0.1397 -0.0656 -0.0406 196 ARG D CD 5657 N NE . ARG D 193 ? 0.7720 0.6963 0.7053 0.1624 -0.0714 -0.0415 196 ARG D NE 5658 C CZ . ARG D 193 ? 0.8614 0.7168 0.7086 0.1976 -0.0502 -0.0279 196 ARG D CZ 5659 N NH1 . ARG D 193 ? 0.8639 0.7386 0.7047 0.2153 -0.0564 -0.0295 196 ARG D NH1 5660 N NH2 . ARG D 193 ? 0.9537 0.7071 0.7092 0.2148 -0.0183 -0.0125 196 ARG D NH2 5661 N N . LEU D 194 ? 0.5414 0.6155 0.7162 0.0073 -0.1198 -0.0903 197 LEU D N 5662 C CA . LEU D 194 ? 0.5390 0.6325 0.7337 -0.0203 -0.1147 -0.1070 197 LEU D CA 5663 C C . LEU D 194 ? 0.5566 0.6184 0.7271 -0.0331 -0.1039 -0.0960 197 LEU D C 5664 O O . LEU D 194 ? 0.5696 0.5759 0.7179 -0.0496 -0.1053 -0.0759 197 LEU D O 5665 C CB . LEU D 194 ? 0.5475 0.6052 0.7501 -0.0491 -0.1178 -0.1080 197 LEU D CB 5666 C CG . LEU D 194 ? 0.5756 0.6087 0.7704 -0.0880 -0.1037 -0.1184 197 LEU D CG 5667 C CD1 . LEU D 194 ? 0.5811 0.6852 0.8012 -0.1080 -0.0907 -0.1583 197 LEU D CD1 5668 C CD2 . LEU D 194 ? 0.6196 0.5782 0.7918 -0.1001 -0.1039 -0.1063 197 LEU D CD2 5669 N N . ARG D 195 ? 0.5621 0.6713 0.7374 -0.0237 -0.0934 -0.1122 198 ARG D N 5670 C CA . ARG D 195 ? 0.5855 0.6666 0.7355 -0.0329 -0.0797 -0.1049 198 ARG D CA 5671 C C . ARG D 195 ? 0.5936 0.7004 0.7609 -0.0729 -0.0683 -0.1254 198 ARG D C 5672 O O . ARG D 195 ? 0.5877 0.7801 0.7853 -0.0730 -0.0615 -0.1568 198 ARG D O 5673 C CB . ARG D 195 ? 0.6078 0.7035 0.7310 0.0163 -0.0695 -0.1034 198 ARG D CB 5674 C CG . ARG D 195 ? 0.6370 0.7106 0.7336 0.0116 -0.0506 -0.1024 198 ARG D CG 5675 C CD . ARG D 195 ? 0.6832 0.7498 0.7365 0.0726 -0.0362 -0.0984 198 ARG D CD 5676 N NE . ARG D 195 ? 0.7435 0.6968 0.7282 0.0668 -0.0186 -0.0754 198 ARG D NE 5677 C CZ . ARG D 195 ? 0.8268 0.7237 0.7437 0.1137 0.0049 -0.0674 198 ARG D CZ 5678 N NH1 . ARG D 195 ? 0.8915 0.6759 0.7388 0.0914 0.0273 -0.0525 198 ARG D NH1 5679 N NH2 . ARG D 195 ? 0.8527 0.8051 0.7632 0.1846 0.0086 -0.0761 198 ARG D NH2 5680 N N . VAL D 196 ? 0.6166 0.6537 0.7593 -0.1085 -0.0649 -0.1094 199 VAL D N 5681 C CA . VAL D 196 ? 0.6484 0.6764 0.7847 -0.1530 -0.0482 -0.1226 199 VAL D CA 5682 C C . VAL D 196 ? 0.6710 0.6790 0.7796 -0.1588 -0.0353 -0.1146 199 VAL D C 5683 O O . VAL D 196 ? 0.6702 0.6572 0.7586 -0.1318 -0.0385 -0.0979 199 VAL D O 5684 C CB . VAL D 196 ? 0.6863 0.6315 0.7937 -0.1812 -0.0512 -0.1059 199 VAL D CB 5685 C CG1 . VAL D 196 ? 0.6882 0.6428 0.8144 -0.1874 -0.0518 -0.1237 199 VAL D CG1 5686 C CG2 . VAL D 196 ? 0.6783 0.5709 0.7593 -0.1613 -0.0703 -0.0703 199 VAL D CG2 5687 N N . SER D 197 ? 0.7054 0.7111 0.8042 -0.1995 -0.0156 -0.1290 200 SER D N 5688 C CA . SER D 197 ? 0.7341 0.7133 0.8010 -0.2117 -0.0011 -0.1221 200 SER D CA 5689 C C . SER D 197 ? 0.7607 0.6475 0.7778 -0.2231 -0.0120 -0.0864 200 SER D C 5690 O O . SER D 197 ? 0.7713 0.6167 0.7772 -0.2254 -0.0274 -0.0694 200 SER D O 5691 C CB . SER D 197 ? 0.7677 0.7758 0.8355 -0.2578 0.0265 -0.1510 200 SER D CB 5692 O OG . SER D 197 ? 0.8244 0.7523 0.8532 -0.3037 0.0340 -0.1421 200 SER D OG 5693 N N . ALA D 198 ? 0.7769 0.6401 0.7620 -0.2268 -0.0034 -0.0780 201 ALA D N 5694 C CA . ALA D 198 ? 0.8004 0.6025 0.7387 -0.2398 -0.0142 -0.0509 201 ALA D CA 5695 C C . ALA D 198 ? 0.8484 0.6007 0.7495 -0.2704 -0.0140 -0.0384 201 ALA D C 5696 O O . ALA D 198 ? 0.8667 0.5855 0.7401 -0.2637 -0.0343 -0.0142 201 ALA D O 5697 C CB . ALA D 198 ? 0.8236 0.6110 0.7294 -0.2447 0.0011 -0.0518 201 ALA D CB 5698 N N . THR D 199 ? 0.8784 0.6272 0.7718 -0.3012 0.0111 -0.0560 202 THR D N 5699 C CA . THR D 199 ? 0.9541 0.6287 0.7894 -0.3330 0.0214 -0.0438 202 THR D CA 5700 C C . THR D 199 ? 0.9746 0.6088 0.8035 -0.3247 0.0140 -0.0367 202 THR D C 5701 O O . THR D 199 ? 1.0515 0.5986 0.8128 -0.3286 0.0152 -0.0133 202 THR D O 5702 C CB . THR D 199 ? 0.9989 0.6748 0.8187 -0.3802 0.0595 -0.0701 202 THR D CB 5703 O OG1 . THR D 199 ? 0.9696 0.7211 0.8484 -0.3894 0.0750 -0.1089 202 THR D OG1 5704 C CG2 . THR D 199 ? 0.9903 0.6916 0.8034 -0.3847 0.0693 -0.0747 202 THR D CG2 5705 N N . PHE D 200 ? 0.9163 0.6076 0.8058 -0.3078 0.0077 -0.0558 203 PHE D N 5706 C CA . PHE D 200 ? 0.9373 0.5926 0.8234 -0.2966 0.0011 -0.0519 203 PHE D CA 5707 C C . PHE D 200 ? 0.9267 0.5624 0.8025 -0.2508 -0.0327 -0.0181 203 PHE D C 5708 O O . PHE D 200 ? 0.9906 0.5547 0.8191 -0.2360 -0.0367 0.0016 203 PHE D O 5709 C CB . PHE D 200 ? 0.8786 0.6146 0.8325 -0.2948 0.0043 -0.0865 203 PHE D CB 5710 C CG . PHE D 200 ? 0.9238 0.6137 0.8649 -0.3011 0.0105 -0.0937 203 PHE D CG 5711 C CD1 . PHE D 200 ? 0.8893 0.5825 0.8511 -0.2584 -0.0155 -0.0795 203 PHE D CD1 5712 C CD2 . PHE D 200 ? 1.0067 0.6422 0.9066 -0.3549 0.0483 -0.1179 203 PHE D CD2 5713 C CE1 . PHE D 200 ? 0.9345 0.5761 0.8778 -0.2621 -0.0061 -0.0877 203 PHE D CE1 5714 C CE2 . PHE D 200 ? 1.0626 0.6349 0.9354 -0.3652 0.0618 -0.1274 203 PHE D CE2 5715 C CZ . PHE D 200 ? 1.0241 0.5985 0.9193 -0.3152 0.0335 -0.1114 203 PHE D CZ 5716 N N . TRP D 201 ? 0.8611 0.5594 0.7743 -0.2277 -0.0530 -0.0140 204 TRP D N 5717 C CA . TRP D 201 ? 0.8476 0.5562 0.7594 -0.1940 -0.0824 0.0087 204 TRP D CA 5718 C C . TRP D 201 ? 0.9081 0.5801 0.7581 -0.1909 -0.0935 0.0359 204 TRP D C 5719 O O . TRP D 201 ? 0.9226 0.6008 0.7590 -0.1583 -0.1169 0.0545 204 TRP D O 5720 C CB . TRP D 201 ? 0.7802 0.5528 0.7326 -0.1839 -0.0907 0.0003 204 TRP D CB 5721 C CG . TRP D 201 ? 0.7803 0.5762 0.7241 -0.1693 -0.1135 0.0159 204 TRP D CG 5722 C CD1 . TRP D 201 ? 0.7878 0.6000 0.7072 -0.1859 -0.1156 0.0192 204 TRP D CD1 5723 C CD2 . TRP D 201 ? 0.7792 0.5975 0.7378 -0.1395 -0.1351 0.0243 204 TRP D CD2 5724 N NE1 . TRP D 201 ? 0.7861 0.6442 0.7085 -0.1733 -0.1376 0.0256 204 TRP D NE1 5725 C CE2 . TRP D 201 ? 0.7790 0.6448 0.7277 -0.1405 -0.1508 0.0300 204 TRP D CE2 5726 C CE3 . TRP D 201 ? 0.7772 0.5851 0.7550 -0.1142 -0.1401 0.0236 204 TRP D CE3 5727 C CZ2 . TRP D 201 ? 0.7710 0.6905 0.7357 -0.1134 -0.1731 0.0341 204 TRP D CZ2 5728 C CZ3 . TRP D 201 ? 0.7762 0.6195 0.7647 -0.0823 -0.1614 0.0317 204 TRP D CZ3 5729 C CH2 . TRP D 201 ? 0.7671 0.6735 0.7526 -0.0803 -0.1786 0.0365 204 TRP D CH2 5730 N N . GLN D 202 ? 0.9467 0.5920 0.7587 -0.2211 -0.0772 0.0364 205 GLN D N 5731 C CA . GLN D 202 ? 1.0121 0.6293 0.7581 -0.2193 -0.0875 0.0609 205 GLN D CA 5732 C C . GLN D 202 ? 1.1184 0.6422 0.7896 -0.2039 -0.0823 0.0841 205 GLN D C 5733 O O . GLN D 202 ? 1.1930 0.6864 0.7947 -0.1895 -0.0926 0.1095 205 GLN D O 5734 C CB . GLN D 202 ? 1.0214 0.6389 0.7471 -0.2582 -0.0690 0.0519 205 GLN D CB 5735 C CG . GLN D 202 ? 0.9681 0.6508 0.7287 -0.2657 -0.0739 0.0380 205 GLN D CG 5736 C CD . GLN D 202 ? 0.9771 0.6535 0.7340 -0.2976 -0.0442 0.0187 205 GLN D CD 5737 O OE1 . GLN D 202 ? 1.0066 0.6559 0.7572 -0.3155 -0.0207 0.0091 205 GLN D OE1 5738 N NE2 . GLN D 202 ? 0.9531 0.6535 0.7089 -0.3071 -0.0405 0.0093 205 GLN D NE2 5739 N N . ASN D 203 ? 1.1409 0.6136 0.8158 -0.2062 -0.0636 0.0743 206 ASN D N 5740 C CA . ASN D 203 ? 1.2670 0.6198 0.8539 -0.1927 -0.0481 0.0940 206 ASN D CA 5741 C C . ASN D 203 ? 1.2896 0.6398 0.8651 -0.1254 -0.0768 0.1173 206 ASN D C 5742 O O . ASN D 203 ? 1.2137 0.6214 0.8589 -0.1095 -0.0887 0.1028 206 ASN D O 5743 C CB . ASN D 203 ? 1.2973 0.5945 0.8857 -0.2380 -0.0068 0.0643 206 ASN D CB 5744 C CG . ASN D 203 ? 1.4609 0.5979 0.9304 -0.2445 0.0268 0.0798 206 ASN D CG 5745 O OD1 . ASN D 203 ? 1.5409 0.6028 0.9501 -0.1906 0.0173 0.1081 206 ASN D OD1 5746 N ND2 . ASN D 203 ? 1.5273 0.6060 0.9546 -0.3100 0.0712 0.0595 206 ASN D ND2 5747 N N . PRO D 204 ? 1.4007 0.6903 0.8843 -0.0799 -0.0881 0.1536 207 PRO D N 5748 C CA . PRO D 204 ? 1.4428 0.7353 0.9053 -0.0022 -0.1148 0.1768 207 PRO D CA 5749 C C . PRO D 204 ? 1.5170 0.7004 0.9483 0.0148 -0.0888 0.1737 207 PRO D C 5750 O O . PRO D 204 ? 1.4822 0.7123 0.9548 0.0611 -0.1082 0.1724 207 PRO D O 5751 C CB . PRO D 204 ? 1.5735 0.8116 0.9224 0.0436 -0.1258 0.2167 207 PRO D CB 5752 C CG . PRO D 204 ? 1.6421 0.7821 0.9256 -0.0177 -0.0887 0.2158 207 PRO D CG 5753 C CD . PRO D 204 ? 1.4949 0.7262 0.8885 -0.0918 -0.0795 0.1749 207 PRO D CD 5754 N N . ARG D 205 ? 1.6264 0.6666 0.9820 -0.0289 -0.0412 0.1682 208 ARG D N 5755 C CA . ARG D 205 ? 1.7348 0.6426 1.0340 -0.0250 -0.0052 0.1616 208 ARG D CA 5756 C C . ARG D 205 ? 1.6166 0.6034 1.0265 -0.0584 -0.0018 0.1190 208 ARG D C 5757 O O . ARG D 205 ? 1.6868 0.5867 1.0638 -0.0532 0.0232 0.1083 208 ARG D O 5758 C CB . ARG D 205 ? 1.8996 0.6300 1.0768 -0.0806 0.0537 0.1600 208 ARG D CB 5759 N N . ASN D 206 ? 1.4508 0.5933 0.9796 -0.0895 -0.0247 0.0953 209 ASN D N 5760 C CA . ASN D 206 ? 1.3382 0.5703 0.9689 -0.1126 -0.0265 0.0580 209 ASN D CA 5761 C C . ASN D 206 ? 1.2703 0.5796 0.9567 -0.0516 -0.0629 0.0659 209 ASN D C 5762 O O . ASN D 206 ? 1.2249 0.6094 0.9310 -0.0111 -0.0981 0.0869 209 ASN D O 5763 C CB . ASN D 206 ? 1.2178 0.5626 0.9314 -0.1642 -0.0279 0.0301 209 ASN D CB 5764 C CG . ASN D 206 ? 1.2785 0.5728 0.9597 -0.2349 0.0164 0.0034 209 ASN D CG 5765 O OD1 . ASN D 206 ? 1.3942 0.5780 1.0077 -0.2628 0.0543 -0.0076 209 ASN D OD1 5766 N ND2 . ASN D 206 ? 1.2111 0.5849 0.9356 -0.2671 0.0166 -0.0107 209 ASN D ND2 5767 N N . HIS D 207 ? 1.2710 0.5675 0.9806 -0.0519 -0.0510 0.0442 210 HIS D N 5768 C CA . HIS D 207 ? 1.2308 0.5828 0.9818 0.0041 -0.0773 0.0485 210 HIS D CA 5769 C C . HIS D 207 ? 1.1078 0.5639 0.9574 -0.0220 -0.0829 0.0138 210 HIS D C 5770 O O . HIS D 207 ? 1.1053 0.5492 0.9675 -0.0713 -0.0570 -0.0178 210 HIS D O 5771 C CB . HIS D 207 ? 1.3768 0.5935 1.0395 0.0472 -0.0565 0.0608 210 HIS D CB 5772 C CG . HIS D 207 ? 1.3501 0.6216 1.0538 0.1049 -0.0778 0.0601 210 HIS D CG 5773 N ND1 . HIS D 207 ? 1.3019 0.6809 1.0428 0.1645 -0.1186 0.0798 210 HIS D ND1 5774 C CD2 . HIS D 207 ? 1.3778 0.6180 1.0896 0.1079 -0.0611 0.0379 210 HIS D CD2 5775 C CE1 . HIS D 207 ? 1.2914 0.7049 1.0643 0.2037 -0.1258 0.0705 210 HIS D CE1 5776 N NE2 . HIS D 207 ? 1.3368 0.6614 1.0910 0.1727 -0.0919 0.0469 210 HIS D NE2 5777 N N . PHE D 208 ? 1.0147 0.5781 0.9276 0.0103 -0.1153 0.0182 211 PHE D N 5778 C CA . PHE D 208 ? 0.9114 0.5678 0.9037 -0.0057 -0.1221 -0.0079 211 PHE D CA 5779 C C . PHE D 208 ? 0.8998 0.5847 0.9148 0.0378 -0.1349 -0.0092 211 PHE D C 5780 O O . PHE D 208 ? 0.9355 0.6210 0.9288 0.0866 -0.1503 0.0119 211 PHE D O 5781 C CB . PHE D 208 ? 0.8226 0.5703 0.8591 -0.0197 -0.1391 -0.0059 211 PHE D CB 5782 C CG . PHE D 208 ? 0.8395 0.5674 0.8575 -0.0593 -0.1252 -0.0074 211 PHE D CG 5783 C CD1 . PHE D 208 ? 0.8961 0.5832 0.8629 -0.0582 -0.1273 0.0159 211 PHE D CD1 5784 C CD2 . PHE D 208 ? 0.8021 0.5630 0.8521 -0.0930 -0.1104 -0.0335 211 PHE D CD2 5785 C CE1 . PHE D 208 ? 0.9090 0.5781 0.8572 -0.0969 -0.1117 0.0125 211 PHE D CE1 5786 C CE2 . PHE D 208 ? 0.8100 0.5650 0.8463 -0.1262 -0.0956 -0.0384 211 PHE D CE2 5787 C CZ . PHE D 208 ? 0.8624 0.5662 0.8480 -0.1315 -0.0947 -0.0156 211 PHE D CZ 5788 N N . ARG D 209 ? 0.8547 0.5734 0.9119 0.0230 -0.1286 -0.0360 212 ARG D N 5789 C CA . ARG D 209 ? 0.8447 0.5885 0.9235 0.0577 -0.1357 -0.0428 212 ARG D CA 5790 C C . ARG D 209 ? 