data_3ARB # _entry.id 3ARB # _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 3ARB RCSB RCSB029598 WWPDB D_1000029598 # 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 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 PDB 3ARG 'Ternary crystal structure of the mouse NKT TCR-CD1d-alpha-glucosylceramide(C20:2)' unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3ARB _pdbx_database_status.recvd_initial_deposition_date 2010-11-26 _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 3ARB _cell.length_a 59.037 _cell.length_b 87.309 _cell.length_c 235.654 _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 3ARB _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 'NKT Vbeta8.2' 27166.941 1 ? ? ? 'Chimera of mouse variable domain and human constant domain' 5 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 7 ? ? ? ? 6 non-polymer syn 'DI(HYDROXYETHYL)ETHER' 106.120 2 ? ? ? ? 7 non-polymer syn 'N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]-2,3-dihydroxyoctyl}tetracosanamide' 704.030 1 ? ? ? ? 8 non-polymer syn DODECANE 170.335 1 ? ? ? ? 9 water nat water 18.015 68 ? ? ? ? # 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 3ARB 3ARB 3 ? ? ? 4 PDB 3ARB 3ARB 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 3ARB A 1 ? 279 ? P11609 19 ? 297 ? 1 279 2 2 3ARB B 1 ? 99 ? Q91XJ8 21 ? 119 ? 1 99 3 3 3ARB C 1 ? 207 ? 3ARB 1 ? 210 ? 1 210 4 4 3ARB D 1 ? 244 ? 3ARB 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 3ARB HIS A 201 ? UNP P11609 ASP 219 'SEE REMARK 999' 201 1 1 3ARB GLY A 280 ? UNP P11609 ? ? 'EXPRESSION TAG' 280 2 1 3ARB SER A 281 ? UNP P11609 ? ? 'EXPRESSION TAG' 281 3 1 3ARB LEU A 282 ? UNP P11609 ? ? 'EXPRESSION TAG' 282 4 1 3ARB HIS A 283 ? UNP P11609 ? ? 'EXPRESSION TAG' 283 5 1 3ARB HIS A 284 ? UNP P11609 ? ? 'EXPRESSION TAG' 284 6 1 3ARB ILE A 285 ? UNP P11609 ? ? 'EXPRESSION TAG' 285 7 1 3ARB LEU A 286 ? UNP P11609 ? ? 'EXPRESSION TAG' 286 8 1 3ARB ASP A 287 ? UNP P11609 ? ? 'EXPRESSION TAG' 287 9 1 3ARB ALA A 288 ? UNP P11609 ? ? 'EXPRESSION TAG' 288 10 1 3ARB GLN A 289 ? UNP P11609 ? ? 'EXPRESSION TAG' 289 11 1 3ARB LYS A 290 ? UNP P11609 ? ? 'EXPRESSION TAG' 290 12 1 3ARB MET A 291 ? UNP P11609 ? ? 'EXPRESSION TAG' 291 13 1 3ARB VAL A 292 ? UNP P11609 ? ? 'EXPRESSION TAG' 292 14 1 3ARB TRP A 293 ? UNP P11609 ? ? 'EXPRESSION TAG' 293 15 1 3ARB ASN A 294 ? UNP P11609 ? ? 'EXPRESSION TAG' 294 16 1 3ARB HIS A 295 ? UNP P11609 ? ? 'EXPRESSION TAG' 295 17 1 3ARB ARG A 296 ? UNP P11609 ? ? 'EXPRESSION TAG' 296 18 1 3ARB HIS A 297 ? UNP P11609 ? ? 'EXPRESSION TAG' 297 19 1 3ARB HIS A 298 ? UNP P11609 ? ? 'EXPRESSION TAG' 298 20 1 3ARB HIS A 299 ? UNP P11609 ? ? 'EXPRESSION TAG' 299 21 1 3ARB HIS A 300 ? UNP P11609 ? ? 'EXPRESSION TAG' 300 22 1 3ARB HIS A 301 ? UNP P11609 ? ? 'EXPRESSION TAG' 301 23 1 3ARB 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 D12 non-polymer . DODECANE ? 'C12 H26' 170.335 FEE non-polymer . 'N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]-2,3-dihydroxyoctyl}tetracosanamide' ? 'C39 H77 N O9' 704.030 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 PEG non-polymer . 'DI(HYDROXYETHYL)ETHER' ? 'C4 H10 O3' 106.120 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 3ARB _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.15 _exptl_crystal.density_percent_sol 61.01 _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 '22% 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 2010-02-17 _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 0.95453 _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 0.95453 # _reflns.entry_id 3ARB _reflns.observed_criterion_sigma_I 0 _reflns.observed_criterion_sigma_F 0 _reflns.d_resolution_low 50 _reflns.d_resolution_high 2.7 _reflns.number_obs 32741 _reflns.number_all 34141 _reflns.percent_possible_obs 95.9 _reflns.pdbx_Rmerge_I_obs 0.091 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 9.3 _reflns.B_iso_Wilson_estimate 68.0 _reflns.pdbx_redundancy 3.6 _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 2.70 2.85 97.4 0.580 ? 2.1 3.6 ? 4882 ? ? ? ? ? ? ? ? ? ? ? ? ? 1 1 8.54 50.0 91.1 0.044 ? 22.2 3.6 ? 1190 ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 # _refine.entry_id 3ARB _refine.ls_number_reflns_obs 31106 _refine.ls_number_reflns_all 32726 _refine.pdbx_ls_sigma_I 0 _refine.pdbx_ls_sigma_F 0 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 48.84 _refine.ls_d_res_high 2.70 _refine.ls_percent_reflns_obs 95.05 _refine.ls_R_factor_obs 0.21617 _refine.ls_R_factor_all 0.21617 _refine.ls_R_factor_R_work 0.21399 _refine.ls_R_factor_R_free 0.25673 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.0 _refine.ls_number_reflns_R_free 1635 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.934 _refine.correlation_coeff_Fo_to_Fc_free 0.890 _refine.B_iso_mean 56.060 _refine.aniso_B[1][1] -0.51 _refine.aniso_B[2][2] 4.77 _refine.aniso_B[3][3] -4.26 _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 0.333 _refine.overall_SU_ML 0.268 _refine.overall_SU_B 29.468 _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 6470 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 163 _refine_hist.number_atoms_solvent 68 _refine_hist.number_atoms_total 6701 _refine_hist.d_res_high 2.70 _refine_hist.d_res_low 48.84 # 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 0.005 0.021 ? 6828 'X-RAY DIFFRACTION' ? r_bond_other_d ? ? ? ? 'X-RAY DIFFRACTION' ? r_angle_refined_deg 0.943 1.943 ? 9304 'X-RAY DIFFRACTION' ? r_angle_other_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 4.766 5.000 ? 827 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg 34.448 24.175 ? 309 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg 13.813 15.000 ? 1002 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg 14.472 15.000 ? 32 'X-RAY DIFFRACTION' ? r_chiral_restr 0.061 0.200 ? 1027 'X-RAY DIFFRACTION' ? r_gen_planes_refined 0.003 0.021 ? 5209 '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 0.153 1.500 ? 4153 'X-RAY DIFFRACTION' ? r_mcbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcangle_it 0.296 2.000 ? 6700 'X-RAY DIFFRACTION' ? r_scbond_it 0.381 3.000 ? 2675 'X-RAY DIFFRACTION' ? r_scangle_it 0.650 4.500 ? 2603 '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 2.700 _refine_ls_shell.d_res_low 2.770 _refine_ls_shell.number_reflns_R_work 2304 _refine_ls_shell.R_factor_R_work 0.345 _refine_ls_shell.percent_reflns_obs 97.02 _refine_ls_shell.R_factor_R_free 0.400 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 106 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.number_reflns_obs 2410 _refine_ls_shell.redundancy_reflns_obs ? # _struct.entry_id 3ARB _struct.title 'Ternary crystal structure of the NKT TCR-CD1d-alpha-galactosylceramide analogue-OCH' _struct.pdbx_descriptor 'Antigen-presenting glycoprotein CD1d1, Beta-2-microglobulin, NKT Valpha14-Jalpha18, NKT Vbeta8.2' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3ARB _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 5 ? K N N 6 ? L N N 5 ? M N N 7 ? N N N 8 ? O N N 6 ? P N N 9 ? Q N N 9 ? R N N 9 ? S N N 9 ? # _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 ? SER A 89 ? SER A 59 SER A 89 1 ? 31 HELX_P HELX_P2 2 PRO A 140 ? TRP A 142 ? PRO A 140 TRP A 142 5 ? 3 HELX_P HELX_P3 3 LEU A 143 ? ALA A 152 ? LEU A 143 ALA A 152 1 ? 10 HELX_P HELX_P4 4 ASP A 153 ? ASP A 166 ? ASP A 153 ASP A 166 1 ? 14 HELX_P HELX_P5 5 ASP A 166 ? GLY A 179 ? ASP A 166 GLY A 179 1 ? 14 HELX_P HELX_P6 6 GLY A 179 ? GLU A 184 ? GLY A 179 GLU A 184 1 ? 6 HELX_P HELX_P7 7 SER A 281 ? LYS A 290 ? SER A 281 LYS A 290 1 ? 10 HELX_P HELX_P8 8 LEU C 80 ? THR C 84 ? LEU C 81 THR C 85 5 ? 5 HELX_P HELX_P9 9 ARG C 166 ? ASP C 169 ? ARG C 169 ASP C 172 5 ? 4 HELX_P HELX_P10 10 ALA C 185 ? ALA C 189 ? ALA C 188 ALA C 192 5 ? 5 HELX_P HELX_P11 11 THR D 82 ? THR D 86 ? THR D 83 THR D 87 5 ? 5 HELX_P HELX_P12 12 ASP D 116 ? VAL D 120 ? ASP D 119 VAL D 123 5 ? 5 HELX_P HELX_P13 13 SER D 131 ? GLN D 139 ? SER D 134 GLN D 142 1 ? 9 HELX_P HELX_P14 14 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 ? ? ? ? ? ? ? 2.053 ? disulf2 disulf ? ? A CYS 208 SG ? ? ? 1_555 A CYS 263 SG ? ? A CYS 208 A CYS 263 1_555 ? ? ? ? ? ? ? 2.028 ? disulf3 disulf ? ? B CYS 25 SG ? ? ? 1_555 B CYS 80 SG ? ? B CYS 25 B CYS 80 1_555 ? ? ? ? ? ? ? 2.033 ? disulf4 disulf ? ? C CYS 22 SG ? ? ? 1_555 C CYS 89 SG ? ? C CYS 22 C CYS 90 1_555 ? ? ? ? ? ? ? 2.043 ? disulf5 disulf ? ? C CYS 136 SG ? ? ? 1_555 C CYS 186 SG ? ? C CYS 139 C CYS 189 1_555 ? ? ? ? ? ? ? 2.042 ? disulf6 disulf ? ? C CYS 161 SG ? ? ? 1_555 D CYS 171 SG ? ? C CYS 164 D CYS 174 1_555 ? ? ? ? ? ? ? 2.040 ? disulf7 disulf ? ? D CYS 23 SG ? ? ? 1_555 D CYS 91 SG ? ? D CYS 23 D CYS 92 1_555 ? ? ? ? ? ? ? 2.029 ? disulf8 disulf ? ? D CYS 145 SG ? ? ? 1_555 D CYS 210 SG ? ? D CYS 148 D CYS 213 1_555 ? ? ? ? ? ? ? 2.033 ? covale1 covale ? ? A ASN 165 ND2 ? ? ? 1_555 I NAG . C1 ? ? A ASN 165 A NAG 501 1_555 ? ? ? ? ? ? ? 1.442 ? covale2 covale ? ? G NAG . O4 ? ? ? 1_555 H NAG . C1 ? ? A NAG 314 A NAG 315 1_555 ? ? ? ? ? ? ? 1.443 ? covale3 covale ? ? A ASN 20 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 20 A NAG 400 1_555 ? ? ? ? ? ? ? 1.443 ? covale4 covale ? ? I NAG . O4 ? ? ? 1_555 J NAG . C1 ? ? A NAG 501 A NAG 502 1_555 ? ? ? ? ? ? ? 1.445 ? covale5 covale ? ? A ASN 110 ND2 ? ? ? 1_555 L NAG . C1 ? ? A ASN 110 A NAG 551 1_555 ? ? ? ? ? ? ? 1.445 ? covale6 covale ? ? A ASN 42 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 42 A NAG 314 1_555 ? ? ? ? ? ? ? 1.446 ? covale7 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 400 A NAG 401 1_555 ? ? ? ? ? ? ? 1.456 ? # 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 5.37 2 PRO 108 A . ? PRO 108 A GLY 109 A ? GLY 109 A 1 -0.59 3 TYR 214 A . ? TYR 214 A PRO 215 A ? PRO 215 A 1 -0.57 4 ARG 296 A . ? ARG 296 A HIS 297 A ? HIS 297 A 1 -5.54 5 HIS 31 B . ? HIS 31 B PRO 32 B ? PRO 32 B 1 1.17 6 SER 6 C . ? SER 6 C PRO 7 C ? PRO 7 C 1 0.56 7 THR 27 C . ? THR 27 C PRO 28 C ? PRO 28 C 1 0.03 8 SER 7 D . ? SER 7 D PRO 8 D ? PRO 8 D 1 -1.75 9 TYR 151 D . ? TYR 154 D PRO 152 D ? PRO 155 D 1 -0.46 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 8 ? B ? 4 ? C ? 4 ? D ? 4 ? E ? 4 ? F ? 4 ? G ? 4 ? H ? 5 ? I ? 5 ? J ? 4 ? K ? 8 ? L ? 8 ? M ? 4 ? N ? 6 ? O ? 4 ? P ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? anti-parallel A 6 7 ? anti-parallel A 7 8 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel G 3 4 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel H 4 5 ? anti-parallel I 1 2 ? parallel 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 K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel K 4 5 ? anti-parallel K 5 6 ? anti-parallel K 6 7 ? anti-parallel K 7 8 ? 