0.7642 0.5816 0.8992 0.0360 -0.1365 -0.0697 212 ARG D C 5791 O O . ARG D 209 ? 0.7678 0.5756 0.9057 0.0020 -0.1197 -0.0945 212 ARG D O 5792 C CB . ARG D 209 ? 0.9607 0.5912 0.9789 0.0762 -0.1126 -0.0456 212 ARG D CB 5793 C CG . ARG D 209 ? 0.9752 0.6197 1.0003 0.1306 -0.1206 -0.0446 212 ARG D CG 5794 C CD . ARG D 209 ? 1.1046 0.6161 1.0587 0.1443 -0.0885 -0.0529 212 ARG D CD 5795 N NE . ARG D 209 ? 1.0943 0.5986 1.0654 0.0927 -0.0657 -0.0924 212 ARG D NE 5796 N N . CYS D 210 ? 0.7005 0.5971 0.8743 0.0544 -0.1543 -0.0666 213 CYS D N 5797 C CA . CYS D 210 ? 0.6453 0.5990 0.8557 0.0472 -0.1545 -0.0870 213 CYS D CA 5798 C C . CYS D 210 ? 0.6734 0.6082 0.8828 0.0678 -0.1480 -0.1014 213 CYS D C 5799 O O . CYS D 210 ? 0.7174 0.6244 0.9090 0.1022 -0.1503 -0.0901 213 CYS D O 5800 C CB . CYS D 210 ? 0.5897 0.6116 0.8219 0.0525 -0.1668 -0.0784 213 CYS D CB 5801 S SG . CYS D 210 ? 0.5629 0.6322 0.8124 0.0454 -0.1627 -0.0949 213 CYS D SG 5802 N N . GLN D 211 ? 0.6545 0.6083 0.8783 0.0516 -0.1398 -0.1276 214 GLN D N 5803 C CA . GLN D 211 ? 0.6903 0.6207 0.9080 0.0643 -0.1293 -0.1464 214 GLN D CA 5804 C C . GLN D 211 ? 0.6359 0.6408 0.8852 0.0629 -0.1346 -0.1648 214 GLN D C 5805 O O . GLN D 211 ? 0.6153 0.6570 0.8733 0.0391 -0.1326 -0.1836 214 GLN D O 5806 C CB . GLN D 211 ? 0.7691 0.6195 0.9488 0.0341 -0.1032 -0.1688 214 GLN D CB 5807 C CG . GLN D 211 ? 0.8510 0.6288 0.9965 0.0508 -0.0836 -0.1829 214 GLN D CG 5808 C CD . GLN D 211 ? 0.8910 0.6684 1.0316 0.0063 -0.0616 -0.2274 214 GLN D CD 5809 O OE1 . GLN D 211 ? 1.0047 0.6801 1.0901 -0.0114 -0.0293 -0.2473 214 GLN D OE1 5810 N NE2 . GLN D 211 ? 0.8055 0.6945 0.9940 -0.0111 -0.0765 -0.2451 214 GLN D NE2 5811 N N . VAL D 212 ? 0.6188 0.6538 0.8816 0.0911 -0.1410 -0.1604 215 VAL D N 5812 C CA . VAL D 212 ? 0.5794 0.6740 0.8598 0.0915 -0.1430 -0.1749 215 VAL D CA 5813 C C . VAL D 212 ? 0.6174 0.6978 0.8948 0.1043 -0.1318 -0.1977 215 VAL D C 5814 O O . VAL D 212 ? 0.6439 0.7104 0.9207 0.1348 -0.1297 -0.1924 215 VAL D O 5815 C CB . VAL D 212 ? 0.5363 0.6822 0.8275 0.0995 -0.1517 -0.1577 215 VAL D CB 5816 C CG1 . VAL D 212 ? 0.5187 0.7051 0.8099 0.1003 -0.1478 -0.1707 215 VAL D CG1 5817 C CG2 . VAL D 212 ? 0.5086 0.6539 0.7905 0.0831 -0.1563 -0.1399 215 VAL D CG2 5818 N N . GLN D 213 ? 0.6235 0.7161 0.8973 0.0831 -0.1243 -0.2257 216 GLN D N 5819 C CA . GLN D 213 ? 0.6647 0.7428 0.9296 0.0852 -0.1099 -0.2544 216 GLN D CA 5820 C C . GLN D 213 ? 0.6250 0.7740 0.9044 0.0962 -0.1169 -0.2599 216 GLN D C 5821 O O . GLN D 213 ? 0.5939 0.7960 0.8733 0.0848 -0.1248 -0.2656 216 GLN D O 5822 C CB . GLN D 213 ? 0.7067 0.7658 0.9535 0.0442 -0.0943 -0.2895 216 GLN D CB 5823 C CG . GLN D 213 ? 0.7495 0.8167 0.9858 0.0330 -0.0795 -0.3279 216 GLN D CG 5824 C CD . GLN D 213 ? 0.8577 0.8188 1.0575 0.0446 -0.0527 -0.3377 216 GLN D CD 5825 O OE1 . GLN D 213 ? 0.8788 0.8389 1.0807 0.0789 -0.0503 -0.3367 216 GLN D OE1 5826 N NE2 . GLN D 213 ? 0.9453 0.8088 1.1019 0.0178 -0.0278 -0.3479 216 GLN D NE2 5827 N N . PHE D 214 ? 0.6361 0.7870 0.9217 0.1228 -0.1126 -0.2581 217 PHE D N 5828 C CA . PHE D 214 ? 0.6112 0.8218 0.9040 0.1294 -0.1136 -0.2629 217 PHE D CA 5829 C C . PHE D 214 ? 0.6553 0.8586 0.9401 0.1339 -0.0985 -0.2945 217 PHE D C 5830 O O . PHE D 214 ? 0.7084 0.8583 0.9859 0.1510 -0.0850 -0.3039 217 PHE D O 5831 C CB . PHE D 214 ? 0.5883 0.8319 0.8984 0.1473 -0.1172 -0.2427 217 PHE D CB 5832 C CG . PHE D 214 ? 0.5833 0.8782 0.8970 0.1516 -0.1082 -0.2548 217 PHE D CG 5833 C CD1 . PHE D 214 ? 0.5677 0.8872 0.8584 0.1331 -0.1057 -0.2522 217 PHE D CD1 5834 C CD2 . PHE D 214 ? 0.6034 0.9176 0.9345 0.1783 -0.0990 -0.2684 217 PHE D CD2 5835 C CE1 . PHE D 214 ? 0.5775 0.9338 0.8602 0.1310 -0.0920 -0.2638 217 PHE D CE1 5836 C CE2 . PHE D 214 ? 0.6036 0.9731 0.9395 0.1774 -0.0874 -0.2835 217 PHE D CE2 5837 C CZ . PHE D 214 ? 0.5895 0.9772 0.9000 0.1486 -0.0827 -0.2816 217 PHE D CZ 5838 N N . TYR D 215 ? 0.6470 0.8965 0.9226 0.1228 -0.0988 -0.3097 218 TYR D N 5839 C CA . TYR D 215 ? 0.6878 0.9395 0.9515 0.1202 -0.0843 -0.3438 218 TYR D CA 5840 C C . TYR D 215 ? 0.6809 0.9730 0.9482 0.1372 -0.0781 -0.3437 218 TYR D C 5841 O O . TYR D 215 ? 0.6587 0.9929 0.9120 0.1317 -0.0833 -0.3340 218 TYR D O 5842 C CB . TYR D 215 ? 0.6910 0.9807 0.9366 0.0937 -0.0893 -0.3673 218 TYR D CB 5843 C CG . TYR D 215 ? 0.7091 0.9779 0.9532 0.0656 -0.0893 -0.3804 218 TYR D CG 5844 C CD1 . TYR D 215 ? 0.6746 0.9755 0.9258 0.0609 -0.1066 -0.3615 218 TYR D CD1 5845 C CD2 . TYR D 215 ? 0.7821 0.9923 1.0095 0.0402 -0.0660 -0.4150 218 TYR D CD2 5846 C CE1 . TYR D 215 ? 0.6971 0.9916 0.9495 0.0294 -0.1033 -0.3787 218 TYR D CE1 5847 C CE2 . TYR D 215 ? 0.8131 1.0011 1.0311 0.0015 -0.0581 -0.4331 218 TYR D CE2 5848 C CZ . TYR D 215 ? 0.7673 1.0074 1.0032 -0.0049 -0.0780 -0.4159 218 TYR D CZ 5849 O OH . TYR D 215 ? 0.7999 1.0298 1.0290 -0.0486 -0.0669 -0.4387 218 TYR D OH 5850 N N . GLY D 216 ? 0.7149 0.9893 0.9926 0.1603 -0.0634 -0.3552 219 GLY D N 5851 C CA . GLY D 216 ? 0.7106 1.0370 0.9992 0.1752 -0.0539 -0.3605 219 GLY D CA 5852 C C . GLY D 216 ? 0.7652 1.0777 1.0443 0.1883 -0.0329 -0.3946 219 GLY D C 5853 O O . GLY D 216 ? 0.8015 1.0804 1.0542 0.1694 -0.0255 -0.4195 219 GLY D O 5854 N N . LEU D 217 ? 0.7778 1.1257 1.0780 0.2192 -0.0215 -0.3998 220 LEU D N 5855 C CA . LEU D 217 ? 0.8378 1.1752 1.1289 0.2410 0.0021 -0.4324 220 LEU D CA 5856 C C . LEU D 217 ? 0.9213 1.1516 1.1831 0.2616 0.0167 -0.4455 220 LEU D C 5857 O O . LEU D 217 ? 0.9399 1.1202 1.2003 0.2874 0.0117 -0.4248 220 LEU D O 5858 C CB . LEU D 217 ? 0.8310 1.2472 1.1575 0.2776 0.0106 -0.4355 220 LEU D CB 5859 C CG . LEU D 217 ? 0.7766 1.2914 1.1195 0.2475 0.0108 -0.4330 220 LEU D CG 5860 N N . SER D 218 ? 0.9873 1.1735 1.2142 0.2462 0.0387 -0.4810 221 SER D N 5861 C CA . SER D 218 ? 1.1013 1.1635 1.2801 0.2588 0.0663 -0.5016 221 SER D CA 5862 C C . SER D 218 ? 1.1769 1.2170 1.3487 0.3254 0.0908 -0.5122 221 SER D C 5863 O O . SER D 218 ? 1.1555 1.2771 1.3510 0.3363 0.0959 -0.5277 221 SER D O 5864 C CB . SER D 218 ? 1.1454 1.1735 1.2833 0.2006 0.0825 -0.5426 221 SER D CB 5865 N N . GLU D 219 ? 1.2786 1.2052 1.4097 0.3735 0.1085 -0.5038 222 GLU D N 5866 C CA . GLU D 219 ? 1.3691 1.2691 1.4847 0.4603 0.1303 -0.5071 222 GLU D CA 5867 C C . GLU D 219 ? 1.4343 1.3291 1.5295 0.4693 0.1632 -0.5499 222 GLU D C 5868 O O . GLU D 219 ? 1.5142 1.3937 1.5956 0.5480 0.1839 -0.5562 222 GLU D O 5869 C CB . GLU D 219 ? 1.5047 1.2385 1.5449 0.5102 0.1516 -0.4909 222 GLU D CB 5870 N N . ASN D 220 ? 1.4081 1.3222 1.4986 0.3945 0.1675 -0.5798 223 ASN D N 5871 C CA . ASN D 220 ? 1.4543 1.3861 1.5307 0.3918 0.1948 -0.6215 223 ASN D CA 5872 C C . ASN D 220 ? 1.3423 1.4458 1.4868 0.3846 0.1745 -0.6203 223 ASN D C 5873 O O . ASN D 220 ? 1.3650 1.5021 1.5022 0.3769 0.1947 -0.6535 223 ASN D O 5874 C CB . ASN D 220 ? 1.5098 1.3671 1.5297 0.3144 0.2156 -0.6616 223 ASN D CB 5875 N N . ASP D 221 ? 1.2349 1.4363 1.4355 0.3821 0.1396 -0.5841 224 ASP D N 5876 C CA . ASP D 221 ? 1.1437 1.4913 1.3952 0.3654 0.1265 -0.5808 224 ASP D CA 5877 C C . ASP D 221 ? 1.1327 1.5757 1.4343 0.4293 0.1276 -0.5749 224 ASP D C 5878 O O . ASP D 221 ? 1.1303 1.5696 1.4488 0.4732 0.1130 -0.5492 224 ASP D O 5879 C CB . ASP D 221 ? 1.0471 1.4368 1.3142 0.3106 0.0944 -0.5505 224 ASP D CB 5880 N N . GLU D 222 ? 1.1296 1.6697 1.4535 0.4335 0.1452 -0.6016 225 GLU D N 5881 C CA . GLU D 222 ? 1.1236 1.7903 1.5016 0.4911 0.1500 -0.6086 225 GLU D CA 5882 C C . GLU D 222 ? 1.0271 1.8158 1.4579 0.4613 0.1248 -0.5852 225 GLU D C 5883 O O . GLU D 222 ? 0.9687 1.7735 1.3925 0.3870 0.1176 -0.5760 225 GLU D O 5884 C CB . GLU D 222 ? 1.1508 1.8930 1.5361 0.4933 0.1813 -0.6505 225 GLU D CB 5885 N N . TRP D 223 ? 1.0250 1.8959 1.4988 0.5225 0.1139 -0.5772 226 TRP D N 5886 C CA . TRP D 223 ? 0.9457 1.9389 1.4683 0.4941 0.0922 -0.5610 226 TRP D CA 5887 C C . TRP D 223 ? 0.9430 2.1277 1.5301 0.5439 0.0981 -0.5871 226 TRP D C 5888 O O . TRP D 223 ? 1.0060 2.2072 1.6005 0.6415 0.1005 -0.5943 226 TRP D O 5889 C CB . TRP D 223 ? 0.9342 1.8455 1.4438 0.5079 0.0624 -0.5198 226 TRP D CB 5890 C CG . TRP D 223 ? 0.8581 1.8732 1.4064 0.4675 0.0413 -0.5033 226 TRP D CG 5891 C CD1 . TRP D 223 ? 0.8493 1.9562 1.4347 0.5139 0.0214 -0.4926 226 TRP D CD1 5892 C CD2 . TRP D 223 ? 0.7973 1.8284 1.3393 0.3737 0.0416 -0.4971 226 TRP D CD2 5893 N NE1 . TRP D 223 ? 0.7812 1.9644 1.3889 0.4447 0.0103 -0.4846 226 TRP D NE1 5894 C CE2 . TRP D 223 ? 0.7552 1.8820 1.3318 0.3593 0.0252 -0.4861 226 TRP D CE2 5895 C CE3 . TRP D 223 ? 0.7879 1.7566 1.2875 0.3053 0.0558 -0.4994 226 TRP D CE3 5896 C CZ2 . TRP D 223 ? 0.7122 1.8556 1.2768 0.2738 0.0285 -0.4788 226 TRP D CZ2 5897 C CZ3 . TRP D 223 ? 0.7511 1.7340 1.2342 0.2322 0.0569 -0.4870 226 TRP D CZ3 5898 C CH2 . TRP D 223 ? 0.7183 1.7790 1.2311 0.2145 0.0462 -0.4776 226 TRP D CH2 5899 N N . THR D 224 ? 0.8826 2.2113 1.5085 0.4774 0.1036 -0.6032 227 THR D N 5900 C CA . THR D 224 ? 0.8767 2.4234 1.5699 0.5033 0.1151 -0.6416 227 THR D CA 5901 C C . THR D 224 ? 0.8211 2.5154 1.5635 0.4798 0.0952 -0.6381 227 THR D C 5902 O O . THR D 224 ? 0.8288 2.6895 1.6272 0.5479 0.0860 -0.6569 227 THR D O 5903 C CB . THR D 224 ? 0.8770 2.5040 1.5741 0.4364 0.1535 -0.6836 227 THR D CB 5904 O OG1 . THR D 224 ? 0.8455 2.3991 1.4972 0.3270 0.1606 -0.6685 227 THR D OG1 5905 C CG2 . THR D 224 ? 0.9414 2.4799 1.6053 0.4791 0.1761 -0.7012 227 THR D CG2 5906 N N . GLN D 225 ? 0.7748 2.4121 1.4912 0.3872 0.0897 -0.6163 228 GLN D N 5907 C CA . GLN D 225 ? 0.7301 2.4980 1.4814 0.3385 0.0799 -0.6197 228 GLN D CA 5908 C C . GLN D 225 ? 0.7262 2.5851 1.5212 0.4259 0.0448 -0.6083 228 GLN D C 5909 O O . GLN D 225 ? 0.7575 2.4922 1.5266 0.5082 0.0224 -0.5745 228 GLN D O 5910 C CB . GLN D 225 ? 0.7046 2.3368 1.3991 0.2460 0.0782 -0.5871 228 GLN D CB 5911 C CG . GLN D 225 ? 0.7240 2.2851 1.3621 0.1582 0.1148 -0.5973 228 GLN D CG 5912 N N . ASP D 226 ? 0.6988 2.7743 1.5514 0.4031 0.0432 -0.6389 229 ASP D N 5913 C CA . ASP D 226 ? 0.7005 2.9185 1.6004 0.4925 0.0094 -0.6372 229 ASP D CA 5914 C C . ASP D 226 ? 0.6862 2.7898 1.5541 0.5030 -0.0264 -0.5862 229 ASP D C 5915 O O . ASP D 226 ? 0.6964 2.9098 1.5919 0.5761 -0.0562 -0.5804 229 ASP D O 5916 C CB . ASP D 226 ? 0.6754 3.1926 1.6507 0.4542 0.0195 -0.6953 229 ASP D CB 5917 N N . ARG D 227 ? 0.6675 2.5615 1.4756 0.4351 -0.0236 -0.5507 230 ARG D N 5918 C CA . ARG D 227 ? 0.6595 2.4244 1.4324 0.4476 -0.0540 -0.5022 230 ARG D CA 5919 C C . ARG D 227 ? 0.7076 2.2585 1.4264 0.5211 -0.0620 -0.4646 230 ARG D C 5920 O O . ARG D 227 ? 0.7523 2.2680 1.4630 0.5706 -0.0454 -0.4781 230 ARG D O 5921 C CB . ARG D 227 ? 0.6179 2.3074 1.3587 0.3281 -0.0455 -0.4898 230 ARG D CB 5922 C CG . ARG D 227 ? 0.6228 2.1247 1.3047 0.2724 -0.0239 -0.4748 230 ARG D CG 5923 C CD . ARG D 227 ? 0.6002 2.0312 1.2395 0.1713 -0.0137 -0.4609 230 ARG D CD 5924 N NE . ARG D 227 ? 0.6075 1.8423 1.1830 0.1503 -0.0088 -0.4314 230 ARG D NE 5925 C CZ . ARG D 227 ? 