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 N 1 2 ? parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel N 4 5 ? anti-parallel N 5 6 ? anti-parallel O 1 2 ? parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel P 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 SER A 48 ? PHE A 49 ? SER A 48 PHE A 49 A 2 LEU A 35 ? TRP A 40 ? LEU A 35 TRP A 40 A 3 TRP A 23 ? LEU A 32 ? TRP A 23 LEU A 32 A 4 TYR A 8 ? ASN A 20 ? TYR A 8 ASN A 20 A 5 ILE A 96 ? TYR A 107 ? ILE A 96 TYR A 107 A 6 ALA A 111 ? PHE A 120 ? ALA A 111 PHE A 120 A 7 LYS A 123 ? TRP A 129 ? LYS A 123 TRP A 129 A 8 SER A 132 ? THR A 135 ? SER A 132 THR A 135 B 1 VAL A 190 ? PRO A 197 ? VAL A 190 PRO A 197 B 2 HIS A 203 ? PHE A 213 ? HIS A 203 PHE A 213 B 3 TRP A 245 ? GLU A 254 ? TRP A 245 GLU A 254 B 4 HIS A 233 ? ARG A 234 ? HIS A 233 ARG A 234 C 1 VAL A 190 ? PRO A 197 ? VAL A 190 PRO A 197 C 2 HIS A 203 ? PHE A 213 ? HIS A 203 PHE A 213 C 3 TRP A 245 ? GLU A 254 ? TRP A 245 GLU A 254 C 4 LEU A 238 ? PRO A 239 ? LEU A 238 PRO A 239 D 1 GLN A 227 ? GLU A 228 ? GLN A 227 GLU A 228 D 2 TRP A 219 ? ARG A 224 ? TRP A 219 ARG A 224 D 3 ALA A 262 ? LYS A 266 ? ALA A 262 LYS A 266 D 4 ILE A 275 ? TYR A 278 ? ILE A 275 TYR A 278 E 1 GLN B 6 ? SER B 11 ? GLN B 6 SER B 11 E 2 ASN B 21 ? PHE B 30 ? ASN B 21 PHE B 30 E 3 PHE B 62 ? PHE B 70 ? PHE B 62 PHE B 70 E 4 GLU B 50 ? MET B 51 ? GLU B 50 MET B 51 F 1 GLN B 6 ? SER B 11 ? GLN B 6 SER B 11 F 2 ASN B 21 ? PHE B 30 ? ASN B 21 PHE B 30 F 3 PHE B 62 ? PHE B 70 ? PHE B 62 PHE B 70 F 4 SER B 55 ? PHE B 56 ? SER B 55 PHE B 56 G 1 LYS B 44 ? LYS B 45 ? LYS B 44 LYS B 45 G 2 GLU B 36 ? LYS B 41 ? GLU B 36 LYS B 41 G 3 TYR B 78 ? LYS B 83 ? TYR B 78 LYS B 83 G 4 LYS B 91 ? TYR B 94 ? LYS B 91 TYR B 94 H 1 VAL C 3 ? SER C 6 ? VAL C 3 SER C 6 H 2 SER C 18 ? TYR C 24 ? SER C 18 TYR C 24 H 3 HIS C 71 ? ILE C 76 ? HIS C 72 ILE C 77 H 4 TYR C 61 ? ASP C 66 ? TYR C 62 ASP C 67 H 5 LYS C 53 ? ASN C 58 ? LYS C 53 ASN C 58 I 1 SER C 9 ? ARG C 13 ? SER C 9 ARG C 13 I 2 THR C 107 ? ILE C 112 ? THR C 110 ILE C 115 I 3 ALA C 85 ? GLY C 92 ? ALA C 86 GLY C 93 I 4 HIS C 31 ? GLN C 37 ? HIS C 31 GLN C 37 I 5 LEU C 43 ? LEU C 49 ? LEU C 43 LEU C 49 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 ALA C 85 ? GLY C 92 ? ALA C 86 GLY C 93 J 4 LEU C 101 ? PHE C 103 ? LEU C 104 PHE C 106 K 1 VAL C 155 ? ILE C 157 ? VAL C 158 ILE C 160 K 2 PHE C 170 ? SER C 179 ? PHE C 173 SER C 182 K 3 SER C 134 ? THR C 139 ? SER C 137 THR C 142 K 4 ALA C 121 ? ASP C 127 ? ALA C 124 ASP C 130 K 5 GLU D 124 ? GLU D 129 ? GLU D 127 GLU D 132 K 6 LYS D 140 ? PHE D 150 ? LYS D 143 PHE D 153 K 7 TYR D 188 ? SER D 197 ? TYR D 191 SER D 200 K 8 VAL D 170 ? THR D 172 ? VAL D 173 THR D 175 L 1 CYS C 161 ? MET C 165 ? CYS C 164 MET C 168 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 LEU D 177 ? LYS D 178 ? LEU D 180 LYS D 181 M 1 VAL D 4 ? SER D 7 ? VAL D 4 SER D 7 M 2 VAL D 19 ? GLN D 25 ? VAL D 19 GLN D 25 M 3 SER D 75 ? LEU D 78 ? SER D 76 LEU D 79 M 4 LYS D 65 ? SER D 67 ? LYS D 66 SER D 68 N 1 ASN D 10 ? VAL D 14 ? ASN D 10 VAL D 14 N 2 THR D 109 ? LEU D 114 ? THR D 112 LEU D 117 N 3 SER D 87 ? GLY D 94 ? SER D 88 GLY D 95 N 4 ASN D 31 ? GLN D 37 ? ASN D 31 GLN D 37 N 5 ARG D 44 ? SER D 49 ? ARG D 44 SER D 49 N 6 GLU D 56 ? LYS D 57 ? GLU D 56 LYS D 57 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 PHE D 104 ? PHE D 105 ? PHE D 107 PHE D 108 P 1 LYS D 164 ? VAL D 166 ? LYS D 167 VAL D 169 P 2 VAL D 155 ? VAL D 161 ? VAL D 158 VAL D 164 P 3 HIS D 207 ? PHE D 214 ? HIS D 210 PHE D 217 P 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 LEU A 35 ? O LEU A 35 N LEU A 32 ? N LEU A 32 A 3 4 O VAL A 29 ? O VAL A 29 N LEU A 13 ? N LEU A 13 A 4 5 N CYS A 12 ? N CYS A 12 O ALA A 102 ? O ALA A 102 A 5 6 N SER A 101 ? N SER A 101 O HIS A 117 ? O HIS A 117 A 6 7 N PHE A 120 ? N PHE A 120 O LYS A 123 ? O LYS A 123 A 7 8 N ARG A 127 ? N ARG A 127 O GLN A 134 ? O GLN A 134 B 1 2 N VAL A 190 ? N VAL A 190 O SER A 211 ? O SER A 211 B 2 3 N ARG A 204 ? N ARG A 204 O VAL A 253 ? O VAL A 253 B 3 4 O THR A 250 ? O THR A 250 N HIS A 233 ? N HIS A 233 C 1 2 N VAL A 190 ? N VAL A 190 O SER A 211 ? O SER A 211 C 2 3 N ARG A 204 ? N ARG A 204 O VAL A 253 ? O VAL A 253 C 3 4 O TYR A 246 ? O TYR A 246 N LEU A 238 ? N LEU A 238 D 1 2 O GLN A 227 ? O GLN A 227 N ARG A 224 ? N ARG A 224 D 2 3 N MET A 223 ? N MET A 223 O ALA A 262 ? O ALA A 262 D 3 4 N CYS A 263 ? N CYS A 263 O LEU A 277 ? O LEU A 277 E 1 2 N TYR B 10 ? N TYR B 10 O ASN B 24 ? O ASN B 24 E 2 3 N CYS B 25 ? N CYS B 25 O ALA B 66 ? O ALA B 66 E 3 4 O HIS B 67 ? O HIS B 67 N GLU B 50 ? N GLU B 50 F 1 2 N TYR B 10 ? N TYR B 10 O ASN B 24 ? O ASN B 24 F 2 3 N CYS B 25 ? N CYS B 25 O ALA B 66 ? O ALA B 66 F 3 4 O TYR B 63 ? O TYR B 63 N SER B 55 ? N SER B 55 G 1 2 O LYS B 44 ? O LYS B 44 N LYS B 41 ? N LYS B 41 G 2 3 N GLN B 38 ? N GLN B 38 O ARG B 81 ? O ARG B 81 G 3 4 N VAL B 82 ? N VAL B 82 O LYS B 91 ? O LYS B 91 H 1 2 N GLU C 4 ? N GLU C 4 O ASN C 23 ? O ASN C 23 H 2 3 N LEU C 20 ? N LEU C 20 O LEU C 74 ? O LEU C 75 H 3 4 O HIS C 75 ? O HIS C 76 N SER C 62 ? N SER C 63 H 4 5 O TYR C 61 ? O TYR C 62 N ASN C 58 ? N ASN C 58 I 1 2 N LEU C 10 ? N LEU C 10 O ILE C 110 ? O ILE C 113 I 2 3 O THR C 107 ? O THR C 110 N TYR C 87 ? N TYR C 88 I 3 4 O VAL C 90 ? O VAL C 91 N ARG C 33 ? N ARG C 33 I 4 5 N LEU C 32 ? N LEU C 32 O LEU C 49 ? O LEU C 49 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 N VAL C 91 ? N VAL C 92 O HIS C 102 ? O HIS C 105 K 1 2 N TYR C 156 ? N TYR C 159 O TRP C 178 ? O TRP C 181 K 2 3 O ALA C 177 ? O ALA C 180 N CYS C 136 ? N CYS C 139 K 3 4 O LEU C 137 ? O LEU C 140 N TYR C 123 ? N TYR C 126 K 4 5 N ARG C 126 ? N ARG C 129 O GLU D 129 ? O GLU D 132 K 5 6 N PHE D 128 ? N PHE D 131 O VAL D 144 ? O VAL D 147 K 6 7 N ALA D 147 ? N ALA D 150 O LEU D 190 ? O LEU D 193 K 7 8 O ARG D 193 ? O ARG D 196 N CYS D 171 ? N CYS D 174 L 1 2 N MET C 165 ? N MET C 168 O PHE C 170 ? O PHE C 173 L 2 3 O ALA C 177 ? O ALA C 180 N CYS C 136 ? N CYS C 139 L 3 4 O LEU C 137 ? O LEU C 140 N TYR C 123 ? N TYR C 126 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 ALA D 147 ? N ALA D 150 O LEU D 190 ? O LEU D 193 L 7 8 O ALA D 189 ? O ALA D 192 N LEU D 177 ? N LEU D 180 M 1 2 N SER D 7 ? N SER D 7 O SER D 22 ? O SER D 22 M 2 3 N VAL D 19 ? N VAL D 19 O LEU D 78 ? O LEU D 79 M 3 4 O ILE D 77 ? O ILE D 78 N LYS D 65 ? N LYS D 66 N 1 2 N ALA D 13 ? N ALA D 13 O THR D 112 ? O THR D 115 N 2 3 O THR D 109 ? O THR D 112 N TYR D 89 ? N TYR D 90 N 3 4 O PHE D 90 ? O PHE D 91 N TYR D 35 ? N TYR D 35 N 4 5 N TRP D 34 ? N TRP D 34 O ILE D 46 ? O ILE D 46 N 5 6 N TYR D 48 ? N TYR D 48 O GLU D 56 ? O GLU D 56 O 1 2 N ALA D 13 ? N ALA D 13 O THR D 112 ? O THR D 115 O 2 3 O THR D 109 ? O THR D 112 N TYR D 89 ? N TYR D 90 O 3 4 N SER D 93 ? N SER D 94 O PHE D 104 ? O PHE D 107 P 1 2 O LYS D 164 ? O LYS D 167 N VAL D 161 ? N VAL D 164 P 2 3 N SER D 158 ? N SER D 161 O GLN D 211 ? O GLN D 214 P 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 ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 314' AC4 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 315' AC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 501' AC6 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 502' AC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE PEG A 303' AC8 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 551' AC9 Software ? ? ? ? 15 'BINDING SITE FOR RESIDUE FEE A 601' BC1 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE D12 A 611' BC2 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE PEG B 100' # 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 4 TRP A 23 ? TRP A 23 . ? 1_555 ? 6 AC3 4 SER A 24 ? SER A 24 . ? 1_555 ? 7 AC3 4 ASN A 42 ? ASN A 42 . ? 1_555 ? 8 AC3 4 NAG H . ? NAG A 315 . ? 1_555 ? 9 AC4 1 NAG G . ? NAG A 314 . ? 1_555 ? 10 AC5 4 GLN A 161 ? GLN A 161 . ? 1_555 ? 11 AC5 4 ASN A 165 ? ASN A 165 . ? 1_555 ? 12 AC5 4 HOH P . ? HOH A 320 . ? 1_555 ? 13 AC5 4 NAG J . ? NAG A 502 . ? 1_555 ? 14 AC6 2 TRP A 129 ? TRP A 129 . ? 1_555 ? 15 AC6 2 NAG I . ? NAG A 501 . ? 1_555 ? 16 AC7 3 LYS A 185 ? LYS A 185 . ? 1_555 ? 17 AC7 3 ASP A 242 ? ASP A 242 . ? 1_555 ? 18 AC7 3 GLU A 243 ? GLU A 243 . ? 1_555 ? 19 AC8 1 ASN A 110 ? ASN A 110 . ? 1_555 ? 20 AC9 15 GLN A 14 ? GLN A 14 . ? 1_555 ? 21 AC9 15 PHE A 70 ? PHE A 70 . ? 1_555 ? 22 AC9 15 VAL A 72 ? VAL A 72 . ? 1_555 ? 23 AC9 15 TYR A 73 ? TYR A 73 . ? 1_555 ? 24 AC9 15 SER A 76 ? SER A 76 . ? 1_555 ? 25 AC9 15 ASP A 80 ? ASP A 80 . ? 1_555 ? 26 AC9 15 TRP A 133 ? TRP A 133 . ? 1_555 ? 27 AC9 15 ASP A 153 ? ASP A 153 . ? 1_555 ? 28 AC9 15 GLY A 155 ? GLY A 155 . ? 1_555 ? 29 AC9 15 THR A 156 ? THR A 156 . ? 1_555 ? 30 AC9 15 HOH P . ? HOH A 310 . ? 1_555 ? 31 AC9 15 PRO C 28 ? PRO C 28 . ? 1_555 ? 32 AC9 15 ASN C 30 ? ASN C 30 . ? 1_555 ? 33 AC9 15 ARG C 94 ? ARG C 95 . ? 1_555 ? 34 AC9 15 GLY C 95 ? GLY C 96 . ? 1_555 ? 35 BC1 1 MET A 88 ? MET A 88 . ? 1_555 ? 36 BC2 6 ARG A 11 ? ARG A 11 . ? 1_555 ? 37 BC2 6 SER A 101 ? SER A 101 . ? 1_555 ? 38 BC2 6 PHE B 56 ? PHE B 56 . ? 1_555 ? 39 BC2 6 SER B 57 ? SER B 57 . ? 1_555 ? 40 BC2 6 LYS B 58 ? LYS B 58 . ? 1_555 ? 41 BC2 6 TRP B 60 ? TRP B 60 . ? 1_555 ? # _database_PDB_matrix.entry_id 3ARB _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 3ARB _atom_sites.fract_transf_matrix[1][1] 0.016938 _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] 0.011454 _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] 0.004244 _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 . LYS A 1 6 ? -35.777 -48.983 -87.777 1.00 92.95 ? 6 LYS A N 1 ATOM 2 C CA . LYS A 1 6 ? -35.955 -47.666 -87.094 1.00 92.34 ? 6 LYS A CA 1 ATOM 3 C C . LYS A 1 6 ? -35.002 -47.505 -85.906 1.00 88.47 ? 6 LYS A C 1 ATOM 4 O O . LYS A 1 6 ? -34.938 -46.436 -85.295 1.00 87.68 ? 6 LYS A O 1 ATOM 5 C CB . LYS A 1 6 ? -37.412 -47.486 -86.644 1.00 96.58 ? 6 LYS A CB 1 ATOM 6 C CG . LYS A 1 6 ? -38.423 -47.441 -87.786 1.00 100.96 ? 6 LYS A CG 1 ATOM 7 C CD . LYS A 1 6 ? -39.845 -47.260 -87.272 1.00 105.60 ? 6 LYS A CD 1 ATOM 8 N N . ASN A 1 7 ? -34.262 -48.568 -85.594 1.00 86.38 ? 7 ASN A N 1 ATOM 9 C CA . ASN A 1 7 ? -33.325 -48.580 -84.466 1.00 82.85 ? 7 ASN A CA 1 ATOM 10 C C . ASN A 1 7 ? -32.001 -47.898 -84.808 1.00 79.06 ? 7 ASN A C 1 ATOM 11 O O . ASN A 1 7 ? -31.513 -48.014 -85.934 1.00 78.67 ? 7 ASN A O 1 ATOM 12 C CB . ASN A 1 7 ? -33.062 -50.018 -83.996 1.00 82.59 ? 7 ASN A CB 1 ATOM 13 C CG . ASN A 1 7 ? -34.346 -50.809 -83.737 1.00 86.87 ? 7 ASN A CG 1 ATOM 14 O OD1 . ASN A 1 7 ? -35.458 -50.278 -83.814 1.00 90.19 ? 7 ASN A OD1 1 ATOM 15 N ND2 . ASN A 1 7 ? -34.190 -52.092 -83.428 1.00 87.26 ? 7 ASN A ND2 1 ATOM 16 N N . TYR A 1 8 ? -31.425 -47.194 -83.835 1.00 76.51 ? 8 TYR A N 1 ATOM 17 C CA . TYR A 1 8 ? -30.132 -46.528 -84.015 1.00 73.05 ? 8 TYR A CA 1 ATOM 18 C C . TYR A 1 8 ? -29.091 -47.016 -83.009 1.00 69.92 ? 8 TYR A C 1 ATOM 19 O O . TYR A 1 8 ? -29.337 -47.019 -81.800 1.00 69.93 ? 8 TYR A O 1 ATOM 20 C CB . TYR A 1 8 ? -30.281 -45.005 -83.926 1.00 73.30 ? 8 TYR A CB 1 ATOM 21 C CG . TYR A 1 8 ? -30.856 -44.362 -85.170 1.00 75.75 ? 8 TYR A CG 1 ATOM 22 C CD1 . TYR A 1 8 ? -30.047 -44.090 -86.275 1.00 74.90 ? 8 TYR A CD1 1 ATOM 23 C CD2 . TYR A 1 8 ? -32.207 -44.018 -85.242 1.00 79.41 ? 8 TYR A CD2 1 ATOM 24 C CE1 . TYR A 1 8 ? -30.570 -43.498 -87.422 1.00 77.40 ? 8 TYR A CE1 1 ATOM 25 C CE2 . TYR A 1 8 ? -32.740 -43.422 -86.384 1.00 81.85 ? 8 TYR A CE2 1 ATOM 26 C CZ . TYR A 1 8 ? -31.916 -43.167 -87.471 1.00 80.76 ? 8 TYR A CZ 1 ATOM 27 O OH . TYR A 1 8 ? -32.436 -42.580 -88.603 1.00 83.00 ? 8 TYR A OH 1 ATOM 28 N N . THR A 1 9 ? -27.932 -47.427 -83.519 1.00 67.37 ? 9 THR A N 1 ATOM 29 C CA . THR A 1 9 ? -26.842 -47.909 -82.674 1.00 64.40 ? 9 THR A CA 1 ATOM 30 C C . THR A 1 9 ? -25.780 -46.828 -82.495 1.00 61.96 ? 9 THR A C 1 ATOM 31 O O . THR A 1 9 ? -25.267 -46.271 -83.468 1.00 61.54 ? 9 THR A O 1 ATOM 32 C CB . THR A 1 9 ? -26.201 -49.202 -83.236 1.00 63.88 ? 9 THR A CB 1 ATOM 33 O OG1 . THR A 1 9 ? -27.228 -50.142 -83.571 1.00 66.46 ? 9 THR A OG1 1 ATOM 34 C CG2 . THR A 1 9 ? -25.263 -49.836 -82.214 1.00 61.74 ? 9 THR A CG2 1 ATOM 35 N N . PHE A 1 10 ? -25.472 -46.537 -81.235 1.00 60.49 ? 10 PHE A N 1 ATOM 36 C CA . PHE A 1 10 ? -24.458 -45.559 -80.871 1.00 58.38 ? 10 PHE A CA 1 ATOM 37 C C . PHE A 1 10 ? -23.229 -46.300 -80.356 1.00 56.45 ? 10 PHE A C 1 ATOM 38 O O . PHE A 1 10 ? -23.336 -47.139 -79.459 1.00 56.42 ? 10 PHE A O 1 ATOM 39 C CB . PHE A 1 10 ? -25.021 -44.620 -79.802 1.00 58.81 ? 10 PHE A CB 1 ATOM 40 C CG . PHE A 1 10 ? -24.027 -43.634 -79.259 1.00 56.64 ? 10 PHE A CG 1 ATOM 41 C CD1 . PHE A 1 10 ? -23.806 -42.423 -79.904 1.00 56.16 ? 10 PHE A CD1 1 ATOM 42 C CD2 . PHE A 1 10 ? -23.333 -43.905 -78.085 1.00 54.76 ? 10 PHE A CD2 1 ATOM 43 C CE1 . PHE A 1 10 ? -22.897 -41.505 -79.396 1.00 54.87 ? 10 PHE A CE1 1 ATOM 44 C CE2 . PHE A 1 10 ? -22.419 -42.993 -77.569 1.00 53.46 ? 10 PHE A CE2 1 ATOM 45 C CZ . PHE A 1 10 ? -22.203 -41.790 -78.224 1.00 53.66 ? 10 PHE A CZ 1 ATOM 46 N N . ARG A 1 11 ? -22.063 -46.001 -80.920 1.00 55.18 ? 11 ARG A N 1 ATOM 47 C CA . ARG A 1 11 ? -20.853 -46.716 -80.523 1.00 53.77 ? 11 ARG A CA 1 ATOM 48 C C . ARG A 1 11 ? -19.604 -45.859 -80.359 1.00 52.44 ? 