0.6279 1.8081 1.1650 0.1100 0.0190 -0.4420 230 ARG D CZ 5926 N NH1 . ARG D 227 ? 0.6444 1.9355 1.1967 0.0786 0.0497 -0.4815 230 ARG D NH1 5927 N NH2 . ARG D 227 ? 0.6363 1.6593 1.1169 0.1016 0.0168 -0.4148 230 ARG D NH2 5928 N N . ALA D 228 ? 0.7065 2.1162 1.3844 0.5222 -0.0827 -0.4222 231 ALA D N 5929 C CA . ALA D 228 ? 0.7620 1.9637 1.3798 0.5743 -0.0848 -0.3907 231 ALA D CA 5930 C C . ALA D 228 ? 0.7532 1.8149 1.3353 0.5126 -0.0626 -0.3935 231 ALA D C 5931 O O . ALA D 228 ? 0.6990 1.7714 1.2833 0.4243 -0.0545 -0.3991 231 ALA D O 5932 C CB . ALA D 228 ? 0.7656 1.8734 1.3506 0.5810 -0.1096 -0.3497 231 ALA D CB 5933 N N . LYS D 229 ? 0.8206 1.7482 1.3600 0.5609 -0.0504 -0.3909 232 LYS D N 5934 C CA . LYS D 229 ? 0.8227 1.6261 1.3247 0.5081 -0.0318 -0.3972 232 LYS D CA 5935 C C . LYS D 229 ? 0.7907 1.4772 1.2593 0.4489 -0.0446 -0.3686 232 LYS D C 5936 O O . LYS D 229 ? 0.8248 1.4211 1.2651 0.4766 -0.0563 -0.3434 232 LYS D O 5937 C CB . LYS D 229 ? 0.9198 1.6122 1.3787 0.5701 -0.0110 -0.4086 232 LYS D CB 5938 N N . PRO D 230 ? 0.7364 1.4226 1.2007 0.3715 -0.0400 -0.3723 233 PRO D N 5939 C CA . PRO D 230 ? 0.7015 1.3071 1.1392 0.3205 -0.0528 -0.3472 233 PRO D CA 5940 C C . PRO D 230 ? 0.7390 1.2101 1.1323 0.3161 -0.0483 -0.3464 233 PRO D C 5941 O O . PRO D 230 ? 0.7207 1.1644 1.0928 0.2701 -0.0452 -0.3511 233 PRO D O 5942 C CB . PRO D 230 ? 0.6584 1.3174 1.0945 0.2553 -0.0437 -0.3540 233 PRO D CB 5943 C CG . PRO D 230 ? 0.6820 1.3963 1.1259 0.2618 -0.0211 -0.3862 233 PRO D CG 5944 C CD . PRO D 230 ? 0.7224 1.4765 1.1955 0.3354 -0.0194 -0.4003 233 PRO D CD 5945 N N . VAL D 231 ? 0.8034 1.1924 1.1747 0.3635 -0.0457 -0.3420 234 VAL D N 5946 C CA . VAL D 231 ? 0.8620 1.1214 1.1839 0.3512 -0.0322 -0.3510 234 VAL D CA 5947 C C . VAL D 231 ? 0.8298 1.0362 1.1360 0.3032 -0.0459 -0.3330 234 VAL D C 5948 O O . VAL D 231 ? 0.7715 1.0210 1.0993 0.2906 -0.0656 -0.3084 234 VAL D O 5949 C CB . VAL D 231 ? 0.9763 1.1344 1.2559 0.4158 -0.0139 -0.3533 234 VAL D CB 5950 C CG1 . VAL D 231 ? 1.0190 1.2322 1.3113 0.4748 0.0018 -0.3741 234 VAL D CG1 5951 C CG2 . VAL D 231 ? 0.9979 1.1264 1.2672 0.4532 -0.0293 -0.3191 234 VAL D CG2 5952 N N . THR D 232 ? 0.8732 0.9945 1.1413 0.2735 -0.0326 -0.3504 235 THR D N 5953 C CA . THR D 232 ? 0.8593 0.9340 1.1112 0.2320 -0.0409 -0.3408 235 THR D CA 5954 C C . THR D 232 ? 0.9084 0.9040 1.1374 0.2611 -0.0402 -0.3166 235 THR D C 5955 O O . THR D 232 ? 1.0098 0.9147 1.1964 0.3009 -0.0185 -0.3215 235 THR D O 5956 C CB . THR D 232 ? 0.9064 0.9307 1.1236 0.1872 -0.0226 -0.3764 235 THR D CB 5957 O OG1 . THR D 232 ? 0.8530 0.9649 1.0874 0.1611 -0.0314 -0.3917 235 THR D OG1 5958 C CG2 . THR D 232 ? 0.9155 0.8930 1.1141 0.1464 -0.0245 -0.3740 235 THR D CG2 5959 N N . GLN D 233 ? 0.8486 0.8699 1.0951 0.2452 -0.0616 -0.2896 236 GLN D N 5960 C CA . GLN D 233 ? 0.8844 0.8474 1.1096 0.2733 -0.0657 -0.2617 236 GLN D CA 5961 C C . GLN D 233 ? 0.8343 0.7979 1.0647 0.2303 -0.0804 -0.2445 236 GLN D C 5962 O O . GLN D 233 ? 0.7588 0.7875 1.0167 0.1910 -0.0920 -0.2486 236 GLN D O 5963 C CB . GLN D 233 ? 0.8638 0.9053 1.1190 0.3301 -0.0812 -0.2424 236 GLN D CB 5964 C CG . GLN D 233 ? 0.7579 0.9349 1.0702 0.3055 -0.0993 -0.2418 236 GLN D CG 5965 C CD . GLN D 233 ? 0.7449 1.0231 1.0900 0.3491 -0.1110 -0.2337 236 GLN D CD 5966 O OE1 . GLN D 233 ? 0.7514 1.0399 1.0947 0.3719 -0.1255 -0.2116 236 GLN D OE1 5967 N NE2 . GLN D 233 ? 0.7322 1.0990 1.1075 0.3586 -0.1042 -0.2551 236 GLN D NE2 5968 N N . ILE D 234 ? 0.8890 0.7742 1.0840 0.2443 -0.0776 -0.2241 237 ILE D N 5969 C CA . ILE D 234 ? 0.8518 0.7327 1.0480 0.2091 -0.0891 -0.2067 237 ILE D CA 5970 C C . ILE D 234 ? 0.8266 0.7511 1.0374 0.2452 -0.1111 -0.1732 237 ILE D C 5971 O O . ILE D 234 ? 0.9032 0.7737 1.0774 0.2953 -0.1079 -0.1565 237 ILE D O 5972 C CB . ILE D 234 ? 0.9487 0.6992 1.0816 0.1829 -0.0630 -0.2140 237 ILE D CB 5973 C CG1 . ILE D 234 ? 0.9818 0.7070 1.1001 0.1348 -0.0387 -0.2569 237 ILE D CG1 5974 C CG2 . ILE D 234 ? 0.9146 0.6695 1.0509 0.1480 -0.0733 -0.1977 237 ILE D CG2 5975 N N . VAL D 235 ? 0.7332 0.7530 0.9879 0.2217 -0.1310 -0.1647 238 VAL D N 5976 C CA . VAL D 235 ? 0.7069 0.7844 0.9766 0.2406 -0.1501 -0.1408 238 VAL D CA 5977 C C . VAL D 235 ? 0.6951 0.7383 0.9500 0.2072 -0.1557 -0.1235 238 VAL D C 5978 O O . VAL D 235 ? 0.6540 0.6987 0.9167 0.1635 -0.1532 -0.1308 238 VAL D O 5979 C CB . VAL D 235 ? 0.6333 0.8323 0.9492 0.2298 -0.1597 -0.1475 238 VAL D CB 5980 C CG1 . VAL D 235 ? 0.6221 0.8993 0.9530 0.2522 -0.1755 -0.1340 238 VAL D CG1 5981 C CG2 . VAL D 235 ? 0.6368 0.8700 0.9683 0.2472 -0.1492 -0.1708 238 VAL D CG2 5982 N N . SER D 236 ? 0.7391 0.7566 0.9687 0.2342 -0.1633 -0.1009 239 SER D N 5983 C CA . SER D 236 ? 0.7433 0.7154 0.9491 0.2064 -0.1654 -0.0841 239 SER D CA 5984 C C . SER D 236 ? 0.7200 0.7613 0.9355 0.2173 -0.1860 -0.0641 239 SER D C 5985 O O . SER D 236 ? 0.7452 0.8373 0.9617 0.2662 -0.1980 -0.0568 239 SER D O 5986 C CB . SER D 236 ? 0.8526 0.6904 0.9909 0.2197 -0.1463 -0.0768 239 SER D CB 5987 O OG . SER D 236 ? 0.8890 0.6610 1.0111 0.1953 -0.1215 -0.1029 239 SER D OG 5988 N N . ALA D 237 ? 0.6784 0.7300 0.8995 0.1728 -0.1892 -0.0586 240 ALA D N 5989 C CA . ALA D 237 ? 0.6703 0.7682 0.8874 0.1704 -0.2042 -0.0421 240 ALA D CA 5990 C C . ALA D 237 ? 0.7154 0.7240 0.8870 0.1581 -0.1992 -0.0249 240 ALA D C 5991 O O . ALA D 237 ? 0.7172 0.6595 0.8780 0.1267 -0.1830 -0.0324 240 ALA D O 5992 C CB . ALA D 237 ? 0.5997 0.7718 0.8470 0.1254 -0.2051 -0.0518 240 ALA D CB 5993 N N . GLU D 238 ? 0.7554 0.7733 0.8989 0.1820 -0.2123 -0.0047 241 GLU D N 5994 C CA . GLU D 238 ? 0.8161 0.7402 0.9037 0.1735 -0.2050 0.0136 241 GLU D CA 5995 C C . GLU D 238 ? 0.8034 0.7775 0.8829 0.1585 -0.2199 0.0270 241 GLU D C 5996 O O . GLU D 238 ? 0.7857 0.8645 0.8844 0.1773 -0.2400 0.0274 241 GLU D O 5997 C CB . GLU D 238 ? 0.9369 0.7549 0.9550 0.2280 -0.1956 0.0302 241 GLU D CB 5998 C CG . GLU D 238 ? 0.9705 0.8406 0.9894 0.3031 -0.2102 0.0350 241 GLU D CG 5999 C CD . GLU D 238 ? 1.1153 0.8458 1.0439 0.3646 -0.1926 0.0532 241 GLU D CD 6000 N N . ALA D 239 ? 0.8166 0.7252 0.8687 0.1193 -0.2076 0.0326 242 ALA D N 6001 C CA . ALA D 239 ? 0.8212 0.7536 0.8522 0.1010 -0.2166 0.0451 242 ALA D CA 6002 C C . ALA D 239 ? 0.9085 0.7254 0.8694 0.0972 -0.2022 0.0634 242 ALA D C 6003 O O . ALA D 239 ? 0.9586 0.6764 0.8916 0.0916 -0.1791 0.0600 242 ALA D O 6004 C CB . ALA D 239 ? 0.7411 0.7218 0.8100 0.0453 -0.2108 0.0285 242 ALA D CB 6005 N N . TRP D 240 ? 0.9380 0.7683 0.8645 0.0940 -0.2123 0.0793 243 TRP D N 6006 C CA . TRP D 240 ? 1.0319 0.7518 0.8809 0.0878 -0.1968 0.0983 243 TRP D CA 6007 C C . TRP D 240 ? 0.9994 0.7405 0.8492 0.0351 -0.1932 0.0951 243 TRP D C 6008 O O . TRP D 240 ? 0.9381 0.7790 0.8245 0.0196 -0.2091 0.0868 243 TRP D O 6009 C CB . TRP D 240 ? 1.1426 0.8329 0.9163 0.1573 -0.2119 0.1295 243 TRP D CB 6010 C CG . TRP D 240 ? 1.2252 0.8390 0.9630 0.2150 -0.2033 0.1376 243 TRP D CG 6011 C CD1 . TRP D 240 ? 1.1868 0.8704 0.9754 0.2534 -0.2159 0.1261 243 TRP D CD1 6012 C CD2 . TRP D 240 ? 1.3823 0.8210 1.0128 0.2400 -0.1740 0.1574 243 TRP D CD2 6013 N NE1 . TRP D 240 ? 1.3064 0.8706 1.0290 0.3052 -0.1977 0.1376 243 TRP D NE1 6014 C CE2 . TRP D 240 ? 1.4339 0.8377 1.0528 0.2971 -0.1697 0.1571 243 TRP D CE2 6015 C CE3 . TRP D 240 ? 1.4992 0.7967 1.0324 0.2158 -0.1453 0.1737 243 TRP D CE3 6016 C CZ2 . TRP D 240 ? 1.6063 0.8247 1.1117 0.3315 -0.1350 0.1728 243 TRP D CZ2 6017 C CZ3 . TRP D 240 ? 1.6699 0.7831 1.0882 0.2447 -0.1095 0.1891 243 TRP D CZ3 6018 C CH2 . TRP D 240 ? 1.7284 0.7969 1.1298 0.3026 -0.1034 0.1888 243 TRP D CH2 6019 N N . GLY D 241 ? 1.0527 0.6961 0.8560 0.0032 -0.1672 0.0979 244 GLY D N 6020 C CA . GLY D 241 ? 1.0392 0.6895 0.8333 -0.0434 -0.1590 0.0948 244 GLY D CA 6021 C C . GLY D 241 ? 1.0853 0.7644 0.8306 -0.0251 -0.1798 0.1171 244 GLY D C 6022 O O . GLY D 241 ? 1.1715 0.8222 0.8581 0.0281 -0.1934 0.1424 244 GLY D O 6023 N N . ARG D 242 ? 1.0407 0.7758 0.8027 -0.0654 -0.1811 0.1066 245 ARG D N 6024 C CA . ARG D 242 ? 1.0781 0.8652 0.8000 -0.0584 -0.2017 0.1196 245 ARG D CA 6025 C C . ARG D 242 ? 1.1160 0.8508 0.7897 -0.1026 -0.1823 0.1218 245 ARG D C 6026 O O . ARG D 242 ? 1.0727 0.7876 0.7751 -0.1489 -0.1572 0.1018 245 ARG D O 6027 C CB . ARG D 242 ? 1.0023 0.9226 0.7814 -0.0718 -0.2205 0.0987 245 ARG D CB 6028 C CG . ARG D 242 ? 0.9557 0.8901 0.7578 -0.1358 -0.1999 0.0741 245 ARG D CG 6029 C CD . ARG D 242 ? 0.9017 0.8942 0.7648 -0.1512 -0.1961 0.0495 245 ARG D CD 6030 N NE . ARG D 242 ? 0.9016 1.0028 0.7861 -0.1299 -0.2218 0.0439 245 ARG D NE 6031 C CZ . ARG D 242 ? 0.8596 1.0192 0.7892 -0.1431 -0.2185 0.0221 245 ARG D CZ 6032 N NH1 . ARG D 242 ? 0.8234 0.9305 0.7723 -0.1695 -0.1920 0.0090 245 ARG D NH1 6033 N NH2 . ARG D 242 ? 0.8621 1.1380 0.8126 -0.1268 -0.2406 0.0125 245 ARG D NH2 6034 N N . ALA D 243 ? 1.2044 0.9224 0.8012 -0.0819 -0.1942 0.1460 246 ALA D N 6035 C CA . ALA D 243 ? 1.2516 0.9226 0.7932 -0.1228 -0.1765 0.1491 246 ALA D CA 6036 C C . ALA D 243 ? 1.1982 0.9707 0.7657 -0.1629 -0.1854 0.1283 246 ALA D C 6037 O O . ALA D 243 ? 1.1204 0.9191 0.7461 -0.2032 -0.1694 0.1007 246 ALA D O 6038 C CB . ALA D 243 ? 1.3891 0.9848 0.8193 -0.0820 -0.1824 0.1860 246 ALA D CB 6039 C C1 . NAG E . ? 0.7837 2.1189 1.2930 -0.0588 -0.1286 0.0936 400 NAG A C1 6040 C C2 . NAG E . ? 0.7915 2.3086 1.3969 -0.0871 -0.1311 0.1338 400 NAG A C2 6041 C C3 . NAG E . ? 0.7817 2.3704 1.4280 -0.0762 -0.0897 0.1688 400 NAG A C3 6042 C C4 . NAG E . ? 0.7865 2.2453 1.3953 -0.1098 -0.0673 0.1597 400 NAG A C4 6043 C C5 . NAG E . ? 0.7839 2.0622 1.3034 -0.0981 -0.0778 0.1137 400 NAG A C5 6044 C C6 . NAG E . ? 0.7746 1.9486 1.2438 -0.0702 -0.0460 0.1056 400 NAG A C6 6045 C C7 . NAG E . ? 0.8377 2.4139 1.4959 -0.2034 -0.2030 0.1258 400 NAG A C7 6046 C C8 . NAG E . ? 0.8758 2.4423 1.5618 -0.3045 -0.2356 0.1226 400 NAG A C8 6047 N N2 . NAG E . ? 0.8166 2.3428 1.4580 -0.1806 -0.1619 0.1331 400 NAG A N2 6048 O O3 . NAG E . ? 0.7723 2.4068 1.4000 0.0197 -0.0670 0.1766 400 NAG A O3 6049 O O4 . NAG E . ? 0.8098 2.2887 1.4673 -0.2030 -0.0772 0.1759 400 NAG A O4 6050 O O5 . NAG E . ? 0.7769 2.0464 1.2599 -0.0379 -0.0931 0.0950 400 NAG A O5 6051 O O6 . NAG E . ? 0.7595 1.9528 1.2021 0.0158 -0.0275 0.1072 400 NAG A O6 6052 O O7 . NAG E . ? 0.8354 2.4570 1.4815 -0.1458 -0.2170 0.1211 400 NAG A O7 6053 C C1 . NAG F . ? 0.8168 2.3012 1.4939 -0.2247 -0.0421 0.2048 401 NAG A C1 6054 C C2 . NAG F . ? 0.8172 2.4954 1.5880 -0.2324 -0.0244 0.2584 401 NAG A C2 6055 C C3 . NAG F . ? 0.8373 2.5114 1.6239 -0.2643 0.0123 0.2919 401 NAG A C3 6056 C C4 . NAG F . ? 0.8301 2.3726 1.5331 -0.2049 0.0428 0.2723 401 NAG A C4 6057 C C5 . NAG F . ? 0.8241 2.1912 1.4450 -0.1985 0.0178 0.2168 401 NAG A C5 6058 C C6 . NAG F . ? 0.8163 2.0685 1.3613 -0.1374 0.0431 0.1971 401 NAG A C6 6059 N N2 . NAG F . ? 0.8304 2.6103 1.6724 -0.3010 -0.0609 0.2715 401 NAG A N2 6060 O O3 . NAG F . ? 0.8350 2.6965 1.7019 -0.2517 0.0378 0.3441 401 NAG A O3 6061 O O4 . NAG F . ? 0.8597 2.3710 1.5668 -0.2468 0.0694 0.2990 401 NAG A O4 6062 O O5 . NAG F . ? 0.8033 2.1977 1.4189 -0.1651 -0.0100 0.1941 401 NAG A O5 6063 O O6 . NAG F . ? 0.8216 1.9155 1.3071 -0.1620 0.0245 0.1573 401 NAG A O6 6064 C C1 . NAG G . ? 0.9823 1.1560 1.0644 -0.3232 -0.1020 -0.0992 314 NAG A C1 6065 C C2 . NAG G . ? 0.9890 1.2581 1.1333 -0.3655 -0.1099 -0.0676 314 NAG A C2 6066 C C3 . NAG G . ? 1.0248 1.3320 1.1823 -0.4113 -0.1474 -0.0735 314 NAG A C3 6067 C C4 . NAG G . ? 1.0986 1.2854 1.1878 -0.4396 -0.1698 -0.1071 314 NAG A C4 6068 C C5 . NAG G . ? 1.0759 1.1859 1.1060 -0.3847 -0.1551 -0.1349 314 NAG A C5 6069 C C6 . NAG G . ? 1.1561 1.1461 1.1111 -0.4024 -0.1711 -0.1674 314 NAG A C6 6070 C C7 . NAG G . ? 0.9120 1.3512 1.1468 -0.3271 -0.0712 -0.0104 314 NAG A C7 6071 C C8 . NAG G . ? 0.9709 1.3662 1.2079 -0.3803 -0.0651 0.0070 314 NAG A C8 6072 N N2 . NAG G . ? 0.9226 1.2992 1.1153 -0.3250 -0.0921 -0.0434 314 NAG A N2 6073 O O3 . NAG G . ? 1.0480 1.4322 1.2646 -0.4628 -0.1546 -0.0424 314 NAG A O3 6074 O O4 . NAG G . ? 1.1323 1.3557 1.2276 -0.4766 -0.2085 -0.1156 314 NAG A O4 6075 O O5 . NAG G . ? 1.0447 1.1269 1.0733 -0.3502 -0.1215 -0.1263 314 NAG A O5 6076 O O6 . NAG G . ? 1.1946 1.0903 1.1169 -0.4058 -0.1536 -0.1696 314 NAG A O6 6077 O O7 . NAG G . ? 0.8644 1.3912 1.1304 -0.2844 -0.0563 0.0069 314 NAG A O7 6078 C C1 . NAG H . ? 1.1344 1.6547 1.2021 -0.0407 0.3411 0.0905 501 NAG A C1 6079 C C2 . NAG H . ? 1.2065 1.7409 1.2126 -0.0234 0.3810 0.1136 501 NAG A C2 6080 C C3 . NAG H . ? 1.2396 1.7356 1.2306 -0.0716 0.3720 0.1452 501 NAG A C3 6081 C C4 . NAG H . ? 1.2189 1.7396 1.2955 -0.1352 0.3502 0.1760 501 NAG A C4 6082 C C5 . NAG H . ? 1.1534 1.6789 1.2942 -0.1411 0.3157 0.1481 501 NAG A C5 6083 C C6 . NAG H . ? 1.1432 1.7198 1.3770 -0.1992 0.2987 0.1793 501 NAG A C6 6084 C C7 . NAG H . ? 1.2671 1.7631 1.1419 0.0825 0.4153 0.0621 501 NAG A C7 6085 C C8 . NAG H . ? 1.3137 1.7169 1.0784 0.1236 0.4095 0.0220 501 NAG A C8 6086 N N2 . NAG H . ? 1.2384 1.7051 1.1466 0.0263 0.3855 0.0772 501 NAG A N2 6087 O O3 . NAG H . ? 1.3083 1.8434 1.2571 -0.0566 0.4159 0.1766 501 NAG A O3 6088 O O4 . NAG H . ? 1.2452 1.6715 1.2778 -0.1663 0.3227 0.1811 501 NAG A O4 6089 O O5 . NAG H . ? 1.1253 1.7067 1.2797 -0.0920 0.3340 0.1261 501 NAG A O5 6090 O O6 . NAG H . ? 1.0930 1.6544 1.3669 -0.2003 0.2610 0.1483 501 NAG A O6 6091 O O7 . NAG H . ? 1.2624 1.8545 1.1901 0.1021 0.4443 0.0787 501 NAG A O7 6092 C C1 . NAG I . ? 1.3091 1.7390 1.3381 -0.2073 0.3368 0.2317 502 NAG A C1 6093 C C2 . NAG I . ? 1.3622 1.8837 1.3885 -0.1972 0.3938 0.2746 502 NAG A C2 6094 C C3 . NAG I . ? 1.4332 1.9363 1.4484 -0.2465 0.4022 0.3287 502 NAG A C3 6095 C C4 . NAG I . ? 1.4296 1.9011 1.5093 -0.3153 0.3626 0.3468 502 NAG A C4 6096 C C5 . NAG I . ? 1.3788 1.7564 1.4472 -0.3085 0.3076 0.2943 502 NAG A C5 6097 C C6 . NAG I . ? 1.3865 1.7231 1.5079 -0.3696 0.2649 0.3059 502 NAG A C6 6098 N N2 . NAG I . ? 1.3872 1.8939 1.3246 -0.1358 0.4198 0.2525 502 NAG A N2 6099 O O3 . NAG I . ? 1.4775 2.0864 1.5122 -0.2455 0.4568 0.3762 502 NAG A O3 6100 O O4 . NAG I . ? 1.5092 1.9275 1.5519 -0.3547 0.3651 0.3910 502 NAG A O4 6101 O O5 . NAG I . ? 1.3091 1.7330 1.4045 -0.2670 0.3081 0.2532 502 NAG A O5 6102 C C1 . DB6 J . ? 1.3732 1.0655 0.7672 -0.0537 -0.0558 -0.2962 650 DB6 A C1 6103 C C2 . DB6 J . ? 1.2731 1.0214 0.7482 -0.0529 -0.0399 -0.2683 650 DB6 A C2 6104 N N2 . DB6 J . ? 1.2694 1.0173 0.7454 -0.0280 -0.0021 -0.2597 650 DB6 A N2 6105 C C3 . DB6 J . ? 1.2440 1.0342 0.7310 -0.0540 -0.0517 -0.2480 650 DB6 A C3 6106 O O3 . DB6 J . ? 1.2422 1.0502 0.7421 -0.0755 -0.0881 -0.2538 650 DB6 A O3 6107 C C4 . DB6 J . ? 1.1683 0.9950 0.7157 -0.0485 -0.0358 -0.2218 650 DB6 A C4 6108 O O4 . DB6 J . ? 1.1807 1.0274 0.7178 -0.0445 -0.0475 -0.2044 650 DB6 A O4 6109 C C5 . DB6 J . ? 1.0912 0.9382 0.7052 -0.0607 -0.0437 -0.2204 650 DB6 A C5 6110 C C6 . DB6 J . ? 1.0250 0.9018 0.6846 -0.0547 -0.0407 -0.1978 650 DB6 A C6 6111 C C7 . DB6 J . ? 0.9822 0.8575 0.6751 -0.0482 -0.0155 -0.1907 650 DB6 A C7 6112 C C8 . DB6 J . ? 0.9495 0.8380 0.6684 -0.0442 -0.0151 -0.1690 650 DB6 A C8 6113 C C9 . DB6 J . ? 0.8916 0.7921 0.6615 -0.0439 -0.0212 -0.1680 650 DB6 A C9 6114 C C10 . DB6 J . ? 0.8784 0.7760 0.6614 -0.0391 -0.0263 -0.1499 650 DB6 A C10 6115 C C11 . DB6 J . ? 0.8637 0.7713 0.6523 -0.0294 -0.0494 -0.1478 650 DB6 A C11 6116 C C12 . DB6 J . ? 0.8776 0.7630 0.6609 -0.0202 -0.0570 -0.1315 650 DB6 A C12 6117 C C13 . DB6 J . ? 0.9097 0.7946 0.6608 -0.0062 -0.0750 -0.1231 650 DB6 A C13 6118 C C14 . DB6 J . ? 0.9388 0.7866 0.6766 0.0078 -0.0857 -0.1083 650 DB6 A C14 6119 C C15 . DB6 J . ? 0.9285 0.7905 0.6758 0.0346 -0.1037 -0.1121 650 DB6 A C15 6120 C C16 . DB6 J . ? 0.9656 0.8350 0.6791 0.0580 -0.1208 -0.1029 650 DB6 A C16 6121 C C17 . DB6 J . ? 0.9361 0.8645 0.6736 0.0794 -0.1326 -0.1092 650 DB6 A C17 6122 C C18 . DB6 J . ? 0.9225 0.9061 0.6671 0.0656 -0.1371 -0.1142 650 DB6 A C18 6123 C C1A . DB6 J . ? 1.5122 1.1652 0.7653 -0.0145 -0.0446 -0.3069 650 DB6 A C1A 6124 O O1A . DB6 J . ? 1.4273 1.1204 0.7629 -0.0438 -0.0643 -0.2958 650 DB6 A O1A 6125 C C2A . DB6 J . ? 1.5449 1.2168 0.7549 0.0075 -0.0299 -0.2899 650 DB6 A C2A 6126 O O2A . DB6 J . ? 1.4893 1.2113 0.7478 -0.0047 -0.0407 -0.2637 650 DB6 A O2A 6127 C C3A . DB6 J . ? 1.5417 1.2244 0.7521 0.0370 0.0191 -0.2746 650 DB6 A C3A 6128 O O3A . DB6 J . ? 1.6160 1.2945 0.7512 0.0627 0.0347 -0.2673 650 DB6 A O3A 6129 C C4A . DB6 J . ? 1.5723 1.2180 0.7694 0.0540 0.0376 -0.2952 650 DB6 A C4A 6130 O O4A . DB6 J . ? 1.5099 1.2024 0.7713 0.0650 0.0747 -0.2708 650 DB6 A O4A 6131 O O5A . DB6 J . ? 1.6137 1.1622 0.8089 0.0728 0.0493 -0.3399 650 DB6 A O5A 6132 C C5M . DB6 J . ? 1.5692 1.1723 0.7824 0.0312 0.0095 -0.3206 650 DB6 A C5M 6133 C C6A . DB6 J . ? 1.6586 1.1908 0.8016 0.0575 0.0196 -0.3491 650 DB6 A C6A 6134 O O6A . DB6 J . ? 1.5792 1.1693 0.7824 -0.0009 -0.0356 -0.3331 650 DB6 A O6A 6135 C CAA . DB6 J . ? 1.2519 0.9905 0.7563 -0.0217 0.0142 -0.2638 650 DB6 A CAA 6136 O OAA . DB6 J . ? 1.2355 0.9571 0.7615 -0.0363 0.0007 -0.2739 650 DB6 A OAA 6137 C CAB . DB6 J . ? 1.2547 1.0108 0.7648 0.0050 0.0517 -0.2521 650 DB6 A CAB 6138 C CAC . DB6 J . ? 1.2086 0.9817 0.7808 0.0079 0.0637 -0.2467 650 DB6 A CAC 6139 C CAD . DB6 J . ? 1.1386 0.9587 0.7814 -0.0076 0.0579 -0.2244 650 DB6 A CAD 6140 C CAE . DB6 J . ? 1.0959 0.9369 0.7935 -0.0002 0.0710 -0.2184 650 DB6 A CAE 6141 C CAF . DB6 J . ? 1.0391 0.9026 0.7931 -0.0162 0.0538 -0.2077 650 DB6 A CAF 6142 C CAG . DB6 J . ? 1.0204 0.8732 0.7998 -0.0134 0.0505 -0.2165 650 DB6 A CAG 6143 C CAH . DB6 J . ? 0.9615 0.8434 0.7963 -0.0170 0.0429 -0.2043 650 DB6 A CAH 6144 C CAI . DB6 J . ? 0.9463 0.8229 0.8020 -0.0051 0.0480 -0.2096 650 DB6 A CAI 6145 C CAJ . DB6 J . ? 0.9119 0.7950 0.7968 -0.0112 0.0317 -0.2060 650 DB6 A CAJ 6146 C CAK . DB6 J . ? 0.9139 0.7808 0.8038 0.0006 0.0368 -0.2112 650 DB6 A CAK 6147 C CAL . DB6 J . ? 0.9414 0.7747 0.8082 -0.0069 0.0334 -0.2180 650 DB6 A CAL 6148 C CAM . DB6 J . ? 0.9534 0.7607 0.8180 0.0055 0.0394 -0.2196 650 DB6 A CAM 6149 C CAN . DB6 J . ? 1.0078 0.7693 0.8302 0.0194 0.0522 -0.2318 650 DB6 A CAN 6150 C CAO . DB6 J . ? 1.0147 0.7767 0.8400 0.0489 0.0659 -0.2323 650 DB6 A CAO 6151 C CAP . DB6 J . ? 1.0901 0.8034 0.8654 0.0726 0.0801 -0.2451 650 DB6 A CAP 6152 C CAQ . DB6 J . ? 1.0858 0.8245 0.8781 0.1116 0.0954 -0.2416 650 DB6 A CAQ 6153 C CAR . DB6 J . ? 1.0592 0.8656 0.8811 0.1219 0.1075 -0.2358 650 DB6 A CAR 6154 C CAS . DB6 J . ? 1.1047 0.9166 0.9071 0.1653 0.1296 -0.2397 650 DB6 A CAS 6155 C CAT . DB6 J . ? 1.0920 0.9663 0.9113 0.1697 0.1459 -0.2322 650 DB6 A CAT 6156 O O . HOH K . ? 0.6736 1.1727 1.0181 -0.1622 0.1554 0.0426 303 HOH A O 6157 O O . HOH K . ? 0.7558 0.6716 0.6133 0.1565 -0.1059 -0.1625 304 HOH A O 6158 O O . HOH K . ? 0.9280 0.7067 0.4787 -0.2004 -0.0791 0.0383 305 HOH A O 6159 O O . HOH K . ? 1.0913 0.6452 0.8408 0.0255 -0.1230 0.2864 306 HOH A O 6160 O O . HOH K . ? 0.6209 0.3372 0.4589 -0.0594 -0.0561 0.0262 307 HOH A O 6161 O O . HOH K . ? 1.2491 0.8445 0.6532 -0.2709 -0.0742 -0.0521 308 HOH A O 6162 O O . HOH K . ? 0.9334 0.5815 0.5944 0.0437 0.0851 -0.1246 309 HOH A O 6163 O O . HOH K . ? 0.9926 0.5871 0.6050 0.1108 0.1244 -0.1802 310 HOH A O 6164 O O . HOH K . ? 1.2244 1.1885 0.9653 0.5568 0.2552 -0.2354 311 HOH A O 6165 O O . HOH K . ? 0.7777 0.9931 1.2276 0.5081 -0.1011 0.0774 312 HOH A O 6166 O O . HOH L . ? 1.0864 0.7832 0.9918 -0.4104 0.0971 -0.2832 100 HOH B O 6167 O O . HOH L . ? 0.9732 0.5027 0.6566 -0.2984 0.1156 0.1930 101 HOH B O 6168 O O . HOH L . ? 0.8083 0.6459 0.5632 -0.0954 0.0937 0.0068 102 HOH B O 6169 O O . HOH M . ? 0.9232 0.4182 0.7437 -0.0912 0.0731 0.0853 211 HOH C O 6170 O O . HOH M . ? 1.0974 0.7828 0.5284 -0.3059 -0.1244 -0.2722 212 HOH C O 6171 O O . HOH M . ? 1.0411 0.8043 0.8099 -0.3026 0.1736 -0.1690 213 HOH C O 6172 O O . HOH M . ? 0.8200 0.6438 0.9238 -0.3164 0.0588 0.1001 214 HOH C O 6173 O O . HOH N . ? 0.7892 1.1174 0.8796 0.1763 -0.1404 -0.2012 248 HOH D O 6174 O O . HOH N . ? 0.5138 0.3371 0.9657 0.2796 -0.0047 0.0599 249 HOH D O 6175 O O . HOH N . ? 1.7321 0.1609 0.8175 -0.0828 0.1559 0.0967 250 HOH D O 6176 O O . HOH N . ? 0.5272 0.8831 0.7391 -0.0912 0.1438 -0.2683 251 HOH D O 6177 O O . HOH N . ? 0.8074 0.9458 0.5243 0.1727 -0.0122 -0.1755 252 HOH D O # 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 ? ? ? 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 ? ? ? A . n A 1 109 GLY 109 109 ? ? ? 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 ? ? ? 