11 ARG A C 1 ATOM 49 O O . ARG A 1 11 ? -19.239 -45.085 -81.245 1.00 52.72 ? 11 ARG A O 1 ATOM 50 C CB . ARG A 1 11 ? -20.591 -47.917 -81.442 1.00 54.01 ? 11 ARG A CB 1 ATOM 51 C CG . ARG A 1 11 ? -20.437 -47.603 -82.926 1.00 55.43 ? 11 ARG A CG 1 ATOM 52 C CD . ARG A 1 11 ? -21.155 -48.644 -83.801 1.00 58.56 ? 11 ARG A CD 1 ATOM 53 N NE . ARG A 1 11 ? -21.172 -49.979 -83.198 1.00 59.48 ? 11 ARG A NE 1 ATOM 54 C CZ . ARG A 1 11 ? -21.899 -51.005 -83.640 1.00 61.96 ? 11 ARG A CZ 1 ATOM 55 N NH1 . ARG A 1 11 ? -22.683 -50.876 -84.707 1.00 63.39 ? 11 ARG A NH1 1 ATOM 56 N NH2 . ARG A 1 11 ? -21.838 -52.171 -83.011 1.00 62.80 ? 11 ARG A NH2 1 ATOM 57 N N . CYS A 1 12 ? -18.972 -46.003 -79.198 1.00 51.34 ? 12 CYS A N 1 ATOM 58 C CA . CYS A 1 12 ? -17.662 -45.430 -78.931 1.00 50.30 ? 12 CYS A CA 1 ATOM 59 C C . CYS A 1 12 ? -16.611 -46.517 -79.136 1.00 49.29 ? 12 CYS A C 1 ATOM 60 O O . CYS A 1 12 ? -16.628 -47.550 -78.460 1.00 48.90 ? 12 CYS A O 1 ATOM 61 C CB . CYS A 1 12 ? -17.595 -44.875 -77.509 1.00 50.01 ? 12 CYS A CB 1 ATOM 62 S SG . CYS A 1 12 ? -18.874 -43.652 -77.139 1.00 52.41 ? 12 CYS A SG 1 ATOM 63 N N . LEU A 1 13 ? -15.713 -46.281 -80.089 1.00 49.00 ? 13 LEU A N 1 ATOM 64 C CA . LEU A 1 13 ? -14.695 -47.257 -80.454 1.00 48.49 ? 13 LEU A CA 1 ATOM 65 C C . LEU A 1 13 ? -13.307 -46.751 -80.103 1.00 48.09 ? 13 LEU A C 1 ATOM 66 O O . LEU A 1 13 ? -12.844 -45.753 -80.655 1.00 48.67 ? 13 LEU A O 1 ATOM 67 C CB . LEU A 1 13 ? -14.779 -47.602 -81.943 1.00 49.16 ? 13 LEU A CB 1 ATOM 68 C CG . LEU A 1 13 ? -16.095 -48.189 -82.461 1.00 49.76 ? 13 LEU A CG 1 ATOM 69 C CD1 . LEU A 1 13 ? -15.999 -48.458 -83.953 1.00 50.78 ? 13 LEU A CD1 1 ATOM 70 C CD2 . LEU A 1 13 ? -16.480 -49.457 -81.711 1.00 49.33 ? 13 LEU A CD2 1 ATOM 71 N N . GLN A 1 14 ? -12.655 -47.449 -79.177 1.00 47.47 ? 14 GLN A N 1 ATOM 72 C CA . GLN A 1 14 ? -11.326 -47.085 -78.706 1.00 47.20 ? 14 GLN A CA 1 ATOM 73 C C . GLN A 1 14 ? -10.296 -48.125 -79.139 1.00 47.35 ? 14 GLN A C 1 ATOM 74 O O . GLN A 1 14 ? -10.512 -49.328 -78.980 1.00 47.14 ? 14 GLN A O 1 ATOM 75 C CB . GLN A 1 14 ? -11.335 -46.947 -77.182 1.00 46.81 ? 14 GLN A CB 1 ATOM 76 C CG . GLN A 1 14 ? -9.980 -46.646 -76.557 1.00 47.45 ? 14 GLN A CG 1 ATOM 77 C CD . GLN A 1 14 ? -9.986 -46.788 -75.045 1.00 48.09 ? 14 GLN A CD 1 ATOM 78 O OE1 . GLN A 1 14 ? -10.896 -46.311 -74.363 1.00 48.15 ? 14 GLN A OE1 1 ATOM 79 N NE2 . GLN A 1 14 ? -8.957 -47.438 -74.512 1.00 48.61 ? 14 GLN A NE2 1 ATOM 80 N N . MET A 1 15 ? -9.183 -47.650 -79.693 1.00 47.87 ? 15 MET A N 1 ATOM 81 C CA . MET A 1 15 ? -8.064 -48.516 -80.050 1.00 48.51 ? 15 MET A CA 1 ATOM 82 C C . MET A 1 15 ? -6.774 -48.046 -79.376 1.00 48.88 ? 15 MET A C 1 ATOM 83 O O . MET A 1 15 ? -6.330 -46.911 -79.574 1.00 49.45 ? 15 MET A O 1 ATOM 84 C CB . MET A 1 15 ? -7.917 -48.637 -81.577 1.00 49.52 ? 15 MET A CB 1 ATOM 85 C CG . MET A 1 15 ? -7.669 -47.331 -82.315 1.00 50.68 ? 15 MET A CG 1 ATOM 86 S SD . MET A 1 15 ? -8.671 -47.183 -83.801 1.00 52.67 ? 15 MET A SD 1 ATOM 87 C CE . MET A 1 15 ? -10.126 -46.363 -83.150 1.00 51.04 ? 15 MET A CE 1 ATOM 88 N N . SER A 1 16 ? -6.194 -48.922 -78.560 1.00 48.76 ? 16 SER A N 1 ATOM 89 C CA . SER A 1 16 ? -4.984 -48.597 -77.813 1.00 49.47 ? 16 SER A CA 1 ATOM 90 C C . SER A 1 16 ? -3.816 -49.497 -78.202 1.00 50.85 ? 16 SER A C 1 ATOM 91 O O . SER A 1 16 ? -3.944 -50.725 -78.222 1.00 50.75 ? 16 SER A O 1 ATOM 92 C CB . SER A 1 16 ? -5.242 -48.668 -76.305 1.00 48.74 ? 16 SER A CB 1 ATOM 93 O OG . SER A 1 16 ? -6.089 -47.613 -75.878 1.00 47.91 ? 16 SER A OG 1 ATOM 94 N N . SER A 1 17 ? -2.682 -48.874 -78.512 1.00 52.36 ? 17 SER A N 1 ATOM 95 C CA . SER A 1 17 ? -1.475 -49.599 -78.898 1.00 54.35 ? 17 SER A CA 1 ATOM 96 C C . SER A 1 17 ? -0.381 -49.478 -77.842 1.00 55.54 ? 17 SER A C 1 ATOM 97 O O . SER A 1 17 ? -0.074 -48.383 -77.375 1.00 55.93 ? 17 SER A O 1 ATOM 98 C CB . SER A 1 17 ? -0.954 -49.097 -80.245 1.00 55.90 ? 17 SER A CB 1 ATOM 99 O OG . SER A 1 17 ? -1.947 -49.207 -81.247 1.00 55.32 ? 17 SER A OG 1 ATOM 100 N N . PHE A 1 18 ? 0.193 -50.617 -77.468 1.00 56.43 ? 18 PHE A N 1 ATOM 101 C CA . PHE A 1 18 ? 1.320 -50.667 -76.543 1.00 58.07 ? 18 PHE A CA 1 ATOM 102 C C . PHE A 1 18 ? 2.428 -51.471 -77.211 1.00 60.66 ? 18 PHE A C 1 ATOM 103 O O . PHE A 1 18 ? 2.345 -52.696 -77.294 1.00 60.75 ? 18 PHE A O 1 ATOM 104 C CB . PHE A 1 18 ? 0.906 -51.309 -75.211 1.00 56.81 ? 18 PHE A CB 1 ATOM 105 C CG . PHE A 1 18 ? -0.221 -50.594 -74.512 1.00 54.74 ? 18 PHE A CG 1 ATOM 106 C CD1 . PHE A 1 18 ? -1.549 -50.891 -74.812 1.00 52.96 ? 18 PHE A CD1 1 ATOM 107 C CD2 . PHE A 1 18 ? 0.044 -49.625 -73.550 1.00 55.02 ? 18 PHE A CD2 1 ATOM 108 C CE1 . PHE A 1 18 ? -2.596 -50.227 -74.174 1.00 51.17 ? 18 PHE A CE1 1 ATOM 109 C CE2 . PHE A 1 18 ? -0.993 -48.956 -72.904 1.00 53.38 ? 18 PHE A CE2 1 ATOM 110 C CZ . PHE A 1 18 ? -2.317 -49.259 -73.217 1.00 51.76 ? 18 PHE A CZ 1 ATOM 111 N N . ALA A 1 19 ? 3.447 -50.776 -77.713 1.00 63.18 ? 19 ALA A N 1 ATOM 112 C CA . ALA A 1 19 ? 4.538 -51.423 -78.446 1.00 66.32 ? 19 ALA A CA 1 ATOM 113 C C . ALA A 1 19 ? 5.569 -52.028 -77.505 1.00 68.47 ? 19 ALA A C 1 ATOM 114 O O . ALA A 1 19 ? 6.148 -53.075 -77.800 1.00 70.24 ? 19 ALA A O 1 ATOM 115 C CB . ALA A 1 19 ? 5.201 -50.444 -79.400 1.00 68.39 ? 19 ALA A CB 1 ATOM 116 N N . ASN A 1 20 ? 5.797 -51.346 -76.383 1.00 68.74 ? 20 ASN A N 1 ATOM 117 C CA . ASN A 1 20 ? 6.711 -51.802 -75.331 1.00 70.92 ? 20 ASN A CA 1 ATOM 118 C C . ASN A 1 20 ? 6.386 -51.132 -73.995 1.00 69.51 ? 20 ASN A C 1 ATOM 119 O O . ASN A 1 20 ? 5.270 -50.647 -73.801 1.00 66.97 ? 20 ASN A O 1 ATOM 120 C CB . ASN A 1 20 ? 8.182 -51.592 -75.729 1.00 75.09 ? 20 ASN A CB 1 ATOM 121 C CG . ASN A 1 20 ? 8.447 -50.212 -76.311 1.00 77.40 ? 20 ASN A CG 1 ATOM 122 O OD1 . ASN A 1 20 ? 8.090 -49.191 -75.715 1.00 76.68 ? 20 ASN A OD1 1 ATOM 123 N ND2 . ASN A 1 20 ? 9.084 -50.181 -77.484 1.00 81.66 ? 20 ASN A ND2 1 ATOM 124 N N . ARG A 1 21 ? 7.354 -51.103 -73.080 1.00 71.49 ? 21 ARG A N 1 ATOM 125 C CA . ARG A 1 21 ? 7.116 -50.597 -71.725 1.00 70.47 ? 21 ARG A CA 1 ATOM 126 C C . ARG A 1 21 ? 6.921 -49.082 -71.654 1.00 69.86 ? 21 ARG A C 1 ATOM 127 O O . ARG A 1 21 ? 6.257 -48.582 -70.745 1.00 68.32 ? 21 ARG A O 1 ATOM 128 C CB . ARG A 1 21 ? 8.233 -51.037 -70.773 1.00 73.38 ? 21 ARG A CB 1 ATOM 129 C CG . ARG A 1 21 ? 8.370 -52.546 -70.639 1.00 74.30 ? 21 ARG A CG 1 ATOM 130 C CD . ARG A 1 21 ? 8.702 -52.960 -69.208 1.00 76.16 ? 21 ARG A CD 1 ATOM 131 N NE . ARG A 1 21 ? 8.794 -54.415 -69.061 0.70 77.16 ? 21 ARG A NE 1 ATOM 132 C CZ . ARG A 1 21 ? 7.752 -55.240 -68.974 0.70 74.79 ? 21 ARG A CZ 1 ATOM 133 N NH1 . ARG A 1 21 ? 6.510 -54.772 -69.024 0.70 71.51 ? 21 ARG A NH1 1 ATOM 134 N NH2 . ARG A 1 21 ? 7.952 -56.545 -68.841 0.70 75.83 ? 21 ARG A NH2 1 ATOM 135 N N . SER A 1 22 ? 7.484 -48.364 -72.624 1.00 71.14 ? 22 SER A N 1 ATOM 136 C CA . SER A 1 22 ? 7.474 -46.900 -72.618 1.00 71.26 ? 22 SER A CA 1 ATOM 137 C C . SER A 1 22 ? 6.874 -46.272 -73.886 1.00 69.84 ? 22 SER A C 1 ATOM 138 O O . SER A 1 22 ? 7.219 -45.141 -74.248 1.00 71.48 ? 22 SER A O 1 ATOM 139 C CB . SER A 1 22 ? 8.896 -46.377 -72.389 1.00 75.35 ? 22 SER A CB 1 ATOM 140 O OG . SER A 1 22 ? 9.788 -46.902 -73.358 1.00 77.68 ? 22 SER A OG 1 ATOM 141 N N . TRP A 1 23 ? 5.983 -47.000 -74.557 1.00 66.86 ? 23 TRP A N 1 ATOM 142 C CA . TRP A 1 23 ? 5.319 -46.486 -75.756 1.00 65.36 ? 23 TRP A CA 1 ATOM 143 C C . TRP A 1 23 ? 3.860 -46.916 -75.822 1.00 61.67 ? 23 TRP A C 1 ATOM 144 O O . TRP A 1 23 ? 3.537 -48.094 -75.660 1.00 60.51 ? 23 TRP A O 1 ATOM 145 C CB . TRP A 1 23 ? 6.054 -46.918 -77.029 1.00 67.37 ? 23 TRP A CB 1 ATOM 146 C CG . TRP A 1 23 ? 5.644 -46.143 -78.255 1.00 66.84 ? 23 TRP A CG 1 ATOM 147 C CD1 . TRP A 1 23 ? 6.261 -45.040 -78.770 1.00 69.07 ? 23 TRP A CD1 1 ATOM 148 C CD2 . TRP A 1 23 ? 4.527 -46.414 -79.115 1.00 64.25 ? 23 TRP A CD2 1 ATOM 149 N NE1 . TRP A 1 23 ? 5.603 -44.608 -79.897 1.00 68.05 ? 23 TRP A NE1 1 ATOM 150 C CE2 . TRP A 1 23 ? 4.534 -45.433 -80.130 1.00 65.26 ? 23 TRP A CE2 1 ATOM 151 C CE3 . TRP A 1 23 ? 3.519 -47.391 -79.125 1.00 61.33 ? 23 TRP A CE3 1 ATOM 152 C CZ2 . TRP A 1 23 ? 3.574 -45.399 -81.148 1.00 63.67 ? 23 TRP A CZ2 1 ATOM 153 C CZ3 . TRP A 1 23 ? 2.566 -47.356 -80.135 1.00 59.69 ? 23 TRP A CZ3 1 ATOM 154 C CH2 . TRP A 1 23 ? 2.601 -46.366 -81.132 1.00 60.83 ? 23 TRP A CH2 1 ATOM 155 N N . SER A 1 24 ? 2.987 -45.945 -76.074 1.00 60.05 ? 24 SER A N 1 ATOM 156 C CA . SER A 1 24 ? 1.552 -46.180 -76.145 1.00 56.90 ? 24 SER A CA 1 ATOM 157 C C . SER A 1 24 ? 0.838 -45.035 -76.843 1.00 56.21 ? 24 SER A C 1 ATOM 158 O O . SER A 1 24 ? 1.258 -43.881 -76.756 1.00 57.58 ? 24 SER A O 1 ATOM 159 C CB . SER A 1 24 ? 0.964 -46.364 -74.742 1.00 55.45 ? 24 SER A CB 1 ATOM 160 N N . ARG A 1 25 ? -0.239 -45.367 -77.545 1.00 54.32 ? 25 ARG A N 1 ATOM 161 C CA . ARG A 1 25 ? -1.159 -44.361 -78.061 1.00 53.56 ? 25 ARG A CA 1 ATOM 162 C C . ARG A 1 25 ? -2.596 -44.866 -77.997 1.00 51.15 ? 25 ARG A C 1 ATOM 163 O O . ARG A 1 25 ? -2.853 -46.057 -78.171 1.00 50.40 ? 25 ARG A O 1 ATOM 164 C CB . ARG A 1 25 ? -0.779 -43.916 -79.479 1.00 55.09 ? 25 ARG A CB 1 ATOM 165 C CG . ARG A 1 25 ? -0.876 -44.988 -80.551 1.00 55.29 ? 25 ARG A CG 1 ATOM 166 C CD . ARG A 1 25 ? -0.636 -44.412 -81.940 1.00 57.63 ? 25 ARG A CD 1 ATOM 167 N NE . ARG A 1 25 ? -1.581 -43.346 -82.267 1.00 57.38 ? 25 ARG A NE 1 ATOM 168 C CZ . ARG A 1 25 ? -1.242 -42.094 -82.566 1.00 59.19 ? 25 ARG A CZ 1 ATOM 169 N NH1 . ARG A 1 25 ? 0.035 -41.729 -82.601 1.00 61.56 ? 25 ARG A NH1 1 ATOM 170 N NH2 . ARG A 1 25 ? -2.188 -41.207 -82.842 1.00 58.76 ? 25 ARG A NH2 1 ATOM 171 N N . THR A 1 26 ? -3.520 -43.953 -77.720 1.00 50.33 ? 26 THR A N 1 ATOM 172 C CA . THR A 1 26 ? -4.940 -44.271 -77.668 1.00 48.61 ? 26 THR A CA 1 ATOM 173 C C . THR A 1 26 ? -5.696 -43.304 -78.564 1.00 48.67 ? 26 THR A C 1 ATOM 174 O O . THR A 1 26 ? -5.580 -42.088 -78.415 1.00 49.45 ? 26 THR A O 1 ATOM 175 C CB . THR A 1 26 ? -5.484 -44.231 -76.216 1.00 47.73 ? 26 THR A CB 1 ATOM 176 O OG1 . THR A 1 26 ? -4.945 -45.334 -75.479 1.00 47.84 ? 26 THR A OG1 1 ATOM 177 C CG2 . THR A 1 26 ? -7.005 -44.328 -76.184 1.00 46.63 ? 26 THR A CG2 1 ATOM 178 N N . ASP A 1 27 ? -6.450 -43.864 -79.506 1.00 48.14 ? 27 ASP A N 1 ATOM 179 C CA . ASP A 1 27 ? -7.277 -43.088 -80.420 1.00 48.41 ? 27 ASP A CA 1 ATOM 180 C C . ASP A 1 27 ? -8.698 -43.622 -80.385 1.00 47.09 ? 27 ASP A C 1 ATOM 181 O O . ASP A 1 27 ? -8.905 -44.834 -80.325 1.00 46.44 ? 27 ASP A O 1 ATOM 182 C CB . ASP A 1 27 ? -6.720 -43.158 -81.843 1.00 49.67 ? 27 ASP A CB 1 ATOM 183 C CG . ASP A 1 27 ? -5.367 -42.478 -81.980 1.00 52.13 ? 27 ASP A CG 1 ATOM 184 O OD1 . ASP A 1 27 ? -5.296 -41.241 -81.800 1.00 53.33 ? 27 ASP A OD1 1 ATOM 185 O OD2 . ASP A 1 27 ? -4.374 -43.179 -82.282 1.00 53.64 ? 27 ASP A OD2 1 ATOM 186 N N . SER A 1 28 ? -9.673 -42.716 -80.423 1.00 47.11 ? 28 SER A N 1 ATOM 187 C CA . SER A 1 28 ? -11.082 -43.102 -80.377 1.00 46.49 ? 28 SER A CA 1 ATOM 188 C C . SER A 1 28 ? -11.939 -42.396 -81.425 1.00 47.07 ? 28 SER A C 1 ATOM 189 O O . SER A 1 28 ? -11.659 -41.259 -81.815 1.00 48.28 ? 28 SER A O 1 ATOM 190 C CB . SER A 1 28 ? -11.662 -42.849 -78.986 1.00 45.96 ? 28 SER A CB 1 ATOM 191 O OG . SER A 1 28 ? -10.926 -43.543 -77.996 1.00 46.63 ? 28 SER A OG 1 ATOM 192 N N . VAL A 1 29 ? -12.979 -43.091 -81.878 1.00 46.50 ? 29 VAL A N 1 ATOM 193 C CA . VAL A 1 29 ? -14.011 -42.506 -82.731 1.00 47.07 ? 29 VAL A CA 1 ATOM 194 C C . VAL A 1 29 ? -15.395 -42.877 -82.213 1.00 46.58 ? 29 VAL A C 1 ATOM 195 O O . VAL A 1 29 ? -15.587 -43.954 -81.642 1.00 45.94 ? 29 VAL A O 1 ATOM 196 C CB . VAL A 1 29 ? -13.890 -42.945 -84.209 1.00 47.86 ? 29 VAL A CB 1 ATOM 197 C CG1 . VAL A 1 29 ? -12.702 -42.274 -84.867 1.00 48.68 ? 29 VAL A CG1 1 ATOM 198 C CG2 . VAL A 1 29 ? -13.806 -44.468 -84.332 1.00 47.70 ? 29 VAL A CG2 1 ATOM 199 N N . VAL A 1 30 ? -16.355 -41.982 -82.418 1.00 47.09 ? 30 VAL A N 1 ATOM 200 C CA . VAL A 1 30 ? -17.725 -42.210 -81.978 1.00 47.01 ? 