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 296 296 296 ARG ARG A . n A 1 297 HIS 297 297 297 HIS HIS A . n A 1 298 HIS 298 298 298 HIS HIS A . n A 1 299 HIS 299 299 299 HIS HIS A . n A 1 300 HIS 300 300 300 HIS HIS A . n A 1 301 HIS 301 301 ? ? ? A . n A 1 302 HIS 302 302 ? ? ? A . n B 2 1 ILE 1 1 ? ? ? B . n B 2 2 GLN 2 2 2 GLN GLN B . n B 2 3 LYS 3 3 3 LYS LYS B . n B 2 4 THR 4 4 4 THR THR B . n B 2 5 PRO 5 5 5 PRO PRO B . n B 2 6 GLN 6 6 6 GLN GLN B . n B 2 7 ILE 7 7 7 ILE ILE B . n B 2 8 GLN 8 8 8 GLN GLN B . n B 2 9 VAL 9 9 9 VAL VAL B . n B 2 10 TYR 10 10 10 TYR TYR B . n B 2 11 SER 11 11 11 SER SER B . n B 2 12 ARG 12 12 12 ARG ARG B . n B 2 13 HIS 13 13 13 HIS HIS B . n B 2 14 PRO 14 14 14 PRO PRO B . n B 2 15 PRO 15 15 15 PRO PRO B . n B 2 16 GLU 16 16 16 GLU GLU B . n B 2 17 ASN 17 17 17 ASN ASN B . n B 2 18 GLY 18 18 18 GLY GLY B . n B 2 19 LYS 19 19 19 LYS LYS B . n B 2 20 PRO 20 20 20 PRO PRO B . n B 2 21 ASN 21 21 21 ASN ASN B . n B 2 22 ILE 22 22 22 ILE ILE B . n B 2 23 LEU 23 23 23 LEU LEU B . n B 2 24 ASN 24 24 24 ASN ASN B . n B 2 25 CYS 25 25 25 CYS CYS B . n B 2 26 TYR 26 26 26 TYR TYR B . n B 2 27 VAL 27 27 27 VAL VAL B . n B 2 28 THR 28 28 28 THR THR B . n B 2 29 GLN 29 29 29 GLN GLN B . n B 2 30 PHE 30 30 30 PHE PHE B . n B 2 31 HIS 31 31 31 HIS HIS B . n B 2 32 PRO 32 32 32 PRO PRO B . n B 2 33 PRO 33 33 33 PRO PRO B . n B 2 34 HIS 34 34 34 HIS HIS B . n B 2 35 ILE 35 35 35 ILE ILE B . n B 2 36 GLU 36 36 36 GLU GLU B . n B 2 37 ILE 37 37 37 ILE ILE B . n B 2 38 GLN 38 38 38 GLN GLN B . n B 2 39 MET 39 39 39 MET MET B . n B 2 40 LEU 40 40 40 LEU LEU B . n B 2 41 LYS 41 41 41 LYS LYS B . n B 2 42 ASN 42 42 42 ASN ASN B . n B 2 43 GLY 43 43 43 GLY GLY B . n B 2 44 LYS 44 44 44 LYS LYS B . n B 2 45 LYS 45 45 45 LYS LYS B . n B 2 46 ILE 46 46 46 ILE ILE B . n B 2 47 PRO 47 47 47 PRO PRO B . n B 2 48 LYS 48 48 48 LYS LYS B . n B 2 49 VAL 49 49 49 VAL VAL B . n B 2 50 GLU 50 50 50 GLU GLU B . n B 2 51 MET 51 51 51 MET MET B . n B 2 52 SER 52 52 52 SER SER B . n B 2 53 ASP 53 53 53 ASP ASP B . n B 2 54 MET 54 54 54 MET MET B . n B 2 55 SER 55 55 55 SER SER B . n B 2 56 PHE 56 56 56 PHE PHE B . n B 2 57 SER 57 57 57 SER SER B . n B 2 58 LYS 58 58 58 LYS LYS B . n B 2 59 ASP 59 59 59 ASP ASP B . n B 2 60 TRP 60 60 60 TRP TRP B . n B 2 61 SER 61 61 61 SER SER B . n B 2 62 PHE 62 62 62 PHE PHE B . n B 2 63 TYR 63 63 63 TYR TYR B . n B 2 64 ILE 64 64 64 ILE ILE B . n B 2 65 LEU 65 65 65 LEU LEU B . n B 2 66 ALA 66 66 66 ALA ALA B . n B 2 67 HIS 67 67 67 HIS HIS B . n B 2 68 THR 68 68 68 THR THR B . n B 2 69 GLU 69 69 69 GLU GLU B . n B 2 70 PHE 70 70 70 PHE PHE B . n B 2 71 THR 71 71 71 THR THR B . n B 2 72 PRO 72 72 72 PRO PRO B . n B 2 73 THR 73 73 73 THR THR B . n B 2 74 GLU 74 74 74 GLU GLU B . n B 2 75 THR 75 75 75 THR THR B . n B 2 76 ASP 76 76 76 ASP ASP B . n B 2 77 THR 77 77 77 THR THR B . n B 2 78 TYR 78 78 78 TYR TYR B . n B 2 79 ALA 79 79 79 ALA ALA B . n B 2 80 CYS 80 80 80 CYS CYS B . n B 2 81 ARG 81 81 81 ARG ARG B . n B 2 82 VAL 82 82 82 VAL VAL B . n B 2 83 LYS 83 83 83 LYS LYS B . n B 2 84 HIS 84 84 84 HIS HIS B . n B 2 85 ALA 85 85 85 ALA ALA B . n B 2 86 SER 86 86 86 SER SER B . n B 2 87 MET 87 87 87 MET MET B . n B 2 88 ALA 88 88 88 ALA ALA B . n B 2 89 GLU 89 89 89 GLU GLU B . n B 2 90 PRO 90 90 90 PRO PRO B . n B 2 91 LYS 91 91 91 LYS LYS B . n B 2 92 THR 92 92 92 THR THR B . n B 2 93 VAL 93 93 93 VAL VAL B . n B 2 94 TYR 94 94 94 TYR TYR B . n B 2 95 TRP 95 95 95 TRP TRP B . n B 2 96 ASP 96 96 96 ASP ASP B . n B 2 97 ARG 97 97 97 ARG ARG B . n B 2 98 ASP 98 98 98 ASP ASP B . n B 2 99 MET 99 99 99 MET MET B . n C 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 ? ? ? 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 101 104 104 LEU LEU C . n C 3 102 HIS 102 105 105 HIS HIS C . n C 3 103 PHE 103 106 106 PHE PHE C . n C 3 104 GLY 104 107 107 GLY GLY C . n C 3 105 ALA 105 108 108 ALA ALA C . n C 3 106 GLY 106 109 109 GLY GLY C . n C 3 107 THR 107 110 110 THR THR C . n C 3 108 GLN 108 111 111 GLN GLN C . n C 3 109 LEU 109 112 112 LEU LEU C . n C 3 110 ILE 110 113 113 ILE ILE C . n C 3 111 VAL 111 114 114 VAL VAL C . n C 3 112 ILE 112 115 115 ILE ILE C . n C 3 113 PRO 113 116 116 PRO PRO C . n C 3 114 ASP 114 117 117 ASP ASP C . n C 3 115 ILE 115 118 118 ILE ILE C . n C 3 116 GLN 116 119 119 GLN GLN C . n C 3 117 ASN 117 120 120 ASN ASN C . n C 3 118 PRO 118 121 121 PRO PRO C . n C 3 119 ASP 119 122 122 ASP ASP C . n C 3 120 PRO 120 123 123 PRO PRO C . n C 3 121 ALA 121 124 124 ALA ALA C . n C 3 122 VAL 122 125 125 VAL VAL C . n C 3 123 TYR 123 126 126 TYR TYR C . n C 3 124 GLN 124 127 127 GLN GLN C . n C 3 125 LEU 125 128 128 LEU LEU C . n C 3 126 ARG 126 129 129 ARG ARG C . n C 3 127 ASP 127 130 130 ASP ASP C . n C 3 128 SER 128 131 131 SER SER C . n C 3 129 LYS 129 132 132 LYS LYS C . n C 3 130 SER 130 133 133 SER SER C . n C 3 131 SER 131 134 134 SER SER C . n C 3 132 ASP 132 135 135 ASP ASP C . n C 3 133 LYS 133 136 136 LYS LYS C . n C 3 134 SER 134 137 137 SER SER C . n C 3 135 VAL 135 138 138 VAL VAL C . n C 3 136 CYS 136 139 139 CYS CYS C . n C 3 137 LEU 137 140 140 LEU LEU C . n C 3 138 PHE 138 141 141 PHE PHE C . n C 3 139 THR 139 142 142 THR THR C . n C 3 140 ASP 140 143 143 ASP ASP C . n C 3 141 PHE 141 144 144 PHE PHE C . n C 3 142 ASP 142 145 145 ASP ASP C . n C 3 143 SER 143 146 146 SER SER C . n C 3 144 GLN 144 147 147 GLN GLN C . n C 3 145 THR 145 148 148 THR THR C . n C 3 146 ASN 146 149 149 ASN ASN C . n C 3 147 VAL 147 150 150 VAL VAL C . n C 3 148 SER 148 151 151 SER SER C . n C 3 149 GLN 149 152 152 GLN GLN C . n C 3 150 SER 150 153 153 SER SER C . n C 3 151 LYS 151 154 154 LYS LYS C . n C 3 152 ASP 152 155 155 ASP ASP C . n C 3 153 SER 153 156 156 SER SER C . n C 3 154 ASP 154 157 157 ASP ASP C . n C 3 155 VAL 155 158 158 VAL VAL C . n C 3 156 TYR 156 159 159 TYR TYR C . n C 3 157 ILE 157 160 160 ILE ILE C . n C 3 158 THR 158 161 161 THR THR C . n C 3 159 ASP 159 162 162 ASP ASP C . n C 3 160 LYS 160 163 163 LYS LYS C . n C 3 161 CYS 161 164 164 CYS CYS C . n C 3 162 VAL 162 165 165 VAL VAL C . n C 3 163 LEU 163 166 166 LEU LEU C . n C 3 164 ASP 164 167 167 ASP ASP C . n C 3 165 MET 165 168 168 MET MET C . n C 3 166 ARG 166 169 169 ARG ARG C . n C 3 167 SER 167 170 170 SER SER C . n C 3 168 MET 168 171 171 MET MET C . n C 3 169 ASP 169 172 172 ASP ASP C . n C 3 170 PHE 170 173 173 PHE PHE C . n C 3 171 LYS 171 174 174 LYS LYS C . n C 3 172 SER 172 175 175 SER SER C . n C 3 173 ASN 173 176 176 ASN ASN C . n C 3 174 SER 174 177 177 SER SER C . n C 3 175 ALA 175 178 178 ALA ALA C . n C 3 176 VAL 176 179 179 VAL VAL C . n C 3 177 ALA 177 180 180 ALA ALA C . n C 3 178 TRP 178 181 181 TRP TRP C . n C 3 179 SER 179 182 182 SER SER C . n C 3 180 ASN 180 183 183 ASN ASN C . n C 3 181 LYS 181 184 184 LYS LYS C . n C 3 182 SER 182 185 ? ? ? C . n C 3 183 ASP 183 186 186 ASP ASP C . n C 3 184 PHE 184 187 187 PHE PHE C . n C 3 185 ALA 185 188 188 ALA ALA C . n C 3 186 CYS 186 189 189 CYS CYS C . n C 3 187 ALA 187 190 190 ALA ALA C . n C 3 188 ASN 188 191 191 ASN ASN C . n C 3 189 ALA 189 192 192 ALA ALA C . n C 3 190 PHE 190 193 193 PHE PHE C . n C 3 191 ASN 191 194 194 ASN ASN C . n C 3 192 ASN 192 195 195 ASN ASN C . n C 3 193 SER 193 196 196 SER SER C . n C 3 194 ILE 194 197 197 ILE ILE C . n C 3 195 ILE 195 198 198 ILE ILE C . n C 3 196 PRO 196 199 199 PRO PRO C . n C 3 197 GLU 197 200 200 GLU GLU C . n C 3 198 ASP 198 201 201 ASP ASP C . n C 3 199 THR 199 202 202 THR THR C . n C 3 200 PHE 200 203 203 PHE PHE C . n C 3 201 PHE 201 204 204 PHE PHE C . n C 3 202 PRO 202 205 205 PRO PRO C . n C 3 203 SER 203 206 206 SER SER C . n C 3 204 PRO 204 207 207 PRO PRO 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 GLU 1 1 ? ? ? D . n D 4 2 ALA 2 2 ? ? ? D . n D 4 3 ALA 3 3 3 ALA ALA D . n D 4 4 VAL 4 4 4 VAL VAL D . n D 4 5 THR 5 5 5 THR THR D . n D 4 6 GLN 6 6 6 GLN GLN D . n D 4 7 SER 7 7 7 SER SER D . n D 4 8 PRO 8 8 8 PRO PRO D . n D 4 9 ARG 9 9 9 ARG ARG D . n D 4 10 ASN 10 10 10 ASN ASN D . n D 4 11 LYS 11 11 11 LYS LYS D . n D 4 12 VAL 12 12 12 VAL VAL D . n D 4 13 ALA 13 13 13 ALA ALA D . n D 4 14 VAL 14 14 14 VAL VAL D . n D 4 15 THR 15 15 15 THR THR D . n D 4 16 GLY 16 16 16 GLY GLY D . n D 4 17 GLY 17 17 17 GLY GLY D . n D 4 18 LYS 18 18 18 LYS LYS D . n D 4 19 VAL 19 19 19 VAL VAL D . n D 4 20 THR 20 20 20 THR THR D . n D 4 21 LEU 21 21 21 LEU LEU D . n D 4 22 SER 22 22 22 SER SER D . n D 4 23 CYS 23 23 23 CYS CYS D . n D 4 24 ASN 24 24 24 ASN ASN D . n D 4 25 GLN 25 25 25 GLN GLN D . n D 4 26 THR 26 26 26 THR THR D . n D 4 27 ASN 27 27 27 ASN ASN D . n D 4 28 ASN 28 28 28 ASN ASN D . n D 4 29 HIS 29 29 29 HIS HIS D . n D 4 30 ASN 30 30 30 ASN ASN D . n D 4 31 ASN 31 31 31 ASN ASN D . n D 4 32 MET 32 32 32 MET MET D . n D 4 33 TYR 33 33 33 TYR TYR D . n D 4 34 TRP 34 34 34 TRP TRP D . n D 4 35 TYR 35 35 35 TYR TYR D . n D 4 36 ARG 36 36 36 ARG ARG D . n D 4 37 GLN 37 37 37 GLN GLN D . n D 4 38 ASP 38 38 38 ASP ASP D . n D 4 39 THR 39 39 39 THR THR D . n D 4 40 GLY 40 40 40 GLY GLY D . n D 4 41 HIS 41 41 41 HIS HIS D . n D 4 42 GLY 42 42 42 GLY GLY D . n D 4 43 LEU 43 43 43 LEU LEU D . n D 4 44 ARG 44 44 44 ARG ARG D . n D 4 45 LEU 45 45 45 LEU LEU D . n D 4 46 ILE 46 46 46 ILE ILE D . n D 4 47 HIS 47 47 47 HIS HIS D . n D 4 48 TYR 48 48 48 TYR TYR D . n D 4 49 SER 49 49 49 SER SER D . n D 4 50 TYR 50 50 50 TYR TYR D . n D 4 51 GLY 51 51 51 GLY GLY D . n D 4 52 ALA 52 52 52 ALA ALA D . n D 4 53 GLY 53 53 53 GLY GLY D . n D 4 54 SER 54 54 54 SER SER D . n D 4 55 THR 55 55 55 THR THR D . n D 4 56 GLU 56 56 56 GLU GLU D . n D 4 57 LYS 57 57 57 LYS LYS D . n D 4 58 GLY 58 58 58 GLY GLY D . n D 4 59 ASP 59 59 59 ASP ASP D . n D 4 60 ILE 60 60 60 ILE ILE D . n D 4 61 PRO 61 61 61 PRO PRO D . n D 4 62 ASP 62 62 62 ASP ASP D . n D 4 63 GLY 63 63 63 GLY GLY D . n D 4 64 TYR 64 65 65 TYR TYR D . n D 4 65 LYS 65 66 66 LYS LYS D . n D 4 66 ALA 66 67 67 ALA ALA D . n D 4 67 SER 67 68 68 SER SER D . n D 4 68 ARG 68 69 69 ARG ARG D . n D 4 69 PRO 69 70 70 PRO PRO D . n D 4 70 SER 70 71 71 SER SER D . n D 4 71 GLN 71 72 72 GLN GLN D . n D 4 72 GLU 72 73 73 GLU GLU D . n D 4 73 ASN 73 74 74 ASN ASN D . n D 4 74 PHE 74 75 75 PHE PHE D . n D 4 75 SER 75 76 76 SER SER D . n D 4 76 LEU 76 77 77 LEU LEU D . n D 4 77 ILE 77 78 78 ILE ILE D . n D 4 78 LEU 78 79 79 LEU LEU D . n D 4 79 GLU 79 80 80 GLU GLU D . n D 4 80 LEU 80 81 81 LEU LEU D . n D 4 81 ALA 81 82 82 ALA ALA D . n D 4 82 THR 82 83 83 THR THR D . n D 4 83 PRO 83 84 84 PRO PRO D . n D 4 84 SER 84 85 85 SER SER D . n D 4 85 GLN 85 86 86 GLN GLN D . n D 4 86 THR 86 87 87 THR THR D . n D 4 87 SER 87 88 88 SER SER D . n D 4 88 VAL 88 89 89 VAL VAL D . n D 4 89 TYR 89 90 90 TYR TYR D . n D 4 90 PHE 90 91 91 PHE PHE D . n D 4 91 CYS 91 92 92 CYS CYS D . n D 4 92 ALA 92 93 93 ALA ALA D . n D 4 93 SER 93 94 94 SER SER D . n D 4 94 GLY 94 95 95 GLY GLY D . n D 4 95 ASP 95 96 96 ASP ASP D . n D 4 96 ALA 96 97 ? ? ? D . n D 4 97 GLY 97 98 ? ? ? D . n D 4 98 GLY 98 99 ? ? ? D . n D 4 99 ASN 99 100 ? ? ? D . n D 4 100 TYR 100 101 ? ? ? D . n D 4 101 ALA 101 102 102 ALA ALA D . n D 4 102 GLU 102 103 103 GLU GLU D . n D 4 103 GLN 103 106 106 GLN GLN D . n D 4 104 PHE 104 107 107 PHE PHE D . n D 4 105 PHE 105 108 108 PHE PHE D . n D 4 106 GLY 106 109 109 GLY GLY D . n D 4 107 PRO 107 110 110 PRO PRO D . n D 4 108 GLY 108 111 111 GLY GLY D . n D 4 109 THR 109 112 112 THR THR D . n D 4 110 ARG 110 113 113 ARG ARG D . n D 4 111 LEU 111 114 114 LEU LEU D . n D 4 112 THR 112 115 115 THR THR D . n D 4 113 VAL 113 116 116 VAL VAL D . n D 4 114 LEU 114 117 117 LEU LEU D . n D 4 115 GLU 115 118 118 GLU GLU D . n D 4 116 ASP 116 119 119 ASP ASP D . n D 4 117 LEU 117 120 120 LEU LEU D . n D 4 118 LYS 118 121 121 LYS LYS D . n D 4 119 ASN 119 122 122 ASN ASN D . n D 4 120 VAL 120 123 123 VAL VAL D . n D 4 121 PHE 121 124 124 PHE PHE D . n D 4 122 PRO 122 125 125 PRO PRO D . n D 4 123 PRO 123 126 126 PRO PRO D . n D 4 124 GLU 124 127 127 GLU GLU D . n D 4 125 VAL 125 128 128 VAL VAL D . n D 4 126 ALA 126 129 129 ALA ALA D . n D 4 127 VAL 127 130 130 VAL VAL D . n D 4 128 PHE 128 131 131 PHE PHE D . n D 4 129 GLU 129 132 132 GLU GLU D . n D 4 130 PRO 130 133 133 PRO PRO D . n D 4 131 SER 131 134 134 SER SER D . n D 4 132 GLU 132 135 135 GLU GLU D . n D 4 133 ALA 133 136 136 ALA ALA D . n D 4 134 GLU 134 137 137 GLU GLU D . n D 4 135 ILE 135 138 138 ILE ILE D . n D 4 136 SER 136 139 139 SER SER D . n D 4 137 HIS 137 140 140 HIS HIS D . n D 4 138 THR 138 141 141 THR THR D . n D 4 139 GLN 139 142 142 GLN GLN D . n D 4 140 LYS 140 143 143 LYS LYS D . n D 4 141 ALA 141 144 144 ALA ALA D . n D 4 142 THR 142 145 145 THR THR D . n D 4 143 LEU 143 146 146 LEU LEU D . n D 4 144 VAL 144 147 147 VAL VAL D . n D 4 145 CYS 145 148 148 CYS CYS D . n D 4 146 LEU 146 149 149 LEU LEU D . n D 4 147 ALA 147 150 150 ALA ALA D . n D 4 148 THR 148 151 151 THR THR D . n D 4 149 GLY 149 152 152 GLY GLY D . n D 4 150 PHE 150 153 153 PHE PHE D . n D 4 151 TYR 151 154 154 TYR TYR D . n D 4 152 PRO 152 155 155 PRO PRO D . n D 4 153 ASP 153 156 156 ASP ASP D . n D 4 154 HIS 154 157 157 HIS HIS D . n D 4 155 VAL 155 158 158 VAL VAL D . n D 4 156 GLU 156 159 159 GLU GLU D . n D 4 157 LEU 157 160 160 LEU LEU D . n D 4 158 SER 158 161 161 SER SER D . n D 4 159 TRP 159 162 162 TRP TRP D . n D 4 160 TRP 160 163 163 TRP TRP D . n D 4 161 VAL 161 164 164 VAL VAL D . n D 4 162 ASN 162 165 165 ASN ASN D . n D 4 163 GLY 163 166 166 GLY GLY D . n D 4 164 LYS 164 167 167 LYS LYS D . n D 4 165 GLU 165 168 168 GLU GLU D . n D 4 166 VAL 166 169 169 VAL VAL D . n D 4 167 HIS 167 170 170 HIS HIS D . n D 4 168 SER 168 171 171 SER SER D . n D 4 169 GLY 169 172 172 GLY GLY D . n D 4 170 VAL 170 173 173 VAL VAL D . n D 4 171 CYS 171 174 174 CYS CYS D . n D 4 172 THR 172 175 175 THR THR D . n D 4 173 ASP 173 176 176 ASP ASP D . n D 4 174 PRO 174 177 177 PRO PRO D . n D 4 175 GLN 175 178 178 GLN GLN D . n D 4 176 PRO 176 179 179 PRO PRO D . n D 4 177 LEU 177 180 180 LEU LEU D . n D 4 178 LYS 178 181 181 LYS LYS D . n D 4 179 GLU 179 182 182 GLU GLU D . n D 4 180 GLN 180 183 183 GLN GLN D . n D 4 181 PRO 181 184 184 PRO PRO D . n D 4 182 ALA 182 185 185 ALA ALA D . n D 4 183 LEU 183 186 186 LEU LEU D . n D 4 184 ASN 184 187 187 ASN ASN D . n D 4 185 ASP 185 188 188 ASP ASP D . n D 4 186 SER 186 189 189 SER SER D . n D 4 187 ARG 187 190 190 ARG ARG D . n D 4 188 TYR 188 191 191 TYR TYR D . n D 4 189 ALA 189 192 192 ALA ALA D . n D 4 190 LEU 190 193 193 LEU LEU D . n D 4 191 SER 191 194 194 SER SER D . n D 4 192 SER 192 195 195 SER SER D . n D 4 193 ARG 193 196 196 ARG ARG D . n D 4 194 LEU 194 197 197 LEU LEU D . n D 4 195 ARG 195 198 198 ARG ARG D . n D 4 196 VAL 196 199 199 VAL VAL D . n D 4 197 SER 197 200 200 SER SER D . n D 4 198 ALA 198 201 201 ALA ALA D . n D 4 199 THR 199 202 202 THR THR D . n D 4 200 PHE 200 203 203 PHE PHE D . n D 4 201 TRP 201 204 204 TRP TRP D . n D 4 202 GLN 202 205 205 GLN GLN D . n D 4 203 ASN 203 206 206 ASN ASN D . n D 4 204 PRO 204 207 207 PRO PRO D . n D 4 205 ARG 205 208 208 ARG ARG D . n D 4 206 ASN 206 209 209 ASN ASN D . n D 4 207 HIS 207 210 210 HIS HIS D . n D 4 208 PHE 208 211 211 PHE PHE D . n D 4 209 ARG 209 212 212 ARG ARG D . n D 4 210 CYS 210 213 213 CYS CYS D . n D 4 211 GLN 211 214 214 GLN GLN D . n D 4 212 VAL 212 215 215 VAL VAL D . n D 4 213 GLN 213 216 216 GLN GLN D . n D 4 214 PHE 214 217 217 PHE PHE D . n D 4 215 TYR 215 218 218 TYR TYR D . n D 4 216 GLY 216 219 219 GLY GLY D . n D 4 217 LEU 217 220 220 LEU LEU D . n D 4 218 SER 218 221 221 SER SER D . n D 4 219 GLU 219 222 222 GLU GLU D . n D 4 220 ASN 220 223 223 ASN ASN D . n D 4 221 ASP 221 224 224 ASP ASP D . n D 4 222 GLU 222 225 225 GLU GLU D . n D 4 223 TRP 223 226 226 TRP TRP D . n D 4 224 THR 224 227 227 THR THR D . n D 4 225 GLN 225 228 228 GLN GLN D . n D 4 226 ASP 226 229 229 ASP ASP D . n D 4 227 ARG 227 230 230 ARG ARG D . n D 4 228 ALA 228 231 231 ALA ALA D . n D 4 229 LYS 229 232 232 LYS LYS D . n D 4 230 PRO 230 233 233 PRO PRO D . n D 4 231 VAL 231 234 234 VAL VAL D . n D 4 232 THR 232 235 235 THR THR D . n D 4 233 GLN 233 236 236 GLN GLN D . n D 4 234 ILE 234 237 237 ILE ILE D . n D 4 235 VAL 235 238 238 VAL VAL D . n D 4 236 SER 236 239 239 SER SER D . n D 4 237 ALA 237 240 240 ALA ALA D . n D 4 238 GLU 238 241 241 GLU GLU D . n D 4 239 ALA 239 242 242 ALA ALA D . n D 4 240 TRP 240 243 243 TRP TRP D . n D 4 241 GLY 241 244 244 GLY GLY D . n D 4 242 ARG 242 245 245 ARG ARG D . n D 4 243 ALA 243 246 246 ALA ALA D . n D 4 244 ASP 244 247 ? ? ? 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 42 A ASN 42 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 20 A ASN 20 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 165 A ASN 165 ? 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,N # _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 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2011-03-30 2 'Structure model' 1 1 2011-07-13 3 'Structure model' 1 2 2014-01-29 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Database references' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 'X-RAY DIFFRACTION' 1 ? refined -14.2648 -46.5735 -74.3706 0.3612 0.2638 0.2581 -0.0175 0.0243 -0.1964 3.5530 4.3814 8.4359 -2.0751 1.1888 -1.5306 0.2006 -0.4772 0.0523 0.6238 -0.0529 0.2458 -0.4171 -0.1927 -0.1478 'X-RAY DIFFRACTION' 2 ? refined -6.3056 -45.2193 -101.9439 0.1314 0.1920 0.1756 -0.0536 0.0196 -0.1120 4.2702 4.6684 9.5435 0.2600 -1.7553 -2.3114 0.0384 -0.2958 0.4103 -0.2677 0.0412 -0.1795 -0.0760 1.0450 -0.0797 'X-RAY DIFFRACTION' 3 ? refined -3.7103 -36.5354 -41.6709 0.1071 0.3362 0.2762 -0.0708 -0.0029 -0.1526 5.2593 6.5507 17.7921 -0.1581 2.6870 3.5867 0.0630 -0.5269 -0.0029 -0.6145 -0.0986 0.3732 -0.2302 -1.2892 0.0356 'X-RAY DIFFRACTION' 4 ? refined 12.9962 -51.2576 -49.6422 0.3134 0.2862 0.2121 -0.0511 -0.1260 -0.1328 8.1098 7.1836 10.1835 0.5157 2.9249 2.2159 0.8053 -0.0549 -0.8731 -0.2150 -0.1787 -0.0640 1.1644 0.0212 -0.6266 'X-RAY DIFFRACTION' 5 ? refined -23.2526 -49.9374 -113.2841 0.1298 0.0825 0.2108 -0.0129 -0.0700 0.0813 2.8581 3.7949 7.0990 0.7307 -0.2222 0.9254 -0.0976 0.2685 0.3631 -0.3848 0.1929 0.1939 -0.0608 -0.5007 -0.0953 'X-RAY DIFFRACTION' 6 ? refined 18.9915 -27.9841 -15.9036 0.2114 0.0897 0.0640 0.0195 -0.0257 -0.0018 10.2479 6.9216 8.9664 -0.0443 -1.7070 -0.4009 0.3855 0.6227 0.2841 -0.1647 -0.3682 -0.2122 -0.6727 -0.1366 -0.0173 'X-RAY DIFFRACTION' 7 ? refined 23.6427 -43.4072 -20.9801 0.0786 0.2076 0.3331 0.0540 -0.1602 -0.0997 3.8783 3.3965 15.2949 -0.0966 -4.6635 3.5346 0.2160 0.2934 -0.5735 0.0923 -0.1672 -0.1763 0.1655 0.5312 -0.0487 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 'X-RAY DIFFRACTION' 1 1 A 7 ? ? A 183 ? ? ? ? 'X-RAY DIFFRACTION' 2 1 A 650 ? ? A 650 ? ? ? ? 'X-RAY DIFFRACTION' 3 1 A 314 ? ? A 314 ? ? ? ? 'X-RAY DIFFRACTION' 4 1 A 400 ? ? A 401 ? ? ? ? 'X-RAY DIFFRACTION' 5 1 A 501 ? ? A 502 ? ? ? ? 'X-RAY DIFFRACTION' 6 2 B 2 ? ? B 99 ? ? ? ? 'X-RAY DIFFRACTION' 7 3 C 1 ? ? C 117 ? ? ? ? 'X-RAY DIFFRACTION' 8 4 D 3 ? ? D 119 ? ? ? ? 'X-RAY DIFFRACTION' 9 5 A 184 ? ? A 300 ? ? ? ? 'X-RAY DIFFRACTION' 10 6 C 118 ? ? C 207 ? ? ? ? 'X-RAY DIFFRACTION' 11 7 D 120 ? ? D 246 ? ? ? ? # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal Blu-Ice 'data collection' . ? 1 PHASER phasing . ? 2 REFMAC refinement 5.5.0109 ? 3 MOSFLM 'data reduction' . ? 4 SCALA 'data scaling' . ? 5 # _pdbx_entry_details.entry_id 3ARG _pdbx_entry_details.sequence_details ;FOR CHAIN C, RESIDUES 1 TO 116 IS MOUSE VARIABLE DOMAIN AND 117-210 IS HUMAN CONSTANT DOMAIN. FOR CHAIN D, RESIDUES 1 TO 117 IS MOUSE VARIABLE DOMAIN AND 118-247 IS HUMAN CONSTANT DOMAIN. THE SWISS-PROT ENTRY P11609 CONFLICTS WITH BRADBURY ET AL., 1988 WHICH SUGGESTS A HISTIDINE IN PLACE OF ASPARTATE. SEQUENCE IN THIS PDB AGREES WITH THE CITATION. ; _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? # 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 ASN A 20 ? ? -148.08 -152.40 2 1 PRO A 52 ? ? -75.63 25.37 3 1 TRP A 53 ? ? -151.31 10.48 4 1 LYS A 57 ? ? -90.21 35.09 5 1 ASP A 166 ? ? -133.18 -34.68 6 1 PRO A 215 ? ? -69.42 -172.28 7 1 ARG A 224 ? ? -111.17 76.46 8 1 GLU A 243 ? ? 72.48 -1.50 9 1 THR A 244 ? ? -77.39 -169.23 10 1 GLN A 273 ? ? -159.52 87.19 11 1 GLN C 14 ? ? -39.56 130.00 12 1 ASP C 69 ? ? -69.74 0.99 13 1 ALA C 70 ? ? -141.88 -3.44 14 1 ALA C 79 ? ? 55.73 75.26 15 1 PHE C 193 ? ? -78.26 28.04 16 1 ASP C 201 ? ? -83.81 36.16 17 1 HIS D 41 ? ? -140.01 -57.98 18 1 ASN D 187 ? ? -101.83 -60.96 19 1 ASP D 188 ? ? -76.72 22.00 20 1 GLU D 222 ? ? -51.66 -0.69 21 1 ASP D 229 ? ? -69.96 2.18 # _pdbx_validate_chiral.id 1 _pdbx_validate_chiral.PDB_model_num 1 _pdbx_validate_chiral.auth_atom_id C1A _pdbx_validate_chiral.label_alt_id ? _pdbx_validate_chiral.auth_asym_id A _pdbx_validate_chiral.auth_comp_id DB6 _pdbx_validate_chiral.auth_seq_id 650 _pdbx_validate_chiral.PDB_ins_code ? _pdbx_validate_chiral.details PLANAR _pdbx_validate_chiral.omega . # 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 1 A ARG 11 ? CZ ? A ARG 11 CZ 2 1 Y 1 A ARG 11 ? NH1 ? A ARG 11 NH1 3 1 Y 1 A ARG 11 ? NH2 ? A ARG 11 NH2 4 1 Y 1 A SER 17 ? OG ? A SER 17 OG 5 1 Y 1 A ARG 21 ? CG ? A ARG 21 CG 6 1 Y 1 A ARG 21 ? CD ? A ARG 21 CD 7 1 Y 1 A ARG 21 ? NE ? A ARG 21 NE 8 1 Y 1 A ARG 21 ? CZ ? A ARG 21 CZ 9 1 Y 1 A ARG 21 ? NH1 ? A ARG 21 NH1 10 1 Y 1 A ARG 21 ? NH2 ? A ARG 21 NH2 11 1 Y 1 A SER 22 ? OG ? A SER 22 OG 12 1 Y 1 A SER 24 ? OG ? A SER 24 OG 13 1 Y 1 A SER 28 ? OG ? A SER 28 OG 14 1 Y 1 A ASP 43 ? CG ? A ASP 43 CG 15 1 Y 1 A ASP 43 ? OD1 ? A ASP 43 OD1 16 1 Y 1 A ASP 43 ? OD2 ? A ASP 43 OD2 17 1 Y 1 A ILE 47 ? CD1 ? A ILE 47 CD1 18 1 Y 1 A PHE 49 ? CG ? A PHE 49 CG 19 1 Y 1 A PHE 49 ? CD1 ? A PHE 49 CD1 20 1 Y 1 A PHE 49 ? CD2 ? A PHE 49 CD2 21 1 Y 1 A PHE 49 ? CE1 ? A PHE 49 CE1 22 1 Y 1 A PHE 49 ? CE2 ? A PHE 49 CE2 23 1 Y 1 A PHE 49 ? CZ ? A PHE 49 CZ 24 1 Y 1 A LYS 51 ? CG ? A LYS 51 CG 25 1 Y 1 A LYS 51 ? CD ? A LYS 51 CD 26 1 Y 1 A LYS 51 ? CE ? A LYS 51 CE 27 1 Y 1 A LYS 51 ? NZ ? A LYS 51 NZ 28 1 Y 1 A SER 54 ? OG ? A SER 54 OG 29 1 Y 1 A GLN 55 ? OE1 ? A GLN 55 OE1 30 1 Y 1 A GLN 55 ? NE2 ? A GLN 55 NE2 31 1 Y 1 A LYS 57 ? CD ? A LYS 57 CD 32 1 Y 1 A LYS 57 ? CE ? A LYS 57 CE 33 1 Y 1 A LYS 57 ? NZ ? A LYS 57 NZ 34 1 Y 1 A GLN 61 ? CG ? A GLN 61 CG 35 1 Y 1 A GLN 61 ? CD ? A GLN 61 CD 36 1 Y 1 A GLN 61 ? OE1 ? A GLN 61 OE1 37 1 Y 1 A GLN 61 ? NE2 ? A GLN 61 NE2 38 1 Y 1 A GLU 64 ? CG ? A GLU 64 CG 39 1 Y 1 A GLU 64 ? CD ? A GLU 64 CD 40 1 Y 1 A GLU 64 ? OE1 ? A GLU 64 OE1 41 1 Y 1 A GLU 64 ? OE2 ? A GLU 64 OE2 42 1 Y 1 A LYS 65 ? CG ? A LYS 65 CG 43 1 Y 1 A LYS 65 ? CD ? A LYS 65 CD 44 1 Y 1 A LYS 65 ? CE ? A LYS 65 CE 45 1 Y 1 A LYS 65 ? NZ ? A LYS 65 NZ 46 1 Y 1 A MET 69 ? CE ? A MET 69 CE 47 1 Y 1 A VAL 72 ? CG1 ? A VAL 72 CG1 48 1 Y 1 A VAL 72 ? CG2 ? A VAL 72 CG2 49 1 Y 1 A LYS 91 ? CG ? A LYS 91 CG 50 1 Y 1 A LYS 91 ? CD ? A LYS 91 CD 51 1 Y 1 A LYS 91 ? CE ? A LYS 91 CE 52 1 Y 1 A LYS 91 ? NZ ? A LYS 91 NZ 53 1 Y 1 A GLU 92 ? CG ? A GLU 92 CG 54 1 Y 1 A GLU 92 ? CD ? A GLU 92 CD 55 1 Y 1 A GLU 