30 VAL A CA 1 ATOM 201 C C . VAL A 1 30 ? -18.685 -42.139 -83.169 1.00 48.10 ? 30 VAL A C 1 ATOM 202 O O . VAL A 1 30 ? -18.647 -41.184 -83.944 1.00 49.06 ? 30 VAL A O 1 ATOM 203 C CB . VAL A 1 30 ? -18.120 -41.213 -80.857 1.00 47.28 ? 30 VAL A CB 1 ATOM 204 C CG1 . VAL A 1 30 ? -19.559 -41.390 -80.445 1.00 48.17 ? 30 VAL A CG1 1 ATOM 205 C CG2 . VAL A 1 30 ? -17.221 -41.397 -79.648 1.00 46.10 ? 30 VAL A CG2 1 ATOM 206 N N . TRP A 1 31 ? -19.528 -43.161 -83.311 1.00 48.20 ? 31 TRP A N 1 ATOM 207 C CA . TRP A 1 31 ? -20.507 -43.234 -84.400 1.00 49.68 ? 31 TRP A CA 1 ATOM 208 C C . TRP A 1 31 ? -21.944 -43.298 -83.888 1.00 50.69 ? 31 TRP A C 1 ATOM 209 O O . TRP A 1 31 ? -22.247 -44.075 -82.981 1.00 50.32 ? 31 TRP A O 1 ATOM 210 C CB . TRP A 1 31 ? -20.265 -44.474 -85.264 1.00 49.74 ? 31 TRP A CB 1 ATOM 211 C CG . TRP A 1 31 ? -18.926 -44.548 -85.910 1.00 49.26 ? 31 TRP A CG 1 ATOM 212 C CD1 . TRP A 1 31 ? -17.779 -45.034 -85.359 1.00 48.27 ? 31 TRP A CD1 1 ATOM 213 C CD2 . TRP A 1 31 ? -18.595 -44.150 -87.244 1.00 50.62 ? 31 TRP A CD2 1 ATOM 214 N NE1 . TRP A 1 31 ? -16.746 -44.951 -86.261 1.00 48.77 ? 31 TRP A NE1 1 ATOM 215 C CE2 . TRP A 1 31 ? -17.219 -44.413 -87.428 1.00 50.26 ? 31 TRP A CE2 1 ATOM 216 C CE3 . TRP A 1 31 ? -19.324 -43.591 -88.302 1.00 52.60 ? 31 TRP A CE3 1 ATOM 217 C CZ2 . TRP A 1 31 ? -16.555 -44.137 -88.629 1.00 51.55 ? 31 TRP A CZ2 1 ATOM 218 C CZ3 . TRP A 1 31 ? -18.663 -43.313 -89.496 1.00 53.89 ? 31 TRP A CZ3 1 ATOM 219 C CH2 . TRP A 1 31 ? -17.291 -43.589 -89.648 1.00 53.29 ? 31 TRP A CH2 1 ATOM 220 N N . LEU A 1 32 ? -22.821 -42.487 -84.474 1.00 52.35 ? 32 LEU A N 1 ATOM 221 C CA . LEU A 1 32 ? -24.266 -42.645 -84.290 1.00 54.11 ? 32 LEU A CA 1 ATOM 222 C C . LEU A 1 32 ? -24.848 -43.204 -85.582 1.00 55.77 ? 32 LEU A C 1 ATOM 223 O O . LEU A 1 32 ? -25.005 -42.482 -86.570 1.00 57.05 ? 32 LEU A O 1 ATOM 224 C CB . LEU A 1 32 ? -24.945 -41.323 -83.907 1.00 55.32 ? 32 LEU A CB 1 ATOM 225 C CG . LEU A 1 32 ? -26.476 -41.342 -83.762 1.00 57.64 ? 32 LEU A CG 1 ATOM 226 C CD1 . LEU A 1 32 ? -26.942 -42.286 -82.654 1.00 57.35 ? 32 LEU A CD1 1 ATOM 227 C CD2 . LEU A 1 32 ? -27.017 -39.943 -83.530 1.00 59.05 ? 32 LEU A CD2 1 ATOM 228 N N . GLY A 1 33 ? -25.160 -44.496 -85.566 1.00 56.07 ? 33 GLY A N 1 ATOM 229 C CA . GLY A 1 33 ? -25.453 -45.227 -86.793 1.00 57.51 ? 33 GLY A CA 1 ATOM 230 C C . GLY A 1 33 ? -24.178 -45.289 -87.611 1.00 56.37 ? 33 GLY A C 1 ATOM 231 O O . GLY A 1 33 ? -23.151 -45.774 -87.135 1.00 54.50 ? 33 GLY A O 1 ATOM 232 N N . ASP A 1 34 ? -24.237 -44.766 -88.830 1.00 57.86 ? 34 ASP A N 1 ATOM 233 C CA . ASP A 1 34 ? -23.069 -44.717 -89.711 1.00 57.39 ? 34 ASP A CA 1 ATOM 234 C C . ASP A 1 34 ? -22.556 -43.288 -89.929 1.00 57.19 ? 34 ASP A C 1 ATOM 235 O O . ASP A 1 34 ? -21.827 -43.016 -90.886 1.00 57.59 ? 34 ASP A O 1 ATOM 236 C CB . ASP A 1 34 ? -23.358 -45.428 -91.044 1.00 59.35 ? 34 ASP A CB 1 ATOM 237 C CG . ASP A 1 34 ? -24.772 -45.189 -91.548 1.00 62.31 ? 34 ASP A CG 1 ATOM 238 O OD1 . ASP A 1 34 ? -25.367 -44.136 -91.219 0.90 63.30 ? 34 ASP A OD1 1 ATOM 239 O OD2 . ASP A 1 34 ? -25.290 -46.061 -92.279 0.90 64.38 ? 34 ASP A OD2 1 ATOM 240 N N . LEU A 1 35 ? -22.939 -42.386 -89.028 1.00 56.94 ? 35 LEU A N 1 ATOM 241 C CA . LEU A 1 35 ? -22.420 -41.021 -89.017 1.00 56.89 ? 35 LEU A CA 1 ATOM 242 C C . LEU A 1 35 ? -21.460 -40.842 -87.853 1.00 54.84 ? 35 LEU A C 1 ATOM 243 O O . LEU A 1 35 ? -21.806 -41.144 -86.710 1.00 53.98 ? 35 LEU A O 1 ATOM 244 C CB . LEU A 1 35 ? -23.553 -39.997 -88.903 1.00 58.61 ? 35 LEU A CB 1 ATOM 245 C CG . LEU A 1 35 ? -24.499 -39.777 -90.085 1.00 61.22 ? 35 LEU A CG 1 ATOM 246 C CD1 . LEU A 1 35 ? -25.563 -38.774 -89.698 1.00 62.88 ? 35 LEU A CD1 1 ATOM 247 C CD2 . LEU A 1 35 ? -23.753 -39.307 -91.326 1.00 62.12 ? 35 LEU A CD2 1 ATOM 248 N N . GLN A 1 36 ? -20.256 -40.359 -88.147 1.00 54.42 ? 36 GLN A N 1 ATOM 249 C CA . GLN A 1 36 ? -19.279 -40.070 -87.105 1.00 53.02 ? 36 GLN A CA 1 ATOM 250 C C . GLN A 1 36 ? -19.675 -38.788 -86.377 1.00 53.86 ? 36 GLN A C 1 ATOM 251 O O . GLN A 1 36 ? -19.949 -37.767 -87.009 1.00 55.59 ? 36 GLN A O 1 ATOM 252 C CB . GLN A 1 36 ? -17.866 -39.952 -87.685 1.00 52.67 ? 36 GLN A CB 1 ATOM 253 C CG . GLN A 1 36 ? -16.763 -39.971 -86.623 1.00 50.77 ? 36 GLN A CG 1 ATOM 254 C CD . GLN A 1 36 ? -15.365 -39.749 -87.182 1.00 50.20 ? 36 GLN A CD 1 ATOM 255 O OE1 . GLN A 1 36 ? -15.154 -39.735 -88.394 1.00 51.28 ? 36 GLN A OE1 1 ATOM 256 N NE2 . GLN A 1 36 ? -14.400 -39.578 -86.289 1.00 48.67 ? 36 GLN A NE2 1 ATOM 257 N N . THR A 1 37 ? -19.720 -38.857 -85.051 1.00 53.06 ? 37 THR A N 1 ATOM 258 C CA . THR A 1 37 ? -20.091 -37.706 -84.232 1.00 54.18 ? 37 THR A CA 1 ATOM 259 C C . THR A 1 37 ? -18.888 -37.116 -83.493 1.00 53.60 ? 37 THR A C 1 ATOM 260 O O . THR A 1 37 ? -18.758 -35.897 -83.392 1.00 54.85 ? 37 THR A O 1 ATOM 261 C CB . THR A 1 37 ? -21.203 -38.051 -83.222 1.00 54.32 ? 37 THR A CB 1 ATOM 262 O OG1 . THR A 1 37 ? -20.800 -39.176 -82.430 1.00 52.85 ? 37 THR A OG1 1 ATOM 263 C CG2 . THR A 1 37 ? -22.505 -38.379 -83.944 1.00 55.82 ? 37 THR A CG2 1 ATOM 264 N N . HIS A 1 38 ? -18.004 -37.979 -82.999 1.00 52.16 ? 38 HIS A N 1 ATOM 265 C CA . HIS A 1 38 ? -16.831 -37.531 -82.252 1.00 51.87 ? 38 HIS A CA 1 ATOM 266 C C . HIS A 1 38 ? -15.518 -38.146 -82.741 1.00 51.36 ? 38 HIS A C 1 ATOM 267 O O . HIS A 1 38 ? -15.496 -39.217 -83.352 1.00 50.75 ? 38 HIS A O 1 ATOM 268 C CB . HIS A 1 38 ? -17.000 -37.814 -80.757 1.00 50.96 ? 38 HIS A CB 1 ATOM 269 C CG . HIS A 1 38 ? -18.214 -37.185 -80.150 1.00 51.90 ? 38 HIS A CG 1 ATOM 270 N ND1 . HIS A 1 38 ? -19.472 -37.738 -80.261 1.00 52.01 ? 38 HIS A ND1 1 ATOM 271 C CD2 . HIS A 1 38 ? -18.362 -36.060 -79.411 1.00 52.64 ? 38 HIS A CD2 1 ATOM 272 C CE1 . HIS A 1 38 ? -20.342 -36.977 -79.623 1.00 53.41 ? 38 HIS A CE1 1 ATOM 273 N NE2 . HIS A 1 38 ? -19.694 -35.952 -79.098 1.00 53.68 ? 38 HIS A NE2 1 ATOM 274 N N . ARG A 1 39 ? -14.430 -37.440 -82.449 1.00 52.11 ? 39 ARG A N 1 ATOM 275 C CA . ARG A 1 39 ? -13.069 -37.880 -82.718 1.00 52.19 ? 39 ARG A CA 1 ATOM 276 C C . ARG A 1 39 ? -12.224 -37.537 -81.493 1.00 52.37 ? 39 ARG A C 1 ATOM 277 O O . ARG A 1 39 ? -12.349 -36.439 -80.941 1.00 53.31 ? 39 ARG A O 1 ATOM 278 C CB . ARG A 1 39 ? -12.532 -37.153 -83.951 1.00 53.79 ? 39 ARG A CB 1 ATOM 279 C CG . ARG A 1 39 ? -11.014 -37.073 -84.051 1.00 54.69 ? 39 ARG A CG 1 ATOM 280 C CD . ARG A 1 39 ? -10.569 -36.037 -85.074 1.00 57.57 ? 39 ARG A CD 1 ATOM 281 N NE . ARG A 1 39 ? -11.102 -36.324 -86.406 1.00 59.06 ? 39 ARG A NE 1 ATOM 282 C CZ . ARG A 1 39 ? -11.958 -35.548 -87.065 1.00 60.70 ? 39 ARG A CZ 1 ATOM 283 N NH1 . ARG A 1 39 ? -12.379 -34.403 -86.533 1.00 61.85 ? 39 ARG A NH1 1 ATOM 284 N NH2 . ARG A 1 39 ? -12.383 -35.912 -88.269 1.00 60.91 ? 39 ARG A NH2 1 ATOM 285 N N . TRP A 1 40 ? -11.381 -38.471 -81.057 1.00 51.74 ? 40 TRP A N 1 ATOM 286 C CA . TRP A 1 40 ? -10.438 -38.183 -79.975 1.00 52.28 ? 40 TRP A CA 1 ATOM 287 C C . TRP A 1 40 ? -9.044 -38.750 -80.246 1.00 52.74 ? 40 TRP A C 1 ATOM 288 O O . TRP A 1 40 ? -8.737 -39.898 -79.911 1.00 51.64 ? 40 TRP A O 1 ATOM 289 C CB . TRP A 1 40 ? -10.983 -38.634 -78.615 1.00 51.21 ? 40 TRP A CB 1 ATOM 290 C CG . TRP A 1 40 ? -10.265 -38.018 -77.439 1.00 52.17 ? 40 TRP A CG 1 ATOM 291 C CD1 . TRP A 1 40 ? -9.474 -36.900 -77.449 1.00 54.25 ? 40 TRP A CD1 1 ATOM 292 C CD2 . TRP A 1 40 ? -10.305 -38.464 -76.078 1.00 51.77 ? 40 TRP A CD2 1 ATOM 293 N NE1 . TRP A 1 40 ? -9.007 -36.636 -76.185 1.00 54.78 ? 40 TRP A NE1 1 ATOM 294 C CE2 . TRP A 1 40 ? -9.503 -37.578 -75.323 1.00 53.19 ? 40 TRP A CE2 1 ATOM 295 C CE3 . TRP A 1 40 ? -10.935 -39.530 -75.423 1.00 50.88 ? 40 TRP A CE3 1 ATOM 296 C CZ2 . TRP A 1 40 ? -9.313 -37.727 -73.946 1.00 53.22 ? 40 TRP A CZ2 1 ATOM 297 C CZ3 . TRP A 1 40 ? -10.745 -39.676 -74.050 1.00 50.84 ? 40 TRP A CZ3 1 ATOM 298 C CH2 . TRP A 1 40 ? -9.940 -38.778 -73.330 1.00 51.89 ? 40 TRP A CH2 1 ATOM 299 N N . SER A 1 41 ? -8.214 -37.917 -80.865 1.00 54.76 ? 41 SER A N 1 ATOM 300 C CA . SER A 1 41 ? -6.842 -38.265 -81.200 1.00 55.97 ? 41 SER A CA 1 ATOM 301 C C . SER A 1 41 ? -5.982 -38.302 -79.940 1.00 56.27 ? 41 SER A C 1 ATOM 302 O O . SER A 1 41 ? -6.264 -37.587 -78.976 1.00 56.51 ? 41 SER A O 1 ATOM 303 C CB . SER A 1 41 ? -6.284 -37.237 -82.189 1.00 58.21 ? 41 SER A CB 1 ATOM 304 O OG . SER A 1 41 ? -5.032 -37.644 -82.712 1.00 59.91 ? 41 SER A OG 1 ATOM 305 N N . ASN A 1 42 ? -4.944 -39.141 -79.948 1.00 56.70 ? 42 ASN A N 1 ATOM 306 C CA . ASN A 1 42 ? -3.947 -39.160 -78.871 1.00 57.53 ? 42 ASN A CA 1 ATOM 307 C C . ASN A 1 42 ? -3.310 -37.779 -78.708 1.00 59.88 ? 42 ASN A C 1 ATOM 308 O O . ASN A 1 42 ? -3.044 -37.336 -77.590 1.00 60.46 ? 42 ASN A O 1 ATOM 309 C CB . ASN A 1 42 ? -2.863 -40.216 -79.139 1.00 58.11 ? 42 ASN A CB 1 ATOM 310 C CG . ASN A 1 42 ? -2.080 -40.582 -77.887 1.00 58.77 ? 42 ASN A CG 1 ATOM 311 O OD1 . ASN A 1 42 ? -2.553 -41.355 -77.056 1.00 57.51 ? 42 ASN A OD1 1 ATOM 312 N ND2 . ASN A 1 42 ? -0.872 -40.030 -77.752 1.00 62.21 ? 42 ASN A ND2 1 ATOM 313 N N . ASP A 1 43 ? -3.095 -37.107 -79.839 1.00 61.46 ? 43 ASP A N 1 ATOM 314 C CA . ASP A 1 43 ? -2.481 -35.780 -79.896 1.00 64.22 ? 43 ASP A CA 1 ATOM 315 C C . ASP A 1 43 ? -3.256 -34.705 -79.137 1.00 64.17 ? 43 ASP A C 1 ATOM 316 O O . ASP A 1 43 ? -2.672 -33.720 -78.680 1.00 66.33 ? 43 ASP A O 1 ATOM 317 C CB . ASP A 1 43 ? -2.334 -35.343 -81.356 1.00 65.99 ? 43 ASP A CB 1 ATOM 318 C CG . ASP A 1 43 ? -1.555 -36.341 -82.195 1.00 67.13 ? 43 ASP A CG 1 ATOM 319 O OD1 . ASP A 1 43 ? -0.912 -37.249 -81.622 1.00 67.53 ? 43 ASP A OD1 1 ATOM 320 O OD2 . ASP A 1 43 ? -1.585 -36.212 -83.438 1.00 68.99 ? 43 ASP A OD2 1 ATOM 321 N N . SER A 1 44 ? -4.566 -34.898 -79.014 1.00 61.97 ? 44 SER A N 1 ATOM 322 C CA . SER A 1 44 ? -5.459 -33.892 -78.447 1.00 62.11 ? 44 SER A CA 1 ATOM 323 C C . SER A 1 44 ? -5.831 -34.199 -76.998 1.00 60.93 ? 44 SER A C 1 ATOM 324 O O . SER A 1 44 ? -6.119 -35.347 -76.648 1.00 58.88 ? 44 SER A O 1 ATOM 325 C CB . SER A 1 44 ? -6.723 -33.773 -79.305 1.00 61.13 ? 44 SER A CB 1 ATOM 326 O OG . SER A 1 44 ? -7.559 -32.724 -78.857 1.00 61.69 ? 44 SER A OG 1 ATOM 327 N N . ALA A 1 45 ? -5.821 -33.163 -76.164 1.00 62.48 ? 45 ALA A N 1 ATOM 328 C CA . ALA A 1 45 ? -6.279 -33.274 -74.781 1.00 61.86 ? 45 ALA A CA 1 ATOM 329 C C . ALA A 1 45 ? -7.800 -33.122 -74.687 1.00 60.87 ? 45 ALA A C 1 ATOM 330 O O . ALA A 1 45 ? -8.387 -33.308 -73.620 1.00 60.36 ? 45 ALA A O 1 ATOM 331 C CB . ALA A 1 45 ? -5.584 -32.242 -73.913 1.00 64.41 ? 45 ALA A CB 1 ATOM 332 N N . THR A 1 46 ? -8.426 -32.804 -75.819 1.00 60.92 ? 46 THR A N 1 ATOM 333 C CA . THR A 1 46 ? -9.856 -32.533 -75.892 1.00 60.49 ? 46 THR A CA 1 ATOM 334 C C . THR A 1 46 ? -10.550 -33.477 -76.883 1.00 58.62 ? 46 THR A C 1 ATOM 335 O O . THR A 1 46 ? -9.986 -33.824 -77.924 1.00 58.57 ? 46 THR A O 1 ATOM 336 C CB . THR A 1 46 ? -10.099 -31.074 -76.336 1.00 63.02 ? 46 THR A CB 1 ATOM 337 O OG1 . THR A 1 46 ? -9.068 -30.231 -75.808 1.00 65.43 ? 46 THR A OG1 1 ATOM 338 C CG2 . THR A 1 46 ? -11.447 -30.567 -75.854 1.00 63.69 ? 46 THR A CG2 1 ATOM 339 N N . ILE A 1 47 ? -11.767 -33.899 -76.546 1.00 57.37 ? 47 ILE A N 1 ATOM 340 C CA . ILE A 1 47 ? -12.626 -34.637 -77.473 1.00 55.88 ? 47 ILE A CA 1 ATOM 341 C C . ILE A 1 47 ? -13.212 -33.638 -78.470 1.00 57.30 ? 47 ILE A C 1 ATOM 342 O O . ILE A 1 47 ? -13.763 -32.608 -78.072 1.00 58.93 ? 47 ILE A O 1 ATOM 343 C CB . ILE A 1 47 ? -13.765 -35.383 -76.733 1.00 54.71 ? 47 ILE A CB 1 ATOM 344 C CG1 . ILE A 1 47 ? -13.187 -36.345 -75.687 1.00 53.49 ? 47 ILE A CG1 1 ATOM 345 C CG2 . ILE A 1 47 ? -14.661 -36.132 -77.722 1.00 53.82 ? 47 ILE A CG2 1 ATOM 346 C CD1 . ILE A 1 47 ? -14.196 -36.851 -74.662 1.00 52.95 ? 47 ILE A CD1 1 ATOM 347 N N . SER A 1 48 ? -13.081 -33.944 -79.757 1.00 56.93 ? 48 SER A N 1 ATOM 348 C CA . SER A 1 48 ? -13.502 -33.037 -80.823 1.00 58.38 ? 48 SER A CA 1 ATOM 349 C C . SER A 1 48 ? -14.852 -33.423 -81.419 1.00 57.90 ? 48 SER A C 1 ATOM 350 O O . SER A 1 48 ? -15.168 -34.609 -81.550 1.00 56.18 ? 48 SER A O 1 ATOM 351 C CB . SER A 1 48 ? -12.450 -32.995 -81.935 1.00 59.17 ? 48 SER A CB 1 ATOM 352 O OG . SER A 1 48 ? -11.170 -32.666 -81.428 1.00 59.96 ? 48 SER A OG 1 ATOM 353 N N . PHE A 1 49 ? -15.636 -32.409 -81.780 1.00 59.55 ? 49 PHE A N 1 ATOM 354 C CA . PHE A 1 49 ? -16.893 -32.606 -82.496 1.00 59.73 ? 49 PHE A CA 1 ATOM 355 C C . PHE A 1 49 ? -16.637 -32.701 -83.993 1.00 60.18 ? 49 PHE A C 1 ATOM 356 O O . PHE A 1 49 ? -15.874 -31.909 -84.552 1.00 61.49 ? 49 PHE A O 1 ATOM 357 C CB . PHE A 1 49 ? -17.869 -31.453 -82.239 1.00 61.86 ? 49 PHE A CB 1 ATOM 358 C CG . PHE A 1 49 ? -18.183 -31.212 -80.787 1.00 62.13 ? 49 PHE A CG 1 ATOM 359 C CD1 . PHE A 1 49 ? -18.229 -29.914 -80.290 1.00 64.37 ? 49 PHE A CD1 1 ATOM 360 C CD2 . PHE A 1 49 ? -18.439 -32.271 -79.919 1.00 60.51 ? 49 PHE A CD2 1 ATOM 361 C CE1 . PHE A 1 49 ? -18.525 -29.673 -78.953 1.00 65.07 ? 49 PHE A CE1 1 ATOM 362 C CE2 . PHE A 1 49 ? -18.735 -32.042 -78.583 1.00 60.82 ? 49 PHE A CE2 1 ATOM 363 C CZ . PHE A 1 49 ? -18.778 -30.740 -78.097 1.00 63.25 ? 49 PHE A CZ 1 ATOM 364 N N . THR A 1 50 ? -17.276 -33.677 -84.633 1.00 59.30 ? 50 THR A N 1 ATOM 365 C CA . THR A 1 50 ? -17.229 -33.815 -86.086 1.00 60.04 ? 50 THR A CA 1 ATOM 366 C C . THR A 1 50 ? -18.565 -33.404 -86.707 1.00 61.55 ? 50 THR A C 1 ATOM 367 O O . THR A 1 50 ? -18.759 -33.525 -87.919 1.00 62.58 ? 50 THR A O 1 ATOM 368 C CB . THR A 1 50 ? -16.859 -35.249 -86.523 1.00 58.49 ? 50 THR A CB 1 ATOM 369 O OG1 . THR A 1 50 ? -17.796 -36.177 -85.972 1.00 57.50 ? 50 THR A OG1 1 ATOM 370 C CG2 . THR A 1 50 ? -15.465 -35.617 -86.052 1.00 57.46 ? 50 THR A CG2 1 ATOM 371 N N . LYS A 1 51 ? -19.479 -32.930 -85.859 1.00 61.86 ? 51 LYS A N 1 ATOM 372 C CA . LYS A 1 51 ? -20.769 -32.377 -86.282 1.00 63.68 ? 51 LYS A CA 1 ATOM 373 C C . LYS A 1 51 ? -21.079 -31.144 -85.438 1.00 64.99 ? 51 LYS A C 1 ATOM 374 O O . LYS A 1 51 ? -20.577 -31.026 -84.320 1.00 64.06 ? 51 LYS A O 1 ATOM 375 C CB . LYS A 1 51 ? -21.898 -33.405 -86.111 1.00 63.21 ? 51 LYS A CB 1 ATOM 376 C CG . LYS A 1 51 ? -21.747 -34.704 -86.906 1.00 62.20 ? 51 LYS A CG 1 ATOM 377 C CD . LYS A 1 51 ? -22.056 -34.518 -88.387 1.00 64.25 ? 51 LYS A CD 1 ATOM 378 C CE . LYS A 1 51 ? -21.710 -35.769 -89.187 1.00 63.39 ? 51 LYS A CE 1 ATOM 379 N NZ . LYS A 1 51 ? -20.243 -36.025 -89.233 1.00 61.81 ? 51 LYS A NZ 1 ATOM 380 N N . PRO A 1 52 ? -21.905 -30.217 -85.966 1.00 67.40 ? 52 PRO A N 1 ATOM 381 C CA . PRO A 1 52 ? -22.347 -29.076 -85.154 1.00 69.03 ? 52 PRO A CA 1 ATOM 382 C C . PRO A 1 52 ? -23.305 -29.460 -84.016 1.00 68.57 ? 52 PRO A C 1 ATOM 383 O O . PRO A 1 52 ? -23.513 -28.666 -83.097 1.00 69.90 ? 52 PRO A O 1 ATOM 384 C CB . PRO A 1 52 ? -23.057 -28.172 -86.169 1.00 72.00 ? 52 PRO A CB 1 ATOM 385 C CG . PRO A 1 52 ? -23.432 -29.071 -87.294 1.00 71.80 ? 52 PRO A CG 1 ATOM 386 C CD . PRO A 1 52 ? -22.346 -30.095 -87.368 1.00 69.09 ? 52 PRO A CD 1 ATOM 387 N N . TRP A 1 53 ? -23.869 -30.666 -84.080 1.00 67.04 ? 53 TRP A N 1 ATOM 388 C CA . TRP A 1 53 ? -24.826 -31.144 -83.079 1.00 66.84 ? 53 TRP A CA 1 ATOM 389 C C . TRP A 1 53 ? -24.288 -32.268 -82.186 1.00 64.26 ? 53 TRP A C 1 ATOM 390 O O . TRP A 1 53 ? -25.059 -32.932 -81.490 1.00 64.21 ? 53 TRP A O 1 ATOM 391 C CB . TRP A 1 53 ? -26.131 -31.586 -83.753 1.00 68.21 ? 53 TRP A CB 1 ATOM 392 C CG . TRP A 1 53 ? -25.944 -32.468 -84.961 1.00 66.75 ? 53 TRP A CG 1 ATOM 393 C CD1 . TRP A 1 53 ? -25.885 -32.064 -86.263 1.00 67.72 ? 53 TRP A CD1 1 ATOM 394 C CD2 . TRP A 1 53 ? -25.802 -33.897 -84.979 1.00 64.09 ? 53 TRP A CD2 1 ATOM 395 N NE1 . TRP A 1 53 ? -25.712 -33.147 -87.089 1.00 66.41 ? 53 TRP A NE1 1 ATOM 396 C CE2 . TRP A 1 53 ? -25.659 -34.285 -86.330 1.00 64.12 ? 53 TRP A CE2 1 ATOM 397 C CE3 . TRP A 1 53 ? -25.783 -34.888 -83.986 1.00 62.25 ? 53 TRP A CE3 1 ATOM 398 C CZ2 . TRP A 1 53 ? -25.496 -35.622 -86.716 1.00 62.33 ? 53 TRP A CZ2 1 ATOM 399 C CZ3 . TRP A 1 53 ? -25.619 -36.221 -84.372 1.00 60.28 ? 53 TRP A CZ3 1 ATOM 400 C CH2 . TRP A 1 53 ? -25.479 -36.572 -85.726 1.00 60.33 ? 53 TRP A CH2 1 ATOM 401 N N . SER A 1 54 ? -22.970 -32.462 -82.193 1.00 62.48 ? 54 SER A N 1 ATOM 402 C CA . SER A 1 54 ? -22.326 -33.567 -81.469 1.00 60.10 ? 54 SER A CA 1 ATOM 403 C C . SER A 1 54 ? -22.430 -33.481 -79.945 1.00 59.98 ? 54 SER A C 1 ATOM 404 O O . SER A 1 54 ? -22.288 -34.490 -79.252 1.00 58.27 ? 54 SER A O 1 ATOM 405 C CB . SER A 1 54 ? -20.857 -33.695 -81.881 1.00 58.65 ? 54 SER A CB 1 ATOM 406 O OG . SER A 1 54 ? -20.729 -34.046 -83.248 1.00 59.09 ? 54 SER A OG 1 ATOM 407 N N . GLN A 1 55 ? -22.674 -32.280 -79.427 1.00 62.05 ? 55 GLN A N 1 ATOM 408 C CA . GLN A 1 55 ? -22.854 -32.090 -77.989 1.00 62.66 ? 55 GLN A CA 1 ATOM 409 C C . GLN A 1 55 ? -24.184 -32.686 -77.516 1.00 63.63 ? 55 GLN A C 1 ATOM 410 O O . GLN A 1 55 ? -24.335 -33.031 -76.342 1.00 63.56 ? 55 GLN A O 1 ATOM 411 C CB . GLN A 1 55 ? -22.759 -30.602 -77.620 1.00 64.90 ? 55 GLN A CB 1 ATOM 412 C CG . GLN A 1 55 ? -22.571 -30.329 -76.128 1.00 65.19 ? 55 GLN A CG 1 ATOM 413 C CD . GLN A 1 55 ? -22.066 -28.922 -75.838 1.00 67.48 ? 55 GLN A CD 1 ATOM 414 O OE1 . GLN A 1 55 ? -21.117 -28.447 -76.464 1.00 67.43 ? 55 GLN A OE1 1 ATOM 415 N NE2 . GLN A 1 55 ? -22.692 -28.255 -74.872 1.00 69.26 ? 55 GLN A NE2 1 ATOM 416 N N . GLY A 1 56 ? -25.133 -32.816 -78.441 1.00 64.90 ? 56 GLY A N 1 ATOM 417 C CA . GLY A 1 56 ? -26.471 -33.303 -78.123 1.00 66.45 ? 56 GLY A CA 1 ATOM 418 C C . GLY A 1 56 ? -27.297 -32.220 -77.460 1.00 69.53 ? 56 GLY A C 1 ATOM 419 O O . GLY A 1 56 ? -27.284 -31.066 -77.894 1.00 71.15 ? 56 GLY A O 1 ATOM 420 N N . LYS A 1 57 ? -28.015 -32.595 -76.405 1.00 70.58 ? 57 LYS A N 1 ATOM 421 C CA . LYS A 1 57 ? -28.818 -31.645 -75.640 1.00 73.88 ? 57 LYS A CA 1 ATOM 422 C C . LYS A 1 57 ? -28.122 -31.228 -74.342 1.00 73.64 ? 57 LYS A C 1 ATOM 423 O O . LYS A 1 57 ? -28.643 -30.397 -73.592 1.00 76.42 ? 57 LYS A O 1 ATOM 424 C CB . LYS A 1 57 ? -30.215 -32.214 -75.352 1.00 76.06 ? 57 LYS A CB 1 ATOM 425 C CG . LYS A 1 57 ? -31.152 -32.258 -76.564 1.00 77.98 ? 57 LYS A CG 1 ATOM 426 C CD . LYS A 1 57 ? -31.795 -30.903 -76.853 1.00 81.42 ? 57 LYS A CD 1 ATOM 427 N N . LEU A 1 58 ? -26.942 -31.799 -74.093 1.00 70.67 ? 58 LEU A N 1 ATOM 428 C CA . LEU A 1 58 ? -26.160 -31.510 -72.888 1.00 70.26 ? 58 LEU A CA 1 ATOM 429 C C . LEU A 1 58 ? -25.685 -30.059 -72.832 1.00 71.98 ? 58 LEU A C 1 ATOM 430 O O . LEU A 1 58 ? -25.366 -29.461 -73.860 1.00 72.06 ? 58 LEU A O 1 ATOM 431 C CB . LEU A 1 58 ? -24.945 -32.442 -72.789 1.00 66.80 ? 58 LEU A CB 1 ATOM 432 C CG . LEU A 1 58 ? -25.091 -33.961 -72.645 1.00 64.80 ? 58 LEU A CG 1 ATOM 433 C CD1 . LEU A 1 58 ? -23.719 -34.568 -72.399 1.00 62.11 ? 58 LEU A CD1 1 ATOM 434 C CD2 . LEU A 1 58 ? -26.047 -34.367 -71.530 1.00 66.45 ? 58 LEU A CD2 1 ATOM 435 N N . SER A 1 59 ? -25.636 -29.504 -71.623 1.00 73.67 ? 59 SER A N 1 ATOM 436 C CA . SER A 1 59 ? -25.127 -28.151 -71.411 1.00 75.75 ? 59 SER A CA 1 ATOM 437 C C . SER A 1 59 ? -23.603 -28.146 -71.458 1.00 73.68 ? 59 SER A C 1 ATOM 438 O O . SER A 1 59 ? -22.977 -29.207 -71.484 1.00 70.91 ? 59 SER A O 1 ATOM 439 C CB . SER A 1 59 ? -25.620 -27.594 -70.074 1.00 78.53 ? 59 SER A CB 1 ATOM 440 O OG . SER A 1 59 ? -25.019 -28.271 -68.984 1.00 77.03 ? 59 SER A OG 1 ATOM 441 N N . ASN A 1 60 ? -23.013 -26.952 -71.473 1.00 75.52 ? 60 ASN A N 1 ATOM 442 C CA . ASN A 1 60 ? -21.560 -26.809 -71.452 1.00 74.45 ? 60 ASN A CA 1 ATOM 443 C C . ASN A 1 60 ? -20.943 -27.428 -70.198 1.00 73.55 ? 60 ASN A C 1 ATOM 444 O O . ASN A 1 60 ? -19.975 -28.187 -70.286 1.00 71.12 ? 60 ASN A O 1 ATOM 445 C CB . ASN A 1 60 ? -21.155 -25.337 -71.582 1.00 77.21 ? 60 ASN A CB 1 ATOM 446 C CG . ASN A 1 60 ? -21.442 -24.767 -72.963 1.00 78.06 ? 60 ASN A CG 1 ATOM 447 O OD1 . ASN A 1 60 ? -21.894 -25.474 -73.863 1.00 76.40 ? 60 ASN A OD1 1 ATOM 448 N ND2 . ASN A 1 60 ? -21.173 -23.479 -73.133 1.00 80.97 ? 60 ASN A ND2 1 ATOM 449 N N . GLN A 1 61 ? -21.526 -27.112 -69.041 1.00 75.90 ? 61 GLN A N 1 ATOM 450 C CA . GLN A 1 61 ? -21.072 -27.643 -67.755 1.00 75.58 ? 61 GLN A CA 1 ATOM 451 C C . GLN A 1 61 ? -21.243 -29.158 -67.674 1.00 72.88 ? 61 GLN A C 1 ATOM 452 O O . GLN A 1 61 ? -20.434 -29.841 -67.044 1.00 71.41 ? 61 GLN A O 1 ATOM 453 C CB . GLN A 1 61 ? -21.813 -26.966 -66.598 1.00 78.90 ? 61 GLN A CB 1 ATOM 454 N N . GLN A 1 62 ? -22.296 -29.671 -68.310 1.00 72.67 ? 62 GLN A N 1 ATOM 455 C CA . GLN A 1 62 ? -22.542 -31.111 -68.384 1.00 70.48 ? 62 GLN A CA 1 ATOM 456 C C . GLN A 1 62 ? -21.525 -31.809 -69.278 1.00 67.48 ? 62 GLN A C 1 ATOM 457 O O . GLN A 1 62 ? -21.141 -32.954 -69.020 1.00 65.43 ? 62 GLN A O 1 ATOM 458 C CB . GLN A 1 62 ? -23.948 -31.395 -68.906 1.00 71.51 ? 62 GLN A CB 1 ATOM 459 C CG . GLN A 1 62 ? -25.017 -31.478 -67.836 1.00 74.35 ? 62 GLN A CG 1 ATOM 460 C CD . GLN A 1 62 ? -26.374 -31.840 -68.410 1.00 76.24 ? 62 GLN A CD 1 ATOM 461 O OE1 . GLN A 1 62 ? -26.893 -32.931 -68.164 1.00 76.12 ? 62 GLN A OE1 1 ATOM 462 N NE2 . GLN A 1 62 ? -26.951 -30.933 -69.193 1.00 78.05 ? 62 GLN A NE2 1 ATOM 463 N N . TRP A 1 63 ? -21.102 -31.114 -70.332 1.00 67.48 ? 63 TRP A N 1 ATOM 464 C CA . TRP A 1 63 ? -20.117 -31.647 -71.259 1.00 65.12 ? 63 TRP A CA 1 ATOM 465 C C . TRP A 1 63 ? -18.715 -31.651 -70.649 1.00 64.43 ? 63 TRP A C 1 ATOM 466 O O . TRP A 1 63 ? -17.983 -32.634 -70.780 1.00 62.34 ? 63 TRP A O 1 ATOM 467 C CB . TRP A 1 63 ? -20.137 -30.875 -72.584 1.00 65.77 ? 63 TRP A CB 1 ATOM 468 C CG . TRP A 1 63 ? -19.071 -31.320 -73.539 1.00 63.72 ? 63 TRP A CG 1 ATOM 469 C CD1 . TRP A 1 63 ? -17.970 -30.613 -73.920 1.00 63.98 ? 63 TRP A CD1 1 ATOM 470 C CD2 . TRP A 1 63 ? -18.991 -32.583 -74.211 1.00 61.54 ? 63 TRP A CD2 1 ATOM 471 N NE1 . TRP A 1 63 ? -17.212 -31.351 -74.797 1.00 62.27 ? 63 TRP A NE1 1 ATOM 472 C CE2 . TRP A 1 63 ? -17.816 -32.565 -74.993 1.00 60.70 ? 63 TRP A CE2 1 ATOM 473 C CE3 . TRP A 1 63 ? -19.801 -33.727 -74.234 1.00 60.59 ? 63 TRP A CE3 1 ATOM 474 C CZ2 . TRP A 1 63 ? -17.429 -33.646 -75.792 1.00 58.62 ? 63 TRP A CZ2 1 ATOM 475 C CZ3 . TRP A 1 63 ? -19.416 -34.802 -75.028 1.00 58.64 ? 63 TRP A CZ3 1 ATOM 476 C CH2 . TRP A 1 63 ? -18.240 -34.751 -75.796 1.00 57.57 ? 63 TRP A CH2 1 ATOM 477 N N . GLU A 1 64 ? -18.354 -30.554 -69.984 1.00 66.63 ? 64 GLU A N 1 ATOM 478 C CA . GLU A 1 64 ? -17.041 -30.418 -69.349 1.00 66.65 ? 64 GLU A CA 1 ATOM 479 C C . GLU A 1 64 ? -16.781 -31.506 -68.305 1.00 65.25 ? 64 GLU A C 1 ATOM 480 O O . GLU A 1 64 ? -15.710 -32.115 -68.297 1.00 63.72 ? 64 GLU A O 1 ATOM 481 C CB . GLU A 1 64 ? -16.877 -29.026 -68.729 1.00 69.74 ? 64 GLU A CB 1 ATOM 482 C CG . GLU A 1 64 ? -16.666 -27.904 -69.744 1.00 71.87 ? 64 GLU A CG 1 ATOM 483 C CD . GLU A 1 64 ? -15.335 -28.002 -70.477 0.70 71.35 ? 64 GLU A CD 1 ATOM 484 O OE1 . GLU A 1 64 ? -14.278 -28.022 -69.806 0.70 71.62 ? 64 GLU A OE1 1 ATOM 485 O OE2 . GLU A 1 64 ? -15.350 -28.051 -71.727 0.70 70.51 ? 64 GLU A OE2 1 ATOM 486 N N . LYS A 1 65 ? -17.770 -31.748 -67.444 1.00 66.00 ? 65 LYS A N 1 ATOM 487 C CA . LYS A 1 65 ? -17.694 -32.795 -66.423 1.00 65.06 ? 65 LYS A CA 1 ATOM 488 C C . LYS A 1 65 ? -17.575 -34.194 -67.033 1.00 62.29 ? 65 LYS A C 1 ATOM 489 O O . LYS A 1 65 ? -16.935 -35.078 -66.460 1.00 61.21 ? 65 LYS A O 1 ATOM 490 C CB . LYS A 1 65 ? -18.912 -32.729 -65.498 1.00 66.91 ? 65 LYS A CB 1 ATOM 491 N N . LEU A 1 66 ? -18.191 -34.385 -68.196 1.00 61.46 ? 66 LEU A N 1 ATOM 492 C CA . LEU A 1 66 ? -18.149 -35.663 -68.896 1.00 59.17 ? 66 LEU A CA 1 ATOM 493 C C . LEU A 1 66 ? -16.808 -35.863 -69.607 1.00 57.55 ? 66 LEU A C 1 ATOM 494 O O . LEU A 1 66 ? -16.253 -36.964 -69.597 1.00 55.96 ? 66 LEU A O 1 ATOM 495 C CB . LEU A 1 66 ? -19.309 -35.764 -69.892 1.00 59.37 ? 66 LEU A CB 1 ATOM 496 C CG . LEU A 1 66 ? -19.713 -37.166 -70.358 1.00 57.89 ? 66 LEU A CG 1 ATOM 497 C CD1 . LEU A 1 66 ? -20.494 -37.902 -69.274 1.00 58.64 ? 66 LEU A CD1 1 ATOM 498 C CD2 . LEU A 1 66 ? -20.529 -37.077 -71.636 1.00 58.45 ? 66 LEU A CD2 1 ATOM 499 N N . GLN A 1 67 ? -16.301 -34.795 -70.220 1.00 58.21 ? 