92 ? OE1 ? A GLU 92 OE1 56 1 Y 1 A GLU 92 ? OE2 ? A GLU 92 OE2 57 1 Y 1 A ASP 93 ? CG ? A ASP 93 CG 58 1 Y 1 A ASP 93 ? OD1 ? A ASP 93 OD1 59 1 Y 1 A ASP 93 ? OD2 ? A ASP 93 OD2 60 1 Y 1 A ILE 98 ? CG1 ? A ILE 98 CG1 61 1 Y 1 A ILE 98 ? CG2 ? A ILE 98 CG2 62 1 Y 1 A ILE 98 ? CD1 ? A ILE 98 CD1 63 1 Y 1 A LEU 100 ? CD1 ? A LEU 100 CD1 64 1 Y 1 A LEU 100 ? CD2 ? A LEU 100 CD2 65 1 Y 1 A GLU 105 ? CG ? A GLU 105 CG 66 1 Y 1 A GLU 105 ? CD ? A GLU 105 CD 67 1 Y 1 A GLU 105 ? OE1 ? A GLU 105 OE1 68 1 Y 1 A GLU 105 ? OE2 ? A GLU 105 OE2 69 1 Y 1 A MET 106 ? CG ? A MET 106 CG 70 1 Y 1 A MET 106 ? SD ? A MET 106 SD 71 1 Y 1 A MET 106 ? CE ? A MET 106 CE 72 1 Y 1 A LYS 123 ? CD ? A LYS 123 CD 73 1 Y 1 A LYS 123 ? CE ? A LYS 123 CE 74 1 Y 1 A LYS 123 ? NZ ? A LYS 123 NZ 75 1 Y 1 A LEU 143 ? CG ? A LEU 143 CG 76 1 Y 1 A LEU 143 ? CD1 ? A LEU 143 CD1 77 1 Y 1 A LEU 143 ? CD2 ? A LEU 143 CD2 78 1 Y 1 A ASP 144 ? CG ? A ASP 144 CG 79 1 Y 1 A ASP 144 ? OD1 ? A ASP 144 OD1 80 1 Y 1 A ASP 144 ? OD2 ? A ASP 144 OD2 81 1 Y 1 A LEU 145 ? CG ? A LEU 145 CG 82 1 Y 1 A LEU 145 ? CD1 ? A LEU 145 CD1 83 1 Y 1 A LEU 145 ? CD2 ? A LEU 145 CD2 84 1 Y 1 A LYS 148 ? CG ? A LYS 148 CG 85 1 Y 1 A LYS 148 ? CD ? A LYS 148 CD 86 1 Y 1 A LYS 148 ? CE ? A LYS 148 CE 87 1 Y 1 A LYS 148 ? NZ ? A LYS 148 NZ 88 1 Y 1 A LEU 150 ? CG ? A LEU 150 CG 89 1 Y 1 A LEU 150 ? CD1 ? A LEU 150 CD1 90 1 Y 1 A LEU 150 ? CD2 ? A LEU 150 CD2 91 1 Y 1 A ASN 151 ? OD1 ? A ASN 151 OD1 92 1 Y 1 A ASN 151 ? ND2 ? A ASN 151 ND2 93 1 Y 1 A GLN 154 ? CD ? A GLN 154 CD 94 1 Y 1 A GLN 154 ? OE1 ? A GLN 154 OE1 95 1 Y 1 A GLN 154 ? NE2 ? A GLN 154 NE2 96 1 Y 1 A MET 162 ? CG ? A MET 162 CG 97 1 Y 1 A MET 162 ? SD ? A MET 162 SD 98 1 Y 1 A MET 162 ? CE ? A MET 162 CE 99 1 Y 1 A LEU 163 ? CG ? A LEU 163 CG 100 1 Y 1 A LEU 163 ? CD1 ? A LEU 163 CD1 101 1 Y 1 A LEU 163 ? CD2 ? A LEU 163 CD2 102 1 Y 1 A LEU 164 ? CG ? A LEU 164 CG 103 1 Y 1 A LEU 164 ? CD1 ? A LEU 164 CD1 104 1 Y 1 A LEU 164 ? CD2 ? A LEU 164 CD2 105 1 Y 1 A ASP 166 ? CG ? A ASP 166 CG 106 1 Y 1 A ASP 166 ? OD1 ? A ASP 166 OD1 107 1 Y 1 A ASP 166 ? OD2 ? A ASP 166 OD2 108 1 Y 1 A LEU 170 ? CG ? A LEU 170 CG 109 1 Y 1 A LEU 170 ? CD1 ? A LEU 170 CD1 110 1 Y 1 A LEU 170 ? CD2 ? A LEU 170 CD2 111 1 Y 1 A ARG 173 ? CG ? A ARG 173 CG 112 1 Y 1 A ARG 173 ? CD ? A ARG 173 CD 113 1 Y 1 A ARG 173 ? NE ? A ARG 173 NE 114 1 Y 1 A ARG 173 ? CZ ? A ARG 173 CZ 115 1 Y 1 A ARG 173 ? NH1 ? A ARG 173 NH1 116 1 Y 1 A ARG 173 ? NH2 ? A ARG 173 NH2 117 1 Y 1 A LEU 176 ? CD1 ? A LEU 176 CD1 118 1 Y 1 A LEU 176 ? CD2 ? A LEU 176 CD2 119 1 Y 1 A GLU 177 ? CG ? A GLU 177 CG 120 1 Y 1 A GLU 177 ? CD ? A GLU 177 CD 121 1 Y 1 A GLU 177 ? OE1 ? A GLU 177 OE1 122 1 Y 1 A GLU 177 ? OE2 ? A GLU 177 OE2 123 1 Y 1 A LYS 180 ? CG ? A LYS 180 CG 124 1 Y 1 A LYS 180 ? CD ? A LYS 180 CD 125 1 Y 1 A LYS 180 ? CE ? A LYS 180 CE 126 1 Y 1 A LYS 180 ? NZ ? A LYS 180 NZ 127 1 Y 1 A SER 181 ? OG ? A SER 181 OG 128 1 Y 1 A LEU 183 ? CG ? A LEU 183 CG 129 1 Y 1 A LEU 183 ? CD1 ? A LEU 183 CD1 130 1 Y 1 A LEU 183 ? CD2 ? A LEU 183 CD2 131 1 Y 1 A GLU 184 ? CG ? A GLU 184 CG 132 1 Y 1 A GLU 184 ? CD ? A GLU 184 CD 133 1 Y 1 A GLU 184 ? OE1 ? A GLU 184 OE1 134 1 Y 1 A GLU 184 ? OE2 ? A GLU 184 OE2 135 1 Y 1 A LYS 185 ? CE ? A LYS 185 CE 136 1 Y 1 A LYS 185 ? NZ ? A LYS 185 NZ 137 1 Y 1 A LYS 188 ? CD ? A LYS 188 CD 138 1 Y 1 A LYS 188 ? CE ? A LYS 188 CE 139 1 Y 1 A LYS 188 ? NZ ? A LYS 188 NZ 140 1 Y 1 A SER 199 ? OG ? A SER 199 OG 141 1 Y 1 A GLN 205 ? CD ? A GLN 205 CD 142 1 Y 1 A GLN 205 ? OE1 ? A GLN 205 OE1 143 1 Y 1 A GLN 205 ? NE2 ? A GLN 205 NE2 144 1 Y 1 A TYR 214 ? CD1 ? A TYR 214 CD1 145 1 Y 1 A TYR 214 ? CD2 ? A TYR 214 CD2 146 1 Y 1 A TYR 214 ? CE1 ? A TYR 214 CE1 147 1 Y 1 A TYR 214 ? CE2 ? A TYR 214 CE2 148 1 Y 1 A TYR 214 ? CZ ? A TYR 214 CZ 149 1 Y 1 A TYR 214 ? OH ? A TYR 214 OH 150 1 Y 1 A GLN 227 ? CG ? A GLN 227 CG 151 1 Y 1 A GLN 227 ? CD ? A GLN 227 CD 152 1 Y 1 A GLN 227 ? OE1 ? A GLN 227 OE1 153 1 Y 1 A GLN 227 ? NE2 ? A GLN 227 NE2 154 1 Y 1 A ARG 234 ? CG ? A ARG 234 CG 155 1 Y 1 A ARG 234 ? CD ? A ARG 234 CD 156 1 Y 1 A ARG 234 ? NE ? A ARG 234 NE 157 1 Y 1 A ARG 234 ? CZ ? A ARG 234 CZ 158 1 Y 1 A ARG 234 ? NH1 ? A ARG 234 NH1 159 1 Y 1 A ARG 234 ? NH2 ? A ARG 234 NH2 160 1 Y 1 A ASP 236 ? CG ? A ASP 236 CG 161 1 Y 1 A ASP 236 ? OD1 ? A ASP 236 OD1 162 1 Y 1 A ASP 236 ? OD2 ? A ASP 236 OD2 163 1 Y 1 A ASP 242 ? CG ? A ASP 242 CG 164 1 Y 1 A ASP 242 ? OD1 ? A ASP 242 OD1 165 1 Y 1 A ASP 242 ? OD2 ? A ASP 242 OD2 166 1 Y 1 A GLU 243 ? CG ? A GLU 243 CG 167 1 Y 1 A GLU 243 ? CD ? A GLU 243 CD 168 1 Y 1 A GLU 243 ? OE1 ? A GLU 243 OE1 169 1 Y 1 A GLU 243 ? OE2 ? A GLU 243 OE2 170 1 Y 1 A GLU 254 ? CD ? A GLU 254 CD 171 1 Y 1 A GLU 254 ? OE1 ? A GLU 254 OE1 172 1 Y 1 A GLU 254 ? OE2 ? A GLU 254 OE2 173 1 Y 1 A LYS 266 ? CE ? A LYS 266 CE 174 1 Y 1 A LYS 266 ? NZ ? A LYS 266 NZ 175 1 Y 1 A GLN 273 ? CG ? A GLN 273 CG 176 1 Y 1 A GLN 273 ? CD ? A GLN 273 CD 177 1 Y 1 A GLN 273 ? OE1 ? A GLN 273 OE1 178 1 Y 1 A GLN 273 ? NE2 ? A GLN 273 NE2 179 1 Y 1 A ILE 275 ? CD1 ? A ILE 275 CD1 180 1 Y 1 A LEU 282 ? CG ? A LEU 282 CG 181 1 Y 1 A LEU 282 ? CD1 ? A LEU 282 CD1 182 1 Y 1 A LEU 282 ? CD2 ? A LEU 282 CD2 183 1 Y 1 A ASP 287 ? CG ? A ASP 287 CG 184 1 Y 1 A ASP 287 ? OD1 ? A ASP 287 OD1 185 1 Y 1 A ASP 287 ? OD2 ? A ASP 287 OD2 186 1 Y 1 A GLN 289 ? CG ? A GLN 289 CG 187 1 Y 1 A GLN 289 ? CD ? A GLN 289 CD 188 1 Y 1 A GLN 289 ? OE1 ? A GLN 289 OE1 189 1 Y 1 A GLN 289 ? NE2 ? A GLN 289 NE2 190 1 Y 1 A LYS 290 ? CD ? A LYS 290 CD 191 1 Y 1 A LYS 290 ? CE ? A LYS 290 CE 192 1 Y 1 A LYS 290 ? NZ ? A LYS 290 NZ 193 1 Y 1 B GLN 2 ? CG ? B GLN 2 CG 194 1 Y 1 B GLN 2 ? CD ? B GLN 2 CD 195 1 Y 1 B GLN 2 ? OE1 ? B GLN 2 OE1 196 1 Y 1 B GLN 2 ? NE2 ? B GLN 2 NE2 197 1 Y 1 B LYS 3 ? CE ? B LYS 3 CE 198 1 Y 1 B LYS 3 ? NZ ? B LYS 3 NZ 199 1 Y 1 B GLN 6 ? CG ? B GLN 6 CG 200 1 Y 1 B GLN 6 ? CD ? B GLN 6 CD 201 1 Y 1 B GLN 6 ? OE1 ? B GLN 6 OE1 202 1 Y 1 B GLN 6 ? NE2 ? B GLN 6 NE2 203 1 Y 1 B GLU 16 ? CG ? B GLU 16 CG 204 1 Y 1 B GLU 16 ? CD ? B GLU 16 CD 205 1 Y 1 B GLU 16 ? OE1 ? B GLU 16 OE1 206 1 Y 1 B GLU 16 ? OE2 ? B GLU 16 OE2 207 1 Y 1 B LYS 19 ? CG ? B LYS 19 CG 208 1 Y 1 B LYS 19 ? CD ? B LYS 19 CD 209 1 Y 1 B LYS 19 ? CE ? B LYS 19 CE 210 1 Y 1 B LYS 19 ? NZ ? B LYS 19 NZ 211 1 Y 1 B ILE 22 ? CD1 ? B ILE 22 CD1 212 1 Y 1 B GLN 29 ? CG ? B GLN 29 CG 213 1 Y 1 B GLN 29 ? CD ? B GLN 29 CD 214 1 Y 1 B GLN 29 ? OE1 ? B GLN 29 OE1 215 1 Y 1 B GLN 29 ? NE2 ? B GLN 29 NE2 216 1 Y 1 B GLU 36 ? CG ? B GLU 36 CG 217 1 Y 1 B GLU 36 ? CD ? B GLU 36 CD 218 1 Y 1 B GLU 36 ? OE1 ? B GLU 36 OE1 219 1 Y 1 B GLU 36 ? OE2 ? B GLU 36 OE2 220 1 Y 1 B LYS 41 ? NZ ? B LYS 41 NZ 221 1 Y 1 B LYS 44 ? CG ? B LYS 44 CG 222 1 Y 1 B LYS 44 ? CD ? B LYS 44 CD 223 1 Y 1 B LYS 44 ? CE ? B LYS 44 CE 224 1 Y 1 B LYS 44 ? NZ ? B LYS 44 NZ 225 1 Y 1 B LYS 45 ? CD ? B LYS 45 CD 226 1 Y 1 B LYS 45 ? CE ? B LYS 45 CE 227 1 Y 1 B LYS 45 ? NZ ? B LYS 45 NZ 228 1 Y 1 B ILE 46 ? CD1 ? B ILE 46 CD1 229 1 Y 1 B LYS 48 ? CD ? B LYS 48 CD 230 1 Y 1 B LYS 48 ? CE ? B LYS 48 CE 231 1 Y 1 B LYS 48 ? NZ ? B LYS 48 NZ 232 1 Y 1 B GLU 50 ? CD ? B GLU 50 CD 233 1 Y 1 B GLU 50 ? OE1 ? B GLU 50 OE1 234 1 Y 1 B GLU 50 ? OE2 ? B GLU 50 OE2 235 1 Y 1 B LYS 58 ? CG ? B LYS 58 CG 236 1 Y 1 B LYS 58 ? CD ? B LYS 58 CD 237 1 Y 1 B LYS 58 ? CE ? B LYS 58 CE 238 1 Y 1 B LYS 58 ? NZ ? B LYS 58 NZ 239 1 Y 1 B GLU 69 ? CG ? B GLU 69 CG 240 1 Y 1 B GLU 69 ? CD ? B GLU 69 CD 241 1 Y 1 B GLU 69 ? OE1 ? B GLU 69 OE1 242 1 Y 1 B GLU 69 ? OE2 ? B GLU 69 OE2 243 1 Y 1 B GLU 74 ? CG ? B GLU 74 CG 244 1 Y 1 B GLU 74 ? CD ? B GLU 74 CD 245 1 Y 1 B GLU 74 ? OE1 ? B GLU 74 OE1 246 1 Y 1 B GLU 74 ? OE2 ? B GLU 74 OE2 247 1 Y 1 B LYS 83 ? CD ? B LYS 83 CD 248 1 Y 1 B LYS 83 ? CE ? B LYS 83 CE 249 1 Y 1 B LYS 83 ? NZ ? B LYS 83 NZ 250 1 Y 1 B GLU 89 ? CD ? B GLU 89 CD 251 1 Y 1 B GLU 89 ? OE1 ? B GLU 89 OE1 252 1 Y 1 B GLU 89 ? OE2 ? B GLU 89 OE2 253 1 Y 1 B LYS 91 ? CD ? B LYS 91 CD 254 1 Y 1 B LYS 91 ? CE ? B LYS 91 CE 255 1 Y 1 B LYS 91 ? NZ ? B LYS 91 NZ 256 1 Y 1 B MET 99 ? CG ? B MET 99 CG 257 1 Y 1 B MET 99 ? SD ? B MET 99 SD 258 1 Y 1 B MET 99 ? CE ? B MET 99 CE 259 1 Y 1 C THR 1 ? OG1 ? C THR 1 OG1 260 1 Y 1 C THR 1 ? CG2 ? C THR 1 CG2 261 1 Y 1 C GLN 2 ? CG ? C GLN 2 CG 262 1 Y 1 C GLN 2 ? CD ? C GLN 2 CD 263 1 Y 1 C GLN 2 ? OE1 ? C GLN 2 OE1 264 1 Y 1 C GLN 2 ? NE2 ? C GLN 2 NE2 265 1 Y 1 C GLU 4 ? CG ? C GLU 4 CG 266 1 Y 1 C GLU 4 ? CD ? C GLU 4 CD 267 1 Y 1 C GLU 4 ? OE1 ? C GLU 4 OE1 268 1 Y 1 C GLU 4 ? OE2 ? C GLU 4 OE2 269 1 Y 1 C SER 6 ? OG ? C SER 6 OG 270 1 Y 1 C LEU 10 ? CG ? C LEU 10 CG 271 1 Y 1 C LEU 10 ? CD1 ? C LEU 10 CD1 272 1 Y 1 C LEU 10 ? CD2 ? C LEU 10 CD2 273 1 Y 1 C ARG 13 ? CG ? C ARG 13 CG 274 1 Y 1 C ARG 13 ? CD ? C ARG 13 CD 275 1 Y 1 C ARG 13 ? NE ? C ARG 13 NE 276 1 Y 1 C ARG 13 ? CZ ? C ARG 13 CZ 277 1 Y 1 C ARG 13 ? NH1 ? C ARG 13 NH1 278 1 Y 1 C ARG 13 ? NH2 ? C ARG 13 NH2 279 1 Y 1 C VAL 19 ? CG1 ? C VAL 19 CG1 280 1 Y 1 C VAL 19 ? CG2 ? C VAL 19 CG2 281 1 Y 1 C LYS 36 ? CG ? C LYS 36 CG 282 1 Y 1 C LYS 36 ? CD ? C LYS 36 CD 283 1 Y 1 C LYS 36 ? CE ? C LYS 36 CE 284 1 Y 1 C LYS 36 ? NZ ? C LYS 36 NZ 285 1 Y 1 C ASP 38 ? CG ? C ASP 38 CG 286 1 Y 1 C ASP 38 ? OD1 ? C ASP 38 OD1 287 1 Y 1 C ASP 38 ? OD2 ? C ASP 38 OD2 288 1 Y 1 C LYS 41 ? CG ? C LYS 41 CG 289 1 Y 1 C LYS 41 ? CD ? C LYS 41 CD 290 1 Y 1 C LYS 41 ? CE ? C LYS 41 CE 291 1 Y 1 C LYS 41 ? NZ ? C LYS 41 NZ 292 1 Y 1 C VAL 44 ? CG1 ? C VAL 44 CG1 293 1 Y 1 C VAL 44 ? CG2 ? C VAL 44 CG2 294 1 Y 1 C ASP 51 ? OD1 ? C ASP 51 OD1 295 1 Y 1 C ASP 51 ? OD2 ? C ASP 51 OD2 296 1 Y 1 C LYS 53 ? CD ? C LYS 53 CD 297 1 Y 1 C LYS 53 ? CE ? C LYS 53 CE 298 1 Y 1 C LYS 53 ? NZ ? C LYS 53 NZ 299 1 Y 1 C LYS 55 ? CG ? C LYS 55 CG 300 1 Y 1 C LYS 55 ? CD ? C LYS 55 CD 301 1 Y 1 C LYS 55 ? CE ? C LYS 55 CE 302 1 Y 1 C LYS 55 ? NZ ? C LYS 55 NZ 303 1 Y 1 C ASP 67 ? OD1 ? C ASP 66 OD1 304 1 Y 1 C ASP 67 ? OD2 ? C ASP 66 OD2 305 1 Y 1 C ASP 69 ? CG ? C ASP 68 CG 306 1 Y 1 C ASP 69 ? OD1 ? C ASP 68 OD1 307 1 Y 1 C ASP 69 ? OD2 ? C ASP 68 OD2 308 1 Y 1 C LYS 71 ? CG ? C LYS 70 CG 309 1 Y 1 C LYS 71 ? CD ? C LYS 70 CD 310 1 Y 1 C LYS 71 ? CE ? C LYS 70 CE 311 1 Y 1 C LYS 71 ? NZ ? C LYS 70 NZ 312 1 Y 1 C ILE 77 ? CD1 ? C ILE 76 CD1 313 1 Y 1 C LEU 81 ? CD1 ? C LEU 80 CD1 314 1 Y 1 C LEU 81 ? CD2 ? C LEU 80 CD2 315 1 Y 1 C ARG 103 ? CG ? C ARG 100 CG 316 1 Y 1 C ARG 103 ? CD ? C ARG 100 CD 317 1 Y 1 C ARG 103 ? NE ? C ARG 100 NE 318 1 Y 1 C ARG 103 ? CZ ? C ARG 100 CZ 319 1 Y 1 C ARG 103 ? NH1 ? C ARG 100 NH1 320 1 Y 1 C ARG 103 ? NH2 ? C ARG 100 NH2 321 1 Y 1 C GLN 111 ? CD ? C GLN 108 CD 322 1 Y 1 C GLN 111 ? OE1 ? C GLN 108 OE1 323 1 Y 1 C GLN 111 ? NE2 ? C GLN 108 NE2 324 1 Y 1 C ILE 113 ? CG1 ? C ILE 110 CG1 325 1 Y 1 C ILE 113 ? CG2 ? C ILE 110 CG2 326 1 Y 1 C ILE 113 ? CD1 ? C ILE 110 CD1 327 1 Y 1 C GLN 119 ? CG ? C GLN 116 CG 328 1 Y 1 C GLN 119 ? CD ? C GLN 116 