67 GLN A N 1 ATOM 500 C CA . GLN A 1 67 ? -14.991 -34.808 -70.863 1.00 57.19 ? 67 GLN A CA 1 ATOM 501 C C . GLN A 1 67 ? -13.872 -35.010 -69.843 1.00 57.20 ? 67 GLN A C 1 ATOM 502 O O . GLN A 1 67 ? -12.989 -35.845 -70.048 1.00 56.08 ? 67 GLN A O 1 ATOM 503 C CB . GLN A 1 67 ? -14.767 -33.514 -71.644 1.00 58.67 ? 67 GLN A CB 1 ATOM 504 C CG . GLN A 1 67 ? -13.408 -33.422 -72.309 1.00 58.30 ? 67 GLN A CG 1 ATOM 505 C CD . GLN A 1 67 ? -13.359 -32.356 -73.374 1.00 59.83 ? 67 GLN A CD 1 ATOM 506 O OE1 . GLN A 1 67 ? -13.376 -32.662 -74.568 1.00 59.30 ? 67 GLN A OE1 1 ATOM 507 N NE2 . GLN A 1 67 ? -13.308 -31.093 -72.955 1.00 61.67 ? 67 GLN A NE2 1 ATOM 508 N N . HIS A 1 68 ? -13.920 -34.251 -68.747 1.00 58.72 ? 68 HIS A N 1 ATOM 509 C CA . HIS A 1 68 ? -12.949 -34.375 -67.659 1.00 59.04 ? 68 HIS A CA 1 ATOM 510 C C . HIS A 1 68 ? -12.846 -35.816 -67.158 1.00 57.11 ? 68 HIS A C 1 ATOM 511 O O . HIS A 1 68 ? -11.750 -36.310 -66.892 1.00 56.61 ? 68 HIS A O 1 ATOM 512 C CB . HIS A 1 68 ? -13.311 -33.436 -66.503 1.00 61.42 ? 68 HIS A CB 1 ATOM 513 C CG . HIS A 1 68 ? -12.357 -33.497 -65.350 1.00 62.50 ? 68 HIS A CG 1 ATOM 514 N ND1 . HIS A 1 68 ? -12.469 -34.429 -64.340 1.00 62.21 ? 68 HIS A ND1 1 ATOM 515 C CD2 . HIS A 1 68 ? -11.279 -32.738 -65.044 1.00 64.53 ? 68 HIS A CD2 1 ATOM 516 C CE1 . HIS A 1 68 ? -11.500 -34.242 -63.462 1.00 63.55 ? 68 HIS A CE1 1 ATOM 517 N NE2 . HIS A 1 68 ? -10.765 -33.222 -63.865 1.00 65.21 ? 68 HIS A NE2 1 ATOM 518 N N . MET A 1 69 ? -13.995 -36.477 -67.040 1.00 56.26 ? 69 MET A N 1 ATOM 519 C CA . MET A 1 69 ? -14.060 -37.872 -66.619 1.00 54.79 ? 69 MET A CA 1 ATOM 520 C C . MET A 1 69 ? -13.299 -38.781 -67.590 1.00 52.53 ? 69 MET A C 1 ATOM 521 O O . MET A 1 69 ? -12.551 -39.662 -67.159 1.00 51.90 ? 69 MET A O 1 ATOM 522 C CB . MET A 1 69 ? -15.523 -38.306 -66.468 1.00 55.14 ? 69 MET A CB 1 ATOM 523 C CG . MET A 1 69 ? -15.737 -39.705 -65.898 1.00 55.25 ? 69 MET A CG 1 ATOM 524 S SD . MET A 1 69 ? -15.658 -41.007 -67.148 1.00 56.75 ? 69 MET A SD 1 ATOM 525 C CE . MET A 1 69 ? -16.943 -40.476 -68.283 1.00 56.24 ? 69 MET A CE 1 ATOM 526 N N . PHE A 1 70 ? -13.489 -38.559 -68.892 1.00 51.33 ? 70 PHE A N 1 ATOM 527 C CA . PHE A 1 70 ? -12.781 -39.325 -69.916 1.00 49.43 ? 70 PHE A CA 1 ATOM 528 C C . PHE A 1 70 ? -11.292 -38.988 -69.953 1.00 49.55 ? 70 PHE A C 1 ATOM 529 O O . PHE A 1 70 ? -10.463 -39.856 -70.231 1.00 48.67 ? 70 PHE A O 1 ATOM 530 C CB . PHE A 1 70 ? -13.410 -39.129 -71.305 1.00 49.00 ? 70 PHE A CB 1 ATOM 531 C CG . PHE A 1 70 ? -14.693 -39.895 -71.510 1.00 48.13 ? 70 PHE A CG 1 ATOM 532 C CD1 . PHE A 1 70 ? -14.714 -41.285 -71.438 1.00 46.89 ? 70 PHE A CD1 1 ATOM 533 C CD2 . PHE A 1 70 ? -15.879 -39.227 -71.794 1.00 49.12 ? 70 PHE A CD2 1 ATOM 534 C CE1 . PHE A 1 70 ? -15.901 -41.994 -71.628 1.00 46.78 ? 70 PHE A CE1 1 ATOM 535 C CE2 . PHE A 1 70 ? -17.072 -39.929 -71.988 1.00 48.73 ? 70 PHE A CE2 1 ATOM 536 C CZ . PHE A 1 70 ? -17.081 -41.314 -71.903 1.00 47.41 ? 70 PHE A CZ 1 ATOM 537 N N . GLN A 1 71 ? -10.964 -37.728 -69.672 1.00 50.84 ? 71 GLN A N 1 ATOM 538 C CA . GLN A 1 71 ? -9.575 -37.270 -69.628 1.00 51.47 ? 71 GLN A CA 1 ATOM 539 C C . GLN A 1 71 ? -8.802 -37.964 -68.513 1.00 51.39 ? 71 GLN A C 1 ATOM 540 O O . GLN A 1 71 ? -7.651 -38.361 -68.700 1.00 51.53 ? 71 GLN A O 1 ATOM 541 C CB . GLN A 1 71 ? -9.508 -35.752 -69.468 1.00 53.49 ? 71 GLN A CB 1 ATOM 542 C CG . GLN A 1 71 ? -9.818 -34.989 -70.749 1.00 53.62 ? 71 GLN A CG 1 ATOM 543 C CD . GLN A 1 71 ? -9.972 -33.491 -70.537 1.00 55.37 ? 71 GLN A CD 1 ATOM 544 O OE1 . GLN A 1 71 ? -10.062 -33.011 -69.405 1.00 56.67 ? 71 GLN A OE1 1 ATOM 545 N NE2 . GLN A 1 71 ? -10.012 -32.746 -71.633 1.00 55.60 ? 71 GLN A NE2 1 ATOM 546 N N . VAL A 1 72 ? -9.446 -38.115 -67.359 1.00 51.43 ? 72 VAL A N 1 ATOM 547 C CA . VAL A 1 72 ? -8.875 -38.872 -66.247 1.00 51.43 ? 72 VAL A CA 1 ATOM 548 C C . VAL A 1 72 ? -8.792 -40.354 -66.624 1.00 49.66 ? 72 VAL A C 1 ATOM 549 O O . VAL A 1 72 ? -7.835 -41.040 -66.263 1.00 49.75 ? 72 VAL A O 1 ATOM 550 C CB . VAL A 1 72 ? -9.682 -38.663 -64.934 1.00 52.33 ? 72 VAL A CB 1 ATOM 551 C CG1 . VAL A 1 72 ? -9.337 -39.723 -63.894 1.00 52.09 ? 72 VAL A CG1 1 ATOM 552 C CG2 . VAL A 1 72 ? -9.438 -37.266 -64.373 1.00 54.13 ? 72 VAL A CG2 1 ATOM 553 N N . TYR A 1 73 ? -9.789 -40.824 -67.371 1.00 48.28 ? 73 TYR A N 1 ATOM 554 C CA . TYR A 1 73 ? -9.857 -42.212 -67.815 1.00 46.86 ? 73 TYR A CA 1 ATOM 555 C C . TYR A 1 73 ? -8.707 -42.617 -68.749 1.00 46.47 ? 73 TYR A C 1 ATOM 556 O O . TYR A 1 73 ? -8.092 -43.668 -68.553 1.00 46.21 ? 73 TYR A O 1 ATOM 557 C CB . TYR A 1 73 ? -11.213 -42.492 -68.475 1.00 46.09 ? 73 TYR A CB 1 ATOM 558 C CG . TYR A 1 73 ? -11.220 -43.686 -69.403 1.00 45.08 ? 73 TYR A CG 1 ATOM 559 C CD1 . TYR A 1 73 ? -11.201 -44.985 -68.899 1.00 44.91 ? 73 TYR A CD1 1 ATOM 560 C CD2 . TYR A 1 73 ? -11.248 -43.515 -70.787 1.00 45.12 ? 73 TYR A CD2 1 ATOM 561 C CE1 . TYR A 1 73 ? -11.206 -46.085 -69.745 1.00 44.43 ? 73 TYR A CE1 1 ATOM 562 C CE2 . TYR A 1 73 ? -11.251 -44.612 -71.646 1.00 44.65 ? 73 TYR A CE2 1 ATOM 563 C CZ . TYR A 1 73 ? -11.232 -45.892 -71.114 1.00 44.41 ? 73 TYR A CZ 1 ATOM 564 O OH . TYR A 1 73 ? -11.238 -46.985 -71.946 1.00 45.07 ? 73 TYR A OH 1 ATOM 565 N N . ARG A 1 74 ? -8.429 -41.790 -69.756 1.00 46.60 ? 74 ARG A N 1 ATOM 566 C CA . ARG A 1 74 ? -7.411 -42.105 -70.764 1.00 46.31 ? 74 ARG A CA 1 ATOM 567 C C . ARG A 1 74 ? -6.020 -42.278 -70.149 1.00 47.21 ? 74 ARG A C 1 ATOM 568 O O . ARG A 1 74 ? -5.308 -43.230 -70.472 1.00 47.10 ? 74 ARG A O 1 ATOM 569 C CB . ARG A 1 74 ? -7.386 -41.043 -71.869 1.00 46.94 ? 74 ARG A CB 1 ATOM 570 C CG . ARG A 1 74 ? -6.634 -41.476 -73.124 1.00 46.94 ? 74 ARG A CG 1 ATOM 571 C CD . ARG A 1 74 ? -6.750 -40.458 -74.251 1.00 47.69 ? 74 ARG A CD 1 ATOM 572 N NE . ARG A 1 74 ? -6.007 -39.229 -73.978 1.00 49.59 ? 74 ARG A NE 1 ATOM 573 C CZ . ARG A 1 74 ? -5.829 -38.239 -74.850 1.00 50.69 ? 74 ARG A CZ 1 ATOM 574 N NH1 . ARG A 1 74 ? -6.335 -38.318 -76.075 1.00 50.00 ? 74 ARG A NH1 1 ATOM 575 N NH2 . ARG A 1 74 ? -5.137 -37.163 -74.494 1.00 52.55 ? 74 ARG A NH2 1 ATOM 576 N N . VAL A 1 75 ? -5.650 -41.352 -69.268 1.00 48.28 ? 75 VAL A N 1 ATOM 577 C CA . VAL A 1 75 ? -4.377 -41.396 -68.552 1.00 49.53 ? 75 VAL A CA 1 ATOM 578 C C . VAL A 1 75 ? -4.302 -42.643 -67.671 1.00 48.83 ? 75 VAL A C 1 ATOM 579 O O . VAL A 1 75 ? -3.274 -43.322 -67.622 1.00 49.37 ? 75 VAL A O 1 ATOM 580 C CB . VAL A 1 75 ? -4.187 -40.120 -67.683 1.00 51.43 ? 75 VAL A CB 1 ATOM 581 C CG1 . VAL A 1 75 ? -2.941 -40.218 -66.811 1.00 53.10 ? 75 VAL A CG1 1 ATOM 582 C CG2 . VAL A 1 75 ? -4.125 -38.877 -68.564 1.00 52.61 ? 75 VAL A CG2 1 ATOM 583 N N . SER A 1 76 ? -5.410 -42.937 -66.995 1.00 47.85 ? 76 SER A N 1 ATOM 584 C CA . SER A 1 76 ? -5.491 -44.036 -66.038 1.00 47.45 ? 76 SER A CA 1 ATOM 585 C C . SER A 1 76 ? -5.466 -45.404 -66.703 1.00 46.14 ? 76 SER A C 1 ATOM 586 O O . SER A 1 76 ? -4.823 -46.327 -66.198 1.00 46.46 ? 76 SER A O 1 ATOM 587 C CB . SER A 1 76 ? -6.752 -43.905 -65.187 1.00 47.09 ? 76 SER A CB 1 ATOM 588 O OG . SER A 1 76 ? -6.732 -42.703 -64.449 1.00 48.55 ? 76 SER A OG 1 ATOM 589 N N . PHE A 1 77 ? -6.182 -45.522 -67.820 1.00 44.80 ? 77 PHE A N 1 ATOM 590 C CA . PHE A 1 77 ? -6.238 -46.750 -68.604 1.00 43.92 ? 77 PHE A CA 1 ATOM 591 C C . PHE A 1 77 ? -4.846 -47.139 -69.094 1.00 44.67 ? 77 PHE A C 1 ATOM 592 O O . PHE A 1 77 ? -4.428 -48.290 -68.947 1.00 44.82 ? 77 PHE A O 1 ATOM 593 C CB . PHE A 1 77 ? -7.194 -46.577 -69.790 1.00 43.02 ? 77 PHE A CB 1 ATOM 594 C CG . PHE A 1 77 ? -7.267 -47.775 -70.692 1.00 42.73 ? 77 PHE A CG 1 ATOM 595 C CD1 . PHE A 1 77 ? -6.514 -47.828 -71.862 1.00 43.21 ? 77 PHE A CD1 1 ATOM 596 C CD2 . PHE A 1 77 ? -8.088 -48.853 -70.373 1.00 42.54 ? 77 PHE A CD2 1 ATOM 597 C CE1 . PHE A 1 77 ? -6.575 -48.938 -72.697 1.00 43.26 ? 77 PHE A CE1 1 ATOM 598 C CE2 . PHE A 1 77 ? -8.157 -49.969 -71.206 1.00 42.54 ? 77 PHE A CE2 1 ATOM 599 C CZ . PHE A 1 77 ? -7.402 -50.011 -72.368 1.00 42.54 ? 77 PHE A CZ 1 ATOM 600 N N . THR A 1 78 ? -4.139 -46.167 -69.667 1.00 45.39 ? 78 THR A N 1 ATOM 601 C CA . THR A 1 78 ? -2.779 -46.364 -70.158 1.00 46.64 ? 78 THR A CA 1 ATOM 602 C C . THR A 1 78 ? -1.890 -46.965 -69.066 1.00 47.99 ? 78 THR A C 1 ATOM 603 O O . THR A 1 78 ? -1.245 -47.997 -69.281 1.00 48.50 ? 78 THR A O 1 ATOM 604 C CB . THR A 1 78 ? -2.170 -45.033 -70.672 1.00 47.86 ? 78 THR A CB 1 ATOM 605 O OG1 . THR A 1 78 ? -3.073 -44.417 -71.598 1.00 46.57 ? 78 THR A OG1 1 ATOM 606 C CG2 . THR A 1 78 ? -0.828 -45.268 -71.356 1.00 49.21 ? 78 THR A CG2 1 ATOM 607 N N . ARG A 1 79 ? -1.882 -46.325 -67.897 1.00 48.68 ? 79 ARG A N 1 ATOM 608 C CA . ARG A 1 79 ? -1.048 -46.753 -66.780 1.00 50.18 ? 79 ARG A CA 1 ATOM 609 C C . ARG A 1 79 ? -1.477 -48.112 -66.228 1.00 49.63 ? 79 ARG A C 1 ATOM 610 O O . ARG A 1 79 ? -0.631 -48.925 -65.860 1.00 50.77 ? 79 ARG A O 1 ATOM 611 C CB . ARG A 1 79 ? -1.048 -45.701 -65.668 1.00 51.27 ? 79 ARG A CB 1 ATOM 612 C CG . ARG A 1 79 ? 0.209 -45.711 -64.809 1.00 53.25 ? 79 ARG A CG 1 ATOM 613 C CD . ARG A 1 79 ? 0.078 -44.784 -63.612 1.00 53.75 ? 79 ARG A CD 1 ATOM 614 N NE . ARG A 1 79 ? -0.617 -45.426 -62.497 1.00 52.97 ? 79 ARG A NE 1 ATOM 615 C CZ . ARG A 1 79 ? -0.895 -44.836 -61.338 1.00 53.48 ? 79 ARG A CZ 1 ATOM 616 N NH1 . ARG A 1 79 ? -0.548 -43.573 -61.122 1.00 54.99 ? 79 ARG A NH1 1 ATOM 617 N NH2 . ARG A 1 79 ? -1.527 -45.513 -60.390 1.00 52.77 ? 79 ARG A NH2 1 ATOM 618 N N . ASP A 1 80 ? -2.786 -48.354 -66.179 1.00 48.24 ? 80 ASP A N 1 ATOM 619 C CA . ASP A 1 80 ? -3.321 -49.622 -65.676 1.00 48.20 ? 80 ASP A CA 1 ATOM 620 C C . ASP A 1 80 ? -2.924 -50.819 -66.543 1.00 48.10 ? 80 ASP A C 1 ATOM 621 O O . ASP A 1 80 ? -2.523 -51.863 -66.022 1.00 48.83 ? 80 ASP A O 1 ATOM 622 C CB . ASP A 1 80 ? -4.845 -49.549 -65.521 1.00 47.04 ? 80 ASP A CB 1 ATOM 623 C CG . ASP A 1 80 ? -5.274 -48.851 -64.237 1.00 48.53 ? 80 ASP A CG 1 ATOM 624 O OD1 . ASP A 1 80 ? -4.510 -48.008 -63.714 1.00 50.16 ? 80 ASP A OD1 1 ATOM 625 O OD2 . ASP A 1 80 ? -6.385 -49.147 -63.750 1.00 49.17 ? 80 ASP A OD2 1 ATOM 626 N N . ILE A 1 81 ? -3.034 -50.660 -67.860 1.00 47.47 ? 81 ILE A N 1 ATOM 627 C CA . ILE A 1 81 ? -2.643 -51.710 -68.794 1.00 47.73 ? 81 ILE A CA 1 ATOM 628 C C . ILE A 1 81 ? -1.173 -52.082 -68.611 1.00 49.85 ? 81 ILE A C 1 ATOM 629 O O . ILE A 1 81 ? -0.858 -53.249 -68.396 1.00 50.61 ? 81 ILE A O 1 ATOM 630 C CB . ILE A 1 81 ? -2.929 -51.321 -70.271 1.00 46.93 ? 81 ILE A CB 1 ATOM 631 C CG1 . ILE A 1 81 ? -4.437 -51.180 -70.527 1.00 45.03 ? 81 ILE A CG1 1 ATOM 632 C CG2 . ILE A 1 81 ? -2.286 -52.322 -71.237 1.00 47.64 ? 81 ILE A CG2 1 ATOM 633 C CD1 . ILE A 1 81 ? -5.273 -52.416 -70.203 1.00 44.39 ? 81 ILE A CD1 1 ATOM 634 N N . GLN A 1 82 ? -0.285 -51.091 -68.668 1.00 51.22 ? 82 GLN A N 1 ATOM 635 C CA . GLN A 1 82 ? 1.152 -51.355 -68.545 1.00 53.82 ? 82 GLN A CA 1 ATOM 636 C C . GLN A 1 82 ? 1.575 -51.896 -67.177 1.00 55.15 ? 82 GLN A C 1 ATOM 637 O O . GLN A 1 82 ? 2.571 -52.609 -67.080 1.00 57.18 ? 82 GLN A O 1 ATOM 638 C CB . GLN A 1 82 ? 2.000 -50.148 -68.968 1.00 55.17 ? 82 GLN A CB 1 ATOM 639 C CG . GLN A 1 82 ? 1.655 -48.837 -68.302 1.00 55.25 ? 82 GLN A CG 1 ATOM 640 C CD . GLN A 1 82 ? 2.059 -47.631 -69.135 0.90 56.34 ? 82 GLN A CD 1 ATOM 641 O OE1 . GLN A 1 82 ? 2.399 -47.757 -70.313 0.90 56.49 ? 82 GLN A OE1 1 ATOM 642 N NE2 . GLN A 1 82 ? 2.017 -46.452 -68.524 0.90 57.21 ? 82 GLN A NE2 1 ATOM 643 N N . GLU A 1 83 ? 0.814 -51.574 -66.134 1.00 54.59 ? 83 GLU A N 1 ATOM 644 C CA . GLU A 1 83 ? 1.035 -52.170 -64.815 1.00 55.84 ? 83 GLU A CA 1 ATOM 645 C C . GLU A 1 83 ? 0.546 -53.616 -64.778 1.00 55.44 ? 83 GLU A C 1 ATOM 646 O O . GLU A 1 83 ? 1.115 -54.448 -64.074 1.00 56.92 ? 83 GLU A O 1 ATOM 647 C CB . GLU A 1 83 ? 0.368 -51.347 -63.705 1.00 55.52 ? 83 GLU A CB 1 ATOM 648 C CG . GLU A 1 83 ? 0.974 -49.961 -63.474 1.00 56.84 ? 83 GLU A CG 1 ATOM 649 C CD . GLU A 1 83 ? 2.472 -49.990 -63.219 1.00 59.89 ? 83 GLU A CD 1 ATOM 650 O OE1 . GLU A 1 83 ? 2.912 -50.704 -62.293 1.00 61.58 ? 