CD 329 1 Y 1 C GLN 119 ? OE1 ? C GLN 116 OE1 330 1 Y 1 C GLN 119 ? NE2 ? C GLN 116 NE2 331 1 Y 1 C ARG 129 ? CZ ? C ARG 126 CZ 332 1 Y 1 C ARG 129 ? NH1 ? C ARG 126 NH1 333 1 Y 1 C ARG 129 ? NH2 ? C ARG 126 NH2 334 1 Y 1 C LYS 132 ? CD ? C LYS 129 CD 335 1 Y 1 C LYS 132 ? CE ? C LYS 129 CE 336 1 Y 1 C LYS 132 ? NZ ? C LYS 129 NZ 337 1 Y 1 C ASP 135 ? OD1 ? C ASP 132 OD1 338 1 Y 1 C ASP 135 ? OD2 ? C ASP 132 OD2 339 1 Y 1 C LYS 136 ? CG ? C LYS 133 CG 340 1 Y 1 C LYS 136 ? CD ? C LYS 133 CD 341 1 Y 1 C LYS 136 ? CE ? C LYS 133 CE 342 1 Y 1 C LYS 136 ? NZ ? C LYS 133 NZ 343 1 Y 1 C ASP 145 ? OD1 ? C ASP 142 OD1 344 1 Y 1 C ASP 145 ? OD2 ? C ASP 142 OD2 345 1 Y 1 C GLN 147 ? CG ? C GLN 144 CG 346 1 Y 1 C GLN 147 ? CD ? C GLN 144 CD 347 1 Y 1 C GLN 147 ? OE1 ? C GLN 144 OE1 348 1 Y 1 C GLN 147 ? NE2 ? C GLN 144 NE2 349 1 Y 1 C THR 148 ? CG2 ? C THR 145 CG2 350 1 Y 1 C LYS 154 ? CG ? C LYS 151 CG 351 1 Y 1 C LYS 154 ? CD ? C LYS 151 CD 352 1 Y 1 C LYS 154 ? CE ? C LYS 151 CE 353 1 Y 1 C LYS 154 ? NZ ? C LYS 151 NZ 354 1 Y 1 C SER 156 ? OG ? C SER 153 OG 355 1 Y 1 C ASP 157 ? CG ? C ASP 154 CG 356 1 Y 1 C ASP 157 ? OD1 ? C ASP 154 OD1 357 1 Y 1 C ASP 157 ? OD2 ? C ASP 154 OD2 358 1 Y 1 C ASP 162 ? OD1 ? C ASP 159 OD1 359 1 Y 1 C ASP 162 ? OD2 ? C ASP 159 OD2 360 1 Y 1 C LYS 163 ? CD ? C LYS 160 CD 361 1 Y 1 C LYS 163 ? CE ? C LYS 160 CE 362 1 Y 1 C LYS 163 ? NZ ? C LYS 160 NZ 363 1 Y 1 C MET 171 ? CE ? C MET 168 CE 364 1 Y 1 C ASP 172 ? OD1 ? C ASP 169 OD1 365 1 Y 1 C ASP 172 ? OD2 ? C ASP 169 OD2 366 1 Y 1 C LYS 174 ? NZ ? C LYS 171 NZ 367 1 Y 1 C ASN 183 ? CG ? C ASN 180 CG 368 1 Y 1 C ASN 183 ? OD1 ? C ASN 180 OD1 369 1 Y 1 C ASN 183 ? ND2 ? C ASN 180 ND2 370 1 Y 1 C LYS 184 ? CG ? C LYS 181 CG 371 1 Y 1 C LYS 184 ? CD ? C LYS 181 CD 372 1 Y 1 C LYS 184 ? CE ? C LYS 181 CE 373 1 Y 1 C LYS 184 ? NZ ? C LYS 181 NZ 374 1 Y 1 C ASP 186 ? CG ? C ASP 183 CG 375 1 Y 1 C ASP 186 ? OD1 ? C ASP 183 OD1 376 1 Y 1 C ASP 186 ? OD2 ? C ASP 183 OD2 377 1 Y 1 C ILE 197 ? CG1 ? C ILE 194 CG1 378 1 Y 1 C ILE 197 ? CG2 ? C ILE 194 CG2 379 1 Y 1 C ILE 197 ? CD1 ? C ILE 194 CD1 380 1 Y 1 C ILE 198 ? CG1 ? C ILE 195 CG1 381 1 Y 1 C ILE 198 ? CG2 ? C ILE 195 CG2 382 1 Y 1 C ILE 198 ? CD1 ? C ILE 195 CD1 383 1 Y 1 C GLU 200 ? CG ? C GLU 197 CG 384 1 Y 1 C GLU 200 ? CD ? C GLU 197 CD 385 1 Y 1 C GLU 200 ? OE1 ? C GLU 197 OE1 386 1 Y 1 C GLU 200 ? OE2 ? C GLU 197 OE2 387 1 Y 1 C ASP 201 ? OD1 ? C ASP 198 OD1 388 1 Y 1 C ASP 201 ? OD2 ? C ASP 198 OD2 389 1 Y 1 D ARG 9 ? NE ? D ARG 9 NE 390 1 Y 1 D ARG 9 ? CZ ? D ARG 9 CZ 391 1 Y 1 D ARG 9 ? NH1 ? D ARG 9 NH1 392 1 Y 1 D ARG 9 ? NH2 ? D ARG 9 NH2 393 1 Y 1 D ASN 10 ? OD1 ? D ASN 10 OD1 394 1 Y 1 D ASN 10 ? ND2 ? D ASN 10 ND2 395 1 Y 1 D LYS 11 ? CG ? D LYS 11 CG 396 1 Y 1 D LYS 11 ? CD ? D LYS 11 CD 397 1 Y 1 D LYS 11 ? CE ? D LYS 11 CE 398 1 Y 1 D LYS 11 ? NZ ? D LYS 11 NZ 399 1 Y 1 D VAL 12 ? CG1 ? D VAL 12 CG1 400 1 Y 1 D VAL 12 ? CG2 ? D VAL 12 CG2 401 1 Y 1 D LYS 18 ? CG ? D LYS 18 CG 402 1 Y 1 D LYS 18 ? CD ? D LYS 18 CD 403 1 Y 1 D LYS 18 ? CE ? D LYS 18 CE 404 1 Y 1 D LYS 18 ? NZ ? D LYS 18 NZ 405 1 Y 1 D VAL 19 ? CG1 ? D VAL 19 CG1 406 1 Y 1 D VAL 19 ? CG2 ? D VAL 19 CG2 407 1 Y 1 D LEU 21 ? CD1 ? D LEU 21 CD1 408 1 Y 1 D LEU 21 ? CD2 ? D LEU 21 CD2 409 1 Y 1 D SER 22 ? OG ? D SER 22 OG 410 1 Y 1 D ASN 28 ? OD1 ? D ASN 28 OD1 411 1 Y 1 D ASN 28 ? ND2 ? D ASN 28 ND2 412 1 Y 1 D ASN 30 ? CG ? D ASN 30 CG 413 1 Y 1 D ASN 30 ? OD1 ? D ASN 30 OD1 414 1 Y 1 D ASN 30 ? ND2 ? D ASN 30 ND2 415 1 Y 1 D ASP 38 ? OD1 ? D ASP 38 OD1 416 1 Y 1 D ASP 38 ? OD2 ? D ASP 38 OD2 417 1 Y 1 D ARG 44 ? NE ? D ARG 44 NE 418 1 Y 1 D ARG 44 ? CZ ? D ARG 44 CZ 419 1 Y 1 D ARG 44 ? NH1 ? D ARG 44 NH1 420 1 Y 1 D ARG 44 ? NH2 ? D ARG 44 NH2 421 1 Y 1 D LYS 57 ? CE ? D LYS 57 CE 422 1 Y 1 D LYS 57 ? NZ ? D LYS 57 NZ 423 1 Y 1 D ASP 59 ? OD1 ? D ASP 59 OD1 424 1 Y 1 D ASP 59 ? OD2 ? D ASP 59 OD2 425 1 Y 1 D ILE 60 ? CD1 ? D ILE 60 CD1 426 1 Y 1 D ASP 62 ? OD1 ? D ASP 62 OD1 427 1 Y 1 D ASP 62 ? OD2 ? D ASP 62 OD2 428 1 Y 1 D LYS 66 ? CD ? D LYS 65 CD 429 1 Y 1 D LYS 66 ? CE ? D LYS 65 CE 430 1 Y 1 D LYS 66 ? NZ ? D LYS 65 NZ 431 1 Y 1 D SER 68 ? OG ? D SER 67 OG 432 1 Y 1 D SER 71 ? OG ? D SER 70 OG 433 1 Y 1 D GLN 72 ? CG ? D GLN 71 CG 434 1 Y 1 D GLN 72 ? CD ? D GLN 71 CD 435 1 Y 1 D GLN 72 ? OE1 ? D GLN 71 OE1 436 1 Y 1 D GLN 72 ? NE2 ? D GLN 71 NE2 437 1 Y 1 D GLU 73 ? CD ? D GLU 72 CD 438 1 Y 1 D GLU 73 ? OE1 ? D GLU 72 OE1 439 1 Y 1 D GLU 73 ? OE2 ? D GLU 72 OE2 440 1 Y 1 D ASN 74 ? CG ? D ASN 73 CG 441 1 Y 1 D ASN 74 ? OD1 ? D ASN 73 OD1 442 1 Y 1 D ASN 74 ? ND2 ? D ASN 73 ND2 443 1 Y 1 D SER 76 ? OG ? D SER 75 OG 444 1 Y 1 D ILE 78 ? CD1 ? D ILE 77 CD1 445 1 Y 1 D GLU 80 ? CG ? D GLU 79 CG 446 1 Y 1 D GLU 80 ? CD ? D GLU 79 CD 447 1 Y 1 D GLU 80 ? OE1 ? D GLU 79 OE1 448 1 Y 1 D GLU 80 ? OE2 ? D GLU 79 OE2 449 1 Y 1 D LEU 81 ? CD1 ? D LEU 80 CD1 450 1 Y 1 D LEU 81 ? CD2 ? D LEU 80 CD2 451 1 Y 1 D ASP 96 ? CG ? D ASP 95 CG 452 1 Y 1 D ASP 96 ? OD1 ? D ASP 95 OD1 453 1 Y 1 D ASP 96 ? OD2 ? D ASP 95 OD2 454 1 Y 1 D ARG 113 ? CG ? D ARG 110 CG 455 1 Y 1 D ARG 113 ? CD ? D ARG 110 CD 456 1 Y 1 D ARG 113 ? NE ? D ARG 110 NE 457 1 Y 1 D ARG 113 ? CZ ? D ARG 110 CZ 458 1 Y 1 D ARG 113 ? NH1 ? D ARG 110 NH1 459 1 Y 1 D ARG 113 ? NH2 ? D ARG 110 NH2 460 1 Y 1 D LEU 117 ? CG ? D LEU 114 CG 461 1 Y 1 D LEU 117 ? CD1 ? D LEU 114 CD1 462 1 Y 1 D LEU 117 ? CD2 ? D LEU 114 CD2 463 1 Y 1 D GLU 118 ? CG ? D GLU 115 CG 464 1 Y 1 D GLU 118 ? CD ? D GLU 115 CD 465 1 Y 1 D GLU 118 ? OE1 ? D GLU 115 OE1 466 1 Y 1 D GLU 118 ? OE2 ? D GLU 115 OE2 467 1 Y 1 D ASP 119 ? CG ? D ASP 116 CG 468 1 Y 1 D ASP 119 ? OD1 ? D ASP 116 OD1 469 1 Y 1 D ASP 119 ? OD2 ? D ASP 116 OD2 470 1 Y 1 D LEU 120 ? CD1 ? D LEU 117 CD1 471 1 Y 1 D LEU 120 ? CD2 ? D LEU 117 CD2 472 1 Y 1 D LYS 121 ? CD ? D LYS 118 CD 473 1 Y 1 D LYS 121 ? CE ? D LYS 118 CE 474 1 Y 1 D LYS 121 ? NZ ? D LYS 118 NZ 475 1 Y 1 D GLU 127 ? CD ? D GLU 124 CD 476 1 Y 1 D GLU 127 ? OE1 ? D GLU 124 OE1 477 1 Y 1 D GLU 127 ? OE2 ? D GLU 124 OE2 478 1 Y 1 D GLU 135 ? CG ? D GLU 132 CG 479 1 Y 1 D GLU 135 ? CD ? D GLU 132 CD 480 1 Y 1 D GLU 135 ? OE1 ? D GLU 132 OE1 481 1 Y 1 D GLU 135 ? OE2 ? D GLU 132 OE2 482 1 Y 1 D GLU 159 ? CG ? D GLU 156 CG 483 1 Y 1 D GLU 159 ? CD ? D GLU 156 CD 484 1 Y 1 D GLU 159 ? OE1 ? D GLU 156 OE1 485 1 Y 1 D GLU 159 ? OE2 ? D GLU 156 OE2 486 1 Y 1 D LEU 160 ? CD1 ? D LEU 157 CD1 487 1 Y 1 D LEU 160 ? CD2 ? D LEU 157 CD2 488 1 Y 1 D LYS 167 ? CD ? D LYS 164 CD 489 1 Y 1 D LYS 167 ? CE ? D LYS 164 CE 490 1 Y 1 D LYS 167 ? NZ ? D LYS 164 NZ 491 1 Y 1 D GLN 178 ? CD ? D GLN 175 CD 492 1 Y 1 D GLN 178 ? OE1 ? D GLN 175 OE1 493 1 Y 1 D GLN 178 ? NE2 ? D GLN 175 NE2 494 1 Y 1 D LEU 180 ? CG ? D LEU 177 CG 495 1 Y 1 D LEU 180 ? CD1 ? D LEU 177 CD1 496 1 Y 1 D LEU 180 ? CD2 ? D LEU 177 CD2 497 1 Y 1 D LYS 181 ? CG ? D LYS 178 CG 498 1 Y 1 D LYS 181 ? CD ? D LYS 178 CD 499 1 Y 1 D LYS 181 ? CE ? D LYS 178 CE 500 1 Y 1 D LYS 181 ? NZ ? D LYS 178 NZ 501 1 Y 1 D GLN 183 ? CD ? D GLN 180 CD 502 1 Y 1 D GLN 183 ? OE1 ? D GLN 180 OE1 503 1 Y 1 D GLN 183 ? NE2 ? D GLN 180 NE2 504 1 Y 1 D ASN 187 ? OD1 ? D ASN 184 OD1 505 1 Y 1 D ASN 187 ? ND2 ? D ASN 184 ND2 506 1 Y 1 D ARG 190 ? CZ ? D ARG 187 CZ 507 1 Y 1 D ARG 190 ? NH1 ? D ARG 187 NH1 508 1 Y 1 D ARG 190 ? NH2 ? D ARG 187 NH2 509 1 Y 1 D ARG 208 ? CG ? D ARG 205 CG 510 1 Y 1 D ARG 208 ? CD ? D ARG 205 CD 511 1 Y 1 D ARG 208 ? NE ? D ARG 205 NE 512 1 Y 1 D ARG 208 ? CZ ? D ARG 205 CZ 513 1 Y 1 D ARG 208 ? NH1 ? D ARG 205 NH1 514 1 Y 1 D ARG 208 ? NH2 ? D ARG 205 NH2 515 1 Y 1 D ARG 212 ? CZ ? D ARG 209 CZ 516 1 Y 1 D ARG 212 ? NH1 ? D ARG 209 NH1 517 1 Y 1 D ARG 212 ? NH2 ? D ARG 209 NH2 518 1 Y 1 D LEU 220 ? CD1 ? D LEU 217 CD1 519 1 Y 1 D LEU 220 ? CD2 ? D LEU 217 CD2 520 1 Y 1 D SER 221 ? OG ? D SER 218 OG 521 1 Y 1 D GLU 222 ? CG ? D GLU 219 CG 522 1 Y 1 D GLU 222 ? CD ? D GLU 219 CD 523 1 Y 1 D GLU 222 ? OE1 ? D GLU 219 OE1 524 1 Y 1 D GLU 222 ? OE2 ? D GLU 219 OE2 525 1 Y 1 D ASN 223 ? CG ? D ASN 220 CG 526 1 Y 1 D ASN 223 ? OD1 ? D ASN 220 OD1 527 1 Y 1 D ASN 223 ? ND2 ? D ASN 220 ND2 528 1 Y 1 D ASP 224 ? CG ? D ASP 221 CG 529 1 Y 1 D ASP 224 ? OD1 ? D ASP 221 OD1 530 1 Y 1 D ASP 224 ? OD2 ? D ASP 221 OD2 531 1 Y 1 D GLU 225 ? CG ? D GLU 222 CG 532 1 Y 1 D GLU 225 ? CD ? D GLU 222 CD 533 1 Y 1 D GLU 225 ? OE1 ? D GLU 222 OE1 534 1 Y 1 D GLU 225 ? OE2 ? D GLU 222 OE2 535 1 Y 1 D GLN 228 ? CD ? D GLN 225 CD 536 1 Y 1 D GLN 228 ? OE1 ? D GLN 225 OE1 537 1 Y 1 D GLN 228 ? NE2 ? D GLN 225 NE2 538 1 Y 1 D ASP 229 ? CG ? D ASP 226 CG 539 1 Y 1 D ASP 229 ? OD1 ? D ASP 226 OD1 540 1 Y 1 D ASP 229 ? OD2 ? D ASP 226 OD2 541 1 Y 1 D LYS 232 ? CG ? D LYS 229 CG 542 1 Y 1 D LYS 232 ? CD ? D LYS 229 CD 543 1 Y 1 D LYS 232 ? CE ? D LYS 229 CE 544 1 Y 1 D LYS 232 ? NZ ? D LYS 229 NZ 545 1 Y 1 D ILE 237 ? CD1 ? D ILE 234 CD1 546 1 Y 1 D GLU 241 ? OE1 ? D GLU 238 OE1 547 1 Y 1 D GLU 241 ? OE2 ? D GLU 238 OE2 548 1 N 1 A NAG 401 ? C7 ? E NAG 2 C7 549 1 N 1 A NAG 401 ? C8 ? E NAG 2 C8 550 1 N 1 A NAG 401 ? O7 ? E NAG 2 O7 551 1 N 1 A NAG 502 ? C7 ? G NAG 2 C7 552 1 N 1 A NAG 502 ? C8 ? G NAG 2 C8 553 1 N 1 A NAG 502 ? O6 ? G NAG 2 O6 554 1 N 1 A NAG 502 ? O7 ? G NAG 2 O7 # 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 SER 89 ? A SER 89 8 1 Y 1 A PRO 108 ? A PRO 108 9 1 Y 1 A GLY 109 ? A GLY 109 10 1 Y 1 A ALA 241 ? A ALA 241 11 1 Y 1 A HIS 301 ? A HIS 301 12 1 Y 1 A HIS 302 ? A HIS 302 13 1 Y 1 B ILE 1 ? B ILE 1 14 1 Y 1 C LEU 99 ? C LEU 98 15 1 Y 1 C SER 185 ? C SER 182 16 1 Y 1 C GLU 208 ? C GLU 205 17 1 Y 1 C SER 209 ? C SER 206 18 1 Y 1 C SER 210 ? C SER 207 19 1 Y 1 D GLU 1 ? D GLU 1 20 1 Y 1 D ALA 2 ? D ALA 2 21 1 Y 1 D ALA 97 ? D ALA 96 22 1 Y 1 D GLY 98 ? D GLY 97 23 1 Y 1 D GLY 99 ? D GLY 98 24 1 Y 1 D ASN 100 ? D ASN 99 25 1 Y 1 D TYR 101 ? D TYR 100 26 1 Y 1 D ASP 247 ? D ASP 244 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 5 N-ACETYL-D-GLUCOSAMINE NAG 6 '(11E,14E)-N-[(2S,3S,4R)-1-(alpha-D-glucopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]icosa-11,14-dienamide' DB6 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 1 400 400 NAG NAG A . F 5 NAG 2 401 401 NAG NAG A . G 5 NAG 1 314 314 NAG NAG A . H 5 NAG 1 501 501 NAG NAG A . I 5 NAG 2 502 502 NAG NAG A . J 6 DB6 1 650 650 DB6 DB6 A . K 7 HOH 1 303 4 HOH HOH A . K 7 HOH 2 304 5 HOH HOH A . K 7 HOH 3 305 6 HOH HOH A . K 7 HOH 4 306 9 HOH HOH A . K 7 HOH 5 307 17 HOH HOH A . K 7 HOH 6 308 19 HOH HOH A . K 7 HOH 7 309 20 HOH HOH A . K 7 HOH 8 310 35 HOH HOH A . K 7 HOH 9 311 39 HOH HOH A . K 7 HOH 10 312 42 HOH HOH A . L 7 HOH 1 100 13 HOH HOH B . L 7 HOH 2 101 26 HOH HOH B . L 7 HOH 3 102 30 HOH HOH B . M 7 HOH 1 211 12 HOH HOH C . M 7 HOH 2 212 31 HOH HOH C . M 7 HOH 3 213 33 HOH HOH C . M 7 HOH 4 214 41 HOH HOH C . N 7 HOH 1 248 2 HOH HOH D . N 7 HOH 2 249 8 HOH HOH D . N 7 HOH 3 250 18 HOH HOH D . N 7 HOH 4 251 38 HOH HOH D . N 7 HOH 5 252 40 HOH HOH D . #