83 GLU A OE1 1 ATOM 651 O OE2 . GLU A 1 83 ? 3.210 -49.289 -63.945 1.00 61.01 ? 83 GLU A OE2 1 ATOM 652 N N . LEU A 1 84 ? -0.511 -53.906 -65.535 1.00 53.87 ? 84 LEU A N 1 ATOM 653 C CA . LEU A 1 84 ? -1.009 -55.276 -65.688 1.00 53.94 ? 84 LEU A CA 1 ATOM 654 C C . LEU A 1 84 ? -0.059 -56.125 -66.533 1.00 55.45 ? 84 LEU A C 1 ATOM 655 O O . LEU A 1 84 ? 0.082 -57.325 -66.298 1.00 56.52 ? 84 LEU A O 1 ATOM 656 C CB . LEU A 1 84 ? -2.420 -55.293 -66.287 1.00 51.82 ? 84 LEU A CB 1 ATOM 657 C CG . LEU A 1 84 ? -3.593 -55.029 -65.338 1.00 51.14 ? 84 LEU A CG 1 ATOM 658 C CD1 . LEU A 1 84 ? -4.866 -54.757 -66.118 1.00 49.68 ? 84 LEU A CD1 1 ATOM 659 C CD2 . LEU A 1 84 ? -3.805 -56.188 -64.363 1.00 52.50 ? 84 LEU A CD2 1 ATOM 660 N N . VAL A 1 85 ? 0.587 -55.493 -67.513 1.00 55.96 ? 85 VAL A N 1 ATOM 661 C CA . VAL A 1 85 ? 1.617 -56.142 -68.317 1.00 57.99 ? 85 VAL A CA 1 ATOM 662 C C . VAL A 1 85 ? 2.752 -56.616 -67.409 1.00 60.82 ? 85 VAL A C 1 ATOM 663 O O . VAL A 1 85 ? 3.238 -57.743 -67.551 1.00 62.41 ? 85 VAL A O 1 ATOM 664 C CB . VAL A 1 85 ? 2.170 -55.196 -69.414 1.00 58.18 ? 85 VAL A CB 1 ATOM 665 C CG1 . VAL A 1 85 ? 3.329 -55.844 -70.165 1.00 60.37 ? 85 VAL A CG1 1 ATOM 666 C CG2 . VAL A 1 85 ? 1.074 -54.809 -70.384 1.00 56.11 ? 85 VAL A CG2 1 ATOM 667 N N . LYS A 1 86 ? 3.147 -55.749 -66.475 1.00 61.80 ? 86 LYS A N 1 ATOM 668 C CA . LYS A 1 86 ? 4.196 -56.035 -65.493 1.00 64.65 ? 86 LYS A CA 1 ATOM 669 C C . LYS A 1 86 ? 3.833 -57.183 -64.553 1.00 65.38 ? 86 LYS A C 1 ATOM 670 O O . LYS A 1 86 ? 4.714 -57.906 -64.092 1.00 67.89 ? 86 LYS A O 1 ATOM 671 C CB . LYS A 1 86 ? 4.523 -54.782 -64.677 1.00 65.19 ? 86 LYS A CB 1 ATOM 672 C CG . LYS A 1 86 ? 5.216 -53.676 -65.462 1.00 65.65 ? 86 LYS A CG 1 ATOM 673 C CD . LYS A 1 86 ? 5.339 -52.405 -64.634 1.00 65.71 ? 86 LYS A CD 1 ATOM 674 C CE . LYS A 1 86 ? 5.872 -51.252 -65.466 1.00 66.18 ? 86 LYS A CE 1 ATOM 675 N NZ . LYS A 1 86 ? 5.932 -49.987 -64.688 1.00 66.60 ? 86 LYS A NZ 1 ATOM 676 N N . MET A 1 87 ? 2.540 -57.333 -64.268 1.00 63.85 ? 87 MET A N 1 ATOM 677 C CA . MET A 1 87 ? 2.030 -58.445 -63.460 1.00 64.85 ? 87 MET A CA 1 ATOM 678 C C . MET A 1 87 ? 2.169 -59.790 -64.168 1.00 66.02 ? 87 MET A C 1 ATOM 679 O O . MET A 1 87 ? 2.641 -60.763 -63.577 1.00 68.07 ? 87 MET A O 1 ATOM 680 C CB . MET A 1 87 ? 0.555 -58.230 -63.110 1.00 62.72 ? 87 MET A CB 1 ATOM 681 C CG . MET A 1 87 ? 0.298 -57.478 -61.821 1.00 63.61 ? 87 MET A CG 1 ATOM 682 S SD . MET A 1 87 ? -1.442 -57.525 -61.322 1.00 63.16 ? 87 MET A SD 1 ATOM 683 C CE . MET A 1 87 ? -1.608 -59.223 -60.777 1.00 64.12 ? 87 MET A CE 1 ATOM 684 N N . MET A 1 88 ? 1.755 -59.832 -65.433 1.00 65.17 ? 88 MET A N 1 ATOM 685 C CA . MET A 1 88 ? 1.621 -61.089 -66.169 1.00 66.34 ? 88 MET A CA 1 ATOM 686 C C . MET A 1 88 ? 2.896 -61.531 -66.887 1.00 68.89 ? 88 MET A C 1 ATOM 687 O O . MET A 1 88 ? 3.291 -62.694 -66.780 1.00 71.01 ? 88 MET A O 1 ATOM 688 C CB . MET A 1 88 ? 0.445 -61.026 -67.153 1.00 64.26 ? 88 MET A CB 1 ATOM 689 C CG . MET A 1 88 ? -0.874 -60.534 -66.556 1.00 62.51 ? 88 MET A CG 1 ATOM 690 S SD . MET A 1 88 ? -1.292 -61.259 -64.957 1.00 64.36 ? 88 MET A SD 1 ATOM 691 C CE . MET A 1 88 ? -1.613 -62.966 -65.410 1.00 65.69 ? 88 MET A CE 1 ATOM 692 N N . SER A 1 89 ? 3.531 -60.610 -67.614 1.00 69.16 ? 89 SER A N 1 ATOM 693 C CA . SER A 1 89 ? 4.779 -60.909 -68.326 1.00 71.92 ? 89 SER A CA 1 ATOM 694 C C . SER A 1 89 ? 5.950 -60.002 -67.902 1.00 73.75 ? 89 SER A C 1 ATOM 695 O O . SER A 1 89 ? 6.245 -59.011 -68.581 1.00 73.54 ? 89 SER A O 1 ATOM 696 C CB . SER A 1 89 ? 4.562 -60.851 -69.843 1.00 71.25 ? 89 SER A CB 1 ATOM 697 N N . PRO A 1 90 ? 6.623 -60.343 -66.780 1.00 75.90 ? 90 PRO A N 1 ATOM 698 C CA . PRO A 1 90 ? 7.774 -59.568 -66.301 1.00 78.08 ? 90 PRO A CA 1 ATOM 699 C C . PRO A 1 90 ? 9.024 -59.776 -67.158 1.00 81.11 ? 90 PRO A C 1 ATOM 700 O O . PRO A 1 90 ? 9.326 -60.903 -67.557 1.00 82.70 ? 90 PRO A O 1 ATOM 701 C CB . PRO A 1 90 ? 8.011 -60.114 -64.882 1.00 79.62 ? 90 PRO A CB 1 ATOM 702 C CG . PRO A 1 90 ? 6.821 -60.980 -64.567 1.00 77.75 ? 90 PRO A CG 1 ATOM 703 C CD . PRO A 1 90 ? 6.327 -61.473 -65.882 1.00 76.62 ? 90 PRO A CD 1 ATOM 704 N N . ASP A 1 93 ? 3.023 -60.769 -74.709 0.70 69.09 ? 93 ASP A N 1 ATOM 705 C CA . ASP A 1 93 ? 4.097 -60.093 -73.988 0.70 70.36 ? 93 ASP A CA 1 ATOM 706 C C . ASP A 1 93 ? 4.237 -58.646 -74.458 0.70 69.55 ? 93 ASP A C 1 ATOM 707 O O . ASP A 1 93 ? 3.923 -57.716 -73.712 0.70 67.99 ? 93 ASP A O 1 ATOM 708 C CB . ASP A 1 93 ? 5.419 -60.850 -74.154 0.70 73.88 ? 93 ASP A CB 1 ATOM 709 N N . TYR A 1 94 ? 4.716 -58.478 -75.692 1.00 70.90 ? 94 TYR A N 1 ATOM 710 C CA . TYR A 1 94 ? 4.811 -57.184 -76.378 1.00 70.37 ? 94 TYR A CA 1 ATOM 711 C C . TYR A 1 94 ? 5.086 -57.422 -77.861 1.00 71.82 ? 94 TYR A C 1 ATOM 712 O O . TYR A 1 94 ? 5.926 -58.260 -78.201 1.00 74.59 ? 94 TYR A O 1 ATOM 713 C CB . TYR A 1 94 ? 5.904 -56.286 -75.774 1.00 72.05 ? 94 TYR A CB 1 ATOM 714 C CG . TYR A 1 94 ? 5.402 -55.343 -74.695 0.70 70.11 ? 94 TYR A CG 1 ATOM 715 C CD1 . TYR A 1 94 ? 4.252 -54.571 -74.893 0.70 67.07 ? 94 TYR A CD1 1 ATOM 716 C CD2 . TYR A 1 94 ? 6.078 -55.214 -73.481 0.70 71.18 ? 94 TYR A CD2 1 ATOM 717 C CE1 . TYR A 1 94 ? 3.786 -53.707 -73.911 0.70 65.31 ? 94 TYR A CE1 1 ATOM 718 C CE2 . TYR A 1 94 ? 5.619 -54.347 -72.491 0.70 69.45 ? 94 TYR A CE2 1 ATOM 719 C CZ . TYR A 1 94 ? 4.471 -53.599 -72.714 0.70 66.66 ? 94 TYR A CZ 1 ATOM 720 O OH . TYR A 1 94 ? 4.007 -52.738 -71.743 0.70 65.63 ? 94 TYR A OH 1 ATOM 721 N N . PRO A 1 95 ? 4.398 -56.681 -78.753 1.00 70.18 ? 95 PRO A N 1 ATOM 722 C CA . PRO A 1 95 ? 3.473 -55.576 -78.493 1.00 67.24 ? 95 PRO A CA 1 ATOM 723 C C . PRO A 1 95 ? 2.064 -56.037 -78.119 1.00 64.33 ? 95 PRO A C 1 ATOM 724 O O . PRO A 1 95 ? 1.759 -57.226 -78.209 1.00 64.77 ? 95 PRO A O 1 ATOM 725 C CB . PRO A 1 95 ? 3.440 -54.819 -79.831 1.00 67.73 ? 95 PRO A CB 1 ATOM 726 C CG . PRO A 1 95 ? 4.300 -55.615 -80.797 1.00 70.88 ? 95 PRO A CG 1 ATOM 727 C CD . PRO A 1 95 ? 4.492 -56.962 -80.194 1.00 71.62 ? 95 PRO A CD 1 ATOM 728 N N . ILE A 1 96 ? 1.223 -55.092 -77.700 1.00 61.66 ? 96 ILE A N 1 ATOM 729 C CA . ILE A 1 96 ? -0.144 -55.387 -77.279 1.00 59.00 ? 96 ILE A CA 1 ATOM 730 C C . ILE A 1 96 ? -1.140 -54.412 -77.911 1.00 57.16 ? 96 ILE A C 1 ATOM 731 O O . ILE A 1 96 ? -0.930 -53.193 -77.901 1.00 56.83 ? 96 ILE A O 1 ATOM 732 C CB . ILE A 1 96 ? -0.278 -55.379 -75.732 1.00 58.17 ? 96 ILE A CB 1 ATOM 733 C CG1 . ILE A 1 96 ? 0.532 -56.527 -75.126 1.00 60.02 ? 96 ILE A CG1 1 ATOM 734 C CG2 . ILE A 1 96 ? -1.735 -55.519 -75.299 1.00 55.97 ? 96 ILE A CG2 1 ATOM 735 C CD1 . ILE A 1 96 ? 0.869 -56.342 -73.665 1.00 60.61 ? 96 ILE A CD1 1 ATOM 736 N N . GLU A 1 97 ? -2.215 -54.967 -78.467 1.00 55.99 ? 97 GLU A N 1 ATOM 737 C CA . GLU A 1 97 ? -3.307 -54.175 -79.021 1.00 54.35 ? 97 GLU A CA 1 ATOM 738 C C . GLU A 1 97 ? -4.595 -54.449 -78.256 1.00 52.66 ? 97 GLU A C 1 ATOM 739 O O . GLU A 1 97 ? -5.007 -55.601 -78.111 1.00 52.96 ? 97 GLU A O 1 ATOM 740 C CB . GLU A 1 97 ? -3.498 -54.473 -80.512 1.00 55.15 ? 97 GLU A CB 1 ATOM 741 C CG . GLU A 1 97 ? -2.283 -54.166 -81.392 1.00 57.08 ? 97 GLU A CG 1 ATOM 742 C CD . GLU A 1 97 ? -1.921 -52.684 -81.451 1.00 56.95 ? 97 GLU A CD 1 ATOM 743 O OE1 . GLU A 1 97 ? -2.799 -51.824 -81.205 1.00 55.32 ? 97 GLU A OE1 1 ATOM 744 O OE2 . GLU A 1 97 ? -0.749 -52.380 -81.758 1.00 58.54 ? 97 GLU A OE2 1 ATOM 745 N N . ILE A 1 98 ? -5.214 -53.380 -77.759 1.00 51.29 ? 98 ILE A N 1 ATOM 746 C CA . ILE A 1 98 ? -6.473 -53.467 -77.016 1.00 49.95 ? 98 ILE A CA 1 ATOM 747 C C . ILE A 1 98 ? -7.540 -52.600 -77.682 1.00 49.09 ? 98 ILE A C 1 ATOM 748 O O . ILE A 1 98 ? -7.285 -51.445 -78.037 1.00 49.03 ? 98 ILE A O 1 ATOM 749 C CB . ILE A 1 98 ? -6.291 -53.050 -75.535 1.00 49.51 ? 98 ILE A CB 1 ATOM 750 C CG1 . ILE A 1 98 ? -5.325 -54.007 -74.837 1.00 50.84 ? 98 ILE A CG1 1 ATOM 751 C CG2 . ILE A 1 98 ? -7.629 -53.041 -74.788 1.00 48.37 ? 98 ILE A CG2 1 ATOM 752 C CD1 . ILE A 1 98 ? -4.521 -53.367 -73.740 1.00 51.38 ? 98 ILE A CD1 1 ATOM 753 N N . GLN A 1 99 ? -8.729 -53.170 -77.856 1.00 48.71 ? 99 GLN A N 1 ATOM 754 C CA . GLN A 1 99 ? -9.849 -52.449 -78.453 1.00 48.20 ? 99 GLN A CA 1 ATOM 755 C C . GLN A 1 99 ? -11.069 -52.453 -77.542 1.00 47.54 ? 99 GLN A C 1 ATOM 756 O O . GLN A 1 99 ? -11.368 -53.460 -76.902 1.00 47.72 ? 99 GLN A O 1 ATOM 757 C CB . GLN A 1 99 ? -10.207 -53.044 -79.814 1.00 49.09 ? 99 GLN A CB 1 ATOM 758 C CG . GLN A 1 99 ? -9.082 -52.988 -80.823 1.00 49.99 ? 99 GLN A CG 1 ATOM 759 C CD . GLN A 1 99 ? -9.368 -53.817 -82.043 1.00 51.24 ? 99 GLN A CD 1 ATOM 760 O OE1 . GLN A 1 99 ? -10.148 -53.422 -82.909 1.00 51.51 ? 99 GLN A OE1 1 ATOM 761 N NE2 . GLN A 1 99 ? -8.729 -54.974 -82.130 1.00 52.93 ? 99 GLN A NE2 1 ATOM 762 N N . LEU A 1 100 ? -11.756 -51.315 -77.484 1.00 47.09 ? 100 LEU A N 1 ATOM 763 C CA . LEU A 1 100 ? -12.992 -51.179 -76.719 1.00 46.98 ? 100 LEU A CA 1 ATOM 764 C C . LEU A 1 100 ? -14.161 -50.783 -77.608 1.00 47.37 ? 100 LEU A C 1 ATOM 765 O O . LEU A 1 100 ? -14.042 -49.889 -78.447 1.00 47.26 ? 100 LEU A O 1 ATOM 766 C CB . LEU A 1 100 ? -12.843 -50.147 -75.603 1.00 46.48 ? 100 LEU A CB 1 ATOM 767 C CG . LEU A 1 100 ? -12.292 -50.606 -74.257 1.00 46.75 ? 100 LEU A CG 1 ATOM 768 C CD1 . LEU A 1 100 ? -10.766 -50.582 -74.253 1.00 47.13 ? 100 LEU A CD1 1 ATOM 769 C CD2 . LEU A 1 100 ? -12.842 -49.708 -73.161 1.00 46.87 ? 100 LEU A CD2 1 ATOM 770 N N . SER A 1 101 ? -15.287 -51.462 -77.412 1.00 48.04 ? 101 SER A N 1 ATOM 771 C CA . SER A 1 101 ? -16.529 -51.124 -78.085 1.00 48.92 ? 101 SER A CA 1 ATOM 772 C C . SER A 1 101 ? -17.603 -50.861 -77.034 1.00 49.48 ? 101 SER A C 1 ATOM 773 O O . SER A 1 101 ? -18.143 -51.791 -76.434 1.00 50.27 ? 101 SER A O 1 ATOM 774 C CB . SER A 1 101 ? -16.948 -52.247 -79.032 1.00 49.92 ? 101 SER A CB 1 ATOM 775 O OG . SER A 1 101 ? -17.986 -51.822 -79.893 1.00 50.88 ? 101 SER A OG 1 ATOM 776 N N . ALA A 1 102 ? -17.888 -49.584 -76.801 1.00 49.46 ? 102 ALA A N 1 ATOM 777 C CA . ALA A 1 102 ? -18.824 -49.175 -75.761 1.00 50.22 ? 102 ALA A CA 1 ATOM 778 C C . ALA A 1 102 ? -19.958 -48.336 -76.333 1.00 51.43 ? 102 ALA A C 1 ATOM 779 O O . ALA A 1 102 ? -19.748 -47.523 -77.231 1.00 51.35 ? 102 ALA A O 1 ATOM 780 C CB . ALA A 1 102 ? -18.096 -48.405 -74.676 1.00 49.46 ? 102 ALA A CB 1 ATOM 781 N N . GLY A 1 103 ? -21.160 -48.537 -75.807 1.00 52.98 ? 103 GLY A N 1 ATOM 782 C CA . GLY A 1 103 ? -22.315 -47.763 -76.238 1.00 54.74 ? 103 GLY A CA 1 ATOM 783 C C . GLY A 1 103 ? -23.639 -48.423 -75.920 1.00 56.98 ? 103 GLY A C 1 ATOM 784 O O . GLY A 1 103 ? -23.740 -49.243 -75.002 1.00 57.33 ? 103 GLY A O 1 ATOM 785 N N . CYS A 1 104 ? -24.659 -48.054 -76.689 1.00 58.73 ? 104 CYS A N 1 ATOM 786 C CA . CYS A 1 104 ? -26.013 -48.539 -76.469 1.00 61.48 ? 104 CYS A CA 1 ATOM 787 C C . CYS A 1 104 ? -26.846 -48.473 -77.750 1.00 63.27 ? 104 CYS A C 1 ATOM 788 O O . CYS A 1 104 ? -26.686 -47.557 -78.559 1.00 62.83 ? 104 CYS A O 1 ATOM 789 C CB . CYS A 1 104 ? -26.684 -47.752 -75.332 1.00 62.62 ? 104 CYS A CB 1 ATOM 790 S SG . CYS A 1 104 ? -26.575 -45.935 -75.458 1.00 62.75 ? 104 CYS A SG 1 ATOM 791 N N . GLU A 1 105 ? -27.716 -49.464 -77.933 1.00 65.63 ? 105 GLU A N 1 ATOM 792 C CA . GLU A 1 105 ? -28.667 -49.480 -79.043 1.00 68.18 ? 105 GLU A CA 1 ATOM 793 C C . GLU A 1 105 ? -30.019 -48.950 -78.576 1.00 71.26 ? 105 GLU A C 1 ATOM 794 O O . GLU A 1 105 ? -30.470 -49.278 -77.477 1.00 72.36 ? 105 GLU A O 1 ATOM 795 C CB . GLU A 1 105 ? -28.818 -50.896 -79.605 1.00 69.23 ? 105 GLU A CB 1 ATOM 796 N N . MET A 1 106 ? -30.661 -48.135 -79.411 1.00 73.08 ? 106 MET A N 1 ATOM 797 C CA . MET A 1 106 ? -31.943 -47.515 -79.053 1.00 76.54 ? 106 MET A CA 1 ATOM 798 C C . MET A 1 106 ? -33.141 -48.208 -79.699 1.00 80.28 ? 106 MET A C 1 ATOM 799 O O . MET A 1 106 ? -33.097 -48.583 -80.873 1.00 80.65 ? 106 MET A O 1 ATOM 800 C CB . MET A 1 106 ? -31.953 -46.019 -79.394 1.00 76.37 ? 106 MET A CB 1 ATOM 801 C CG . MET A 1 106 ? -30.831 -45.204 -78.748 0.90 73.77 ? 106 MET A CG 1 ATOM 802 S SD . MET A 1 106 ? -30.677 -45.354 -76.950 0.90 73.60 ? 106 MET A SD 1 ATOM 803 C CE . MET A 1 106 ? -32.172 -44.536 -76.391 0.90 77.49 ? 106 MET A CE 1 ATOM 804 N N . TYR A 1 107 ? -34.207 -48.366 -78.916 1.00 83.50 ? 107 TYR A N 1 ATOM 805 C CA . TYR A 1 107 ? -35.434 -49.011 -79.373 1.00 87.77 ? 107 TYR A CA 1 ATOM 806 C C . TYR A 1 107 ? -36.654 -48.148 -79.052 1.00 91.46 ? 107 TYR A C 1 ATOM 807 O O . TYR A 1 107 ? -36.733 -47.569 -77.965 1.00 91.59 ? 107 TYR A O 1 ATOM 808 C CB . TYR A 1 107 ? -35.611 -50.378 -78.707 1.00 88.93 ? 107 TYR A CB 1 ATOM 809 C CG . TYR A 1 107 ? -34.436 -51.323 -78.832 1.00 86.02 ? 107 TYR A CG 1 ATOM 810 C CD1 . TYR A 1 107 ? -34.285 -52.137 -79.956 0.90 86.48 ? 107 TYR A CD1 1 ATOM 811 C CD2 . TYR A 1 107 ? -33.488 -51.423 -77.815 1.00 83.33 ? 107 TYR A CD2 1 ATOM 812 C CE1 . TYR A 1 107 ? -33.210 -53.015 -80.070 0.90 83.93 ? 107 TYR A CE1 1 ATOM 813 C CE2 . TYR A 1 107 ? -32.411 -52.296 -77.918 0.90 80.90 ? 107 TYR A CE2 1 ATOM 814 C CZ . TYR A 1 107 ? -32.278 -53.089 -79.047 0.90 81.27 ? 107 TYR A CZ 1 ATOM 815 O OH . TYR A 1 107 ? -31.213 -53.953 -79.149 0.90 79.13 ? 107 TYR A OH 1 ATOM 816 N N . PRO A 1 108 ? -37.611 -48.055 -79.995 1.00 94.88 ? 108 PRO A N 1 ATOM 817 C CA . PRO A 1 108 ? -38.885 -47.405 -79.682 1.00 99.16 ? 108 PRO A CA 1 ATOM 818 C C . PRO A 1 108 ? -39.726 -48.259 -78.725 1.00 102.52 ? 108 PRO A C 1 ATOM 819 O O . PRO A 1 108 ? -39.974 -49.432 -79.009 1.00 104.07 ? 108 PRO A O 1 ATOM 820 C CB . PRO A 1 108 ? -39.571 -47.286 -81.051 1.00 101.79 ? 108 PRO A CB 1 ATOM 821 C CG . PRO A 1 108 ? -38.927 -48.330 -81.901 1.00 100.10 ? 108 PRO A CG 1 ATOM 822 C CD . PRO A 1 108 ? -37.510 -48.425 -81.419 1.00 95.03 ? 108 PRO A CD 1 ATOM 823 N N . GLY A 1 109 ? -40.148 -47.691 -77.596 1.00 103.97 ? 109 GLY A N 1 ATOM 824 C CA . GLY A 1 109 ? -39.838 -46.311 -77.228 1.00 102.45 ? 109 GLY A CA 1 ATOM 825 C C . GLY A 1 109 ? -39.256 -46.186 -75.832 1.00 100.49 ? 109 GLY A C 1 ATOM 826 O O . GLY A 1 109 ? -39.758 -46.795 -74.881 1.00 102.71 ? 109 GLY A O 1 ATOM 827 N N . ASN A 1 110 ? -38.189 -45.396 -75.725 1.00 96.51 ? 110 ASN A N 1 ATOM 828 C CA . ASN A 1 110 ? -37.503 -45.092 -74.458 1.00 94.46 ? 110 ASN A CA 1 ATOM 829 C C . ASN A 1 110 ? -36.767 -46.267 -73.794 1.00 91.98 ? 110 ASN A C 1 ATOM 830 O O . ASN A 1 110 ? -36.252 -46.140 -72.678 1.00 90.77 ? 110 ASN A O 1 ATOM 831 C CB . ASN A 1 110 ? -38.448 -44.393 -73.463 1.00 98.33 ? 110 ASN A CB 1 ATOM 832 C CG . ASN A 1 110 ? -37.749 -43.310 -72.656 1.00 97.16 ? 110 ASN A CG 1 ATOM 833 O OD1 . ASN A 1 110 ? -36.934 -42.552 -73.189 1.00 94.89 ? 110 ASN A OD1 1 ATOM 834 N ND2 . ASN A 1 110 ? -38.070 -43.228 -71.367 1.00 99.95 ? 110 ASN A ND2 1 ATOM 835 N N . ALA A 1 111 ? -36.711 -47.401 -74.492 1.00 91.28 ? 111 ALA A N 1 ATOM 836 C CA . ALA A 1 111 ? -35.979 -48.577 -74.021 1.00 88.80 ? 111 ALA A CA 1 ATOM 837 C C . ALA A 1 111 ? -34.639 -48.709 -74.743 1.00 83.99 ? 111 ALA A C 1 ATOM 838 O O . ALA A 1 111 ? -34.521 -48.341 -75.917 1.00 83.24 ? 111 ALA A O 1 ATOM 839 C CB . ALA A 1 111 ? -36.817 -49.834 -74.213 1.00 92.08 ? 111 ALA A CB 1 ATOM 840 N N . SER A 1 112 ? -33.636 -49.231 -74.038 1.00 80.74 ? 112 SER A N 1 ATOM 841 C CA . SER A 1 112 ? -32.298 -49.419 -74.605 1.00 76.26 ? 112 SER A CA 1 ATOM 842 C C . SER A 1 112 ? -31.502 -50.528 -73.915 1.00 74.26 ? 112 SER A C 1 ATOM 843 O O . SER A 1 112 ? -31.753 -50.861 -72.755 1.00 75.44 ? 112 SER A O 1 ATOM 844 C CB . SER A 1 112 ? -31.506 -48.109 -74.554 1.00 73.79 ? 112 SER A CB 1 ATOM 845 O OG . SER A 1 112 ? -31.246 -47.720 -73.217 1.00 73.55 ? 112 SER A OG 1 ATOM 846 N N . GLU A 1 113 ? -30.543 -51.094 -74.645 1.00 71.24 ? 113 GLU A N 1 ATOM 847 C CA . GLU A 1 113 ? -29.594 -52.055 -74.088 1.00 68.92 ? 113 GLU A CA 1 ATOM 848 C C . GLU A 1 113 ? -28.169 -51.551 -74.295 1.00 64.81 ? 113 GLU A C 1 ATOM 849 O O . GLU A 1 113 ? -27.778 -51.216 -75.414 1.00 63.61 ? 113 GLU A O 1 ATOM 850 C CB . GLU A 1 113 ? -29.771 -53.437 -74.725 1.00 70.20 ? 113 GLU A CB 1 ATOM 851 C CG . GLU A 1 113 ? -31.012 -54.186 -74.264 1.00 74.05 ? 113 GLU A CG 1 ATOM 852 N N . SER A 1 114 ? -27.404 -51.493 -73.209 1.00 62.75 ? 114 SER A N 1 ATOM 853 C CA . SER A 1 114 ? -26.020 -51.022 -73.256 1.00 59.10 ? 114 SER A CA 1 ATOM 854 C C . SER A 1 114 ? -25.026 -52.174 -73.383 1.00 57.34 ? 114 SER A C 1 ATOM 855 O O . SER A 1 114 ? -25.373 -53.332 -73.146 1.00 58.64 ? 114 SER A O 1 ATOM 856 C CB . SER A 1 114 ? -25.701 -50.183 -72.018 1.00 58.48 ? 114 SER A CB 1 ATOM 857 O OG . SER A 1 114 ? -26.427 -48.971 -72.038 1.00 59.54 ? 114 SER A OG 1 ATOM 858 N N . PHE A 1 115 ? -23.794 -51.842 -73.765 1.00 54.47 ? 115 PHE A N 1 ATOM 859 C CA . PHE A 1 115 ? -22.717 -52.823 -73.909 1.00 52.88 ? 115 PHE A CA 1 ATOM 860 C C . PHE A 1 115 ? -21.343 -52.187 -73.720 1.00 50.25 ? 115 PHE A C 1 ATOM 861 O O . PHE A 1 115 ? -21.152 -51.001 -73.990 1.00 49.32 ? 115 PHE A O 1 ATOM 862 C CB . PHE A 1 115 ? -22.785 -53.526 -75.277 1.00 53.40 ? 115 PHE A CB 1 ATOM 863 C CG . PHE A 1 115 ? -22.798 -52.580 -76.450 1.00 53.08 ? 115 PHE A CG 1 ATOM 864 C CD1 . PHE A 1 115 ? -24.002 -52.169 -77.014 1.00 54.61 ? 115 PHE A CD1 1 ATOM 865 C CD2 . PHE A 1 115 ? -21.606 -52.097 -76.988 1.00 51.25 ? 115 PHE A CD2 1 ATOM 866 C CE1 . PHE A 1 115 ? -24.020 -51.290 -78.090 1.00 54.58 ? 115 PHE A CE1 1 ATOM 867 C CE2 . PHE A 1 115 ? -21.615 -51.215 -78.063 1.00 51.12 ? 115 PHE A CE2 1 ATOM 868 C CZ . PHE A 1 115 ? -22.824 -50.811 -78.616 1.00 52.79 ? 115 PHE A CZ 1 ATOM 869 N N . LEU A 1 116 ? -20.395 -52.988 -73.246 1.00 49.21 ? 116 LEU A N 1 ATOM 870 C CA . LEU A 1 116 ? -18.993 -52.595 -73.193 1.00 47.04 ? 116 LEU A CA 1 ATOM 871 C C . LEU A 1 116 ? -18.150 -53.823 -73.504 1.00 46.67 ? 116 LEU A C 1 ATOM 872 O O . LEU A 1 116 ? -17.944 -54.676 -72.640 1.00 47.19 ? 116 LEU A O 1 ATOM 873 C CB . LEU A 1 116 ? -18.630 -52.030 -71.817 1.00 46.62 ? 116 LEU A CB 1 ATOM 874 C CG . LEU A 1 116 ? -17.528 -50.965 -71.727 1.00 45.18 ? 116 LEU A CG 1 ATOM 875 C CD1 . LEU A 1 116 ? -17.446 -50.433 -70.308 1.00 45.65 ? 116 LEU A CD1 1 ATOM 876 C CD2 . LEU A 1 116 ? -16.157 -51.463 -72.188 1.00 43.85 ? 116 LEU A CD2 1 ATOM 877 N N . HIS A 1 117 ? -17.679 -53.915 -74.745 1.00 45.96 ? 117 HIS A N 1 ATOM 878 C CA . HIS A 1 117 ? -16.864 -55.046 -75.175 1.00 45.84 ? 117 HIS A CA 1 ATOM 879 C C . HIS A 1 117 ? -15.386 -54.680 -75.264 1.00 44.38 ? 117 HIS A C 1 ATOM 880 O O . HIS A 1 117 ? -15.032 -53.598 -75.737 1.00 43.44 ? 117 HIS A O 1 ATOM 881 C CB . HIS A 1 117 ? -17.356 -55.602 -76.515 1.00 46.85 ? 117 HIS A CB 1 ATOM 882 C CG . HIS A 1 117 ? -18.732 -56.194 -76.461 1.00 48.86 ? 117 HIS A CG 1 ATOM 883 N ND1 . HIS A 1 117 ? -19.308 -56.644 -75.293 1.00 49.79 ? 117 HIS A ND1 1 ATOM 884 C CD2 . HIS A 1 117 ? -19.634 -56.436 -77.442 1.00 50.44 ? 117 HIS A CD2 1 ATOM 885 C CE1 . HIS A 1 117 ? -20.513 -57.120 -75.552 1.00 51.54 ? 117 HIS A CE1 1 ATOM 886 N NE2 . HIS A 1 117 ? -20.734 -57.007 -76.849 1.00 51.84 ? 117 HIS A NE2 1 ATOM 887 N N . VAL A 1 118 ? -14.534 -55.591 -74.797 1.00 44.28 ? 118 VAL A N 1 ATOM 888 C CA . VAL A 1 118 ? -13.084 -55.413 -74.848 1.00 43.39 ? 118 VAL A CA 1 ATOM 889 C C . VAL A 1 118 ? -12.447 -56.589 -75.582 1.00 44.22 ? 118 VAL A C 1 ATOM 890 O O . VAL A 1 118 ? -12.737 -57.749 -75.277 1.00 45.34 ? 118 VAL A O 1 ATOM 891 C CB . VAL A 1 118 ? -12.462 -55.264 -73.427 1.00 43.02 ? 118 VAL A CB 1 ATOM 892 C CG1 . VAL A 1 118 ? -10.942 -55.167 -73.498 1.00 42.49 ? 118 VAL A CG1 1 ATOM 893 C CG2 . VAL A 1 118 ? -13.023 -54.040 -72.712 1.00 42.28 ? 118 VAL A CG2 1 ATOM 894 N N . ALA A 1 119 ? -11.590 -56.279 -76.554 1.00 43.94 ? 119 ALA A N 1 ATOM 895 C CA . ALA A 1 119 ? -10.830 -57.300 -77.276 1.00 44.92 ? 119 ALA A CA 1 ATOM 896 C C . ALA A 1 119 ? -9.331 -57.201 -76.994 1.00 44.88 ? 119 ALA A C 1 ATOM 897 O O . ALA A 1 119 ? -8.800 -56.109 -76.779 1.00 44.03 ? 119 ALA A O 1 ATOM 898 C CB . ALA A 1 119 ? -11.099 -57.217 -78.771 1.00 45.40 ? 119 ALA A CB 1 ATOM 899 N N . PHE A 1 120 ? -8.663 -58.354 -76.998 1.00 46.00 ? 120 PHE A N 1 ATOM 900 C CA . PHE A 1 120 ? -7.224 -58.446 -76.773 1.00 46.38 ? 120 PHE A CA 1 ATOM 901 C C . PHE A 1 120 ? -6.577 -59.148 -77.963 1.00 48.00 ? 120 PHE A C 1 ATOM 902 O O . PHE A 1 120 ? -6.869 -60.317 -78.243 1.00 49.24 ? 120 PHE A O 1 ATOM 903 C CB . PHE A 1 120 ? -6.952 -59.199 -75.468 1.00 46.83 ? 120 PHE A CB 1 ATOM 904 C CG . PHE A 1 120 ? -5.493 -59.389 -75.150 1.00 47.72 ? 120 PHE A CG 1 ATOM 905 C CD1 . PHE A 1 120 ? -4.752 -58.364 -74.568 1.00 47.01 ? 120 PHE A CD1 1 ATOM 906 C CD2 . PHE A 1 120 ? -4.871 -60.612 -75.390 1.00 49.41 ? 120 PHE A CD2 1 ATOM 907 C CE1 . PHE A 1 120 ? -3.401 -58.546 -74.257 1.00 48.47 ? 120 PHE A CE1 1 ATOM 908 C CE2 . PHE A 1 120 ? -3.524 -60.803 -75.082 1.00 50.76 ? 120 PHE A CE2 1 ATOM 909 C CZ . PHE A 1 120 ? -2.788 -59.766 -74.514 1.00 50.25 ? 120 PHE A CZ 1 ATOM 910 N N . GLN A 1 121 ? -5.707 -58.414 -78.660 1.00 48.14 ? 121 GLN A N 1 ATOM 911 C CA . GLN A 1 121 ? -5.042 -58.870 -79.892 1.00 49.67 ? 121 GLN A CA 1 ATOM 912 C C . GLN A 1 121 ? -6.031 -59.174 -81.024 1.00 49.98 ? 121 GLN A C 1 ATOM 913 O O . GLN A 1 121 ? -5.741 -59.970 -81.920 1.00 51.87 ? 121 GLN A O 1 ATOM 914 C CB . GLN A 1 121 ? -4.101 -60.063 -79.636 1.00 51.53 ? 121 GLN A CB 1 ATOM 915 C CG . GLN A 1 121 ? -3.133 -59.899 -78.459 1.00 51.56 ? 121 GLN A CG 1 ATOM 916 C CD . GLN A 1 121 ? -1.980 -58.937 -78.723 1.00 52.17 ? 121 GLN A CD 1 ATOM 917 O OE1 . GLN A 1 121 ? -2.169 -57.838 -79.246 1.00 51.40 ? 121 GLN A OE1 1 ATOM 918 N NE2 . GLN A 1 121 ? -0.776 -59.345 -78.333 1.00 53.45 ? 121 GLN A NE2 1 ATOM 919 N N . GLY A 1 122 ? -7.193 -58.528 -80.978 1.00 48.54 ? 122 GLY A N 1 ATOM 920 C CA . GLY A 1 122 ? -8.224 -58.704 -82.000 1.00 49.04 ? 122 GLY A CA 1 ATOM 921 C C . GLY A 1 122 ? -9.224 -59.810 -81.711 1.00 49.66 ? 122 GLY A C 1 ATOM 922 O O . GLY A 1 122 ? -10.025 -60.165 -82.574 1.00 50.66 ? 122 GLY A O 1 ATOM 923 N N . LYS A 1 123 ? -9.176 -60.355 -80.499 1.00 49.52 ? 123 LYS A N 1 ATOM 924 C CA . LYS A 1 123 ? -10.132 -61.366 -80.061 1.00 50.49 ? 123 LYS A CA 1 ATOM 925 C C . LYS A 1 123 ? -10.924 -60.863 -78.856 1.00 49.13 ? 123 LYS A C 1 ATOM 926 O O . LYS A 1 123 ? -10.342 -60.380 -77.878 1.00 48.29 ? 123 LYS A O 1 ATOM 927 C CB . LYS A 1 123 ? -9.413 -62.675 -79.720 1.00 52.29 ? 123 LYS A CB 1 ATOM 928 C CG . LYS A 1 123 ? -10.340 -63.865 -79.532 1.00 54.35 ? 123 LYS A CG 1 ATOM 929 C CD . LYS A 1 123 ? -9.566 -65.119 -79.137 1.00 56.97 ? 123 LYS A CD 1 ATOM 930 C CE . LYS A 1 123 ? -10.430 -66.379 -79.239 1.00 59.00 ? 123 LYS A CE 1 ATOM 931 N NZ . LYS A 1 123 ? -10.827 -66.699 -80.642 1.00 59.84 ? 123 LYS A NZ 1 ATOM 932 N N . TYR A 1 124 ? -12.248 -60.980 -78.939 1.00 49.33 ? 124 TYR A N 1 ATOM 933 C CA . TYR A 1 124 ? -13.168 -60.561 -77.876 1.00 48.39 ? 124 TYR A CA 1 ATOM 934 C C . TYR A 1 124 ? -13.000 -61.441 -76.633 1.00 48.97 ? 124 TYR A C 1 ATOM 935 O O . TYR A 1 124 ? -13.151 -62.662 -76.709 1.00 50.88 ? 124 TYR A O 1 ATOM 936 C CB . TYR A 1 124 ? -14.606 -60.602 -78.417 1.00 49.22 ? 124 TYR A CB 1 ATOM 937 C CG . TYR A 1 124 ? -15.733 -60.416 -77.416 1.00 49.20 ? 124 TYR A CG 1 ATOM 938 C CD1 . TYR A 1 124 ? -15.713 -59.384 -76.473 1.00 47.73 ? 124 TYR A CD1 1 ATOM 939 C CD2 . TYR A 1 124 ? -16.850 -61.251 -77.451 1.00 50.96 ? 124 TYR A CD2 1 ATOM 940 C CE1 . TYR A 1 124 ? -16.764 -59.212 -75.571 1.00 48.18 ? 124 TYR A CE1 1 ATOM 941 C CE2 . TYR A 1 124 ? -17.904 -61.087 -76.564 1.00 51.50 ? 124 TYR A CE2 1 ATOM 942 C CZ . TYR A 1 124 ? -17.857 -60.067 -75.626 1.00 50.31 ? 124 TYR A CZ 1 ATOM 943 O OH . TYR A 1 124 ? -18.906 -59.914 -74.745 1.00 50.77 ? 124 TYR A OH 1 ATOM 944 N N . VAL A 1 125 ? -12.676 -60.816 -75.500 1.00 47.56 ? 125 VAL A N 1 ATOM 945 C CA . VAL A 1 125 ? -12.344 -61.560 -74.272 1.00 48.09 ? 125 VAL A CA 1 ATOM 946 C C . VAL A 1 125 ? -13.114 -61.153 -73.015 1.00 47.60 ? 125 VAL A C 1 ATOM 947 O O . VAL A 1 125 ? -13.405 -61.995 -72.166 1.00 48.79 ? 125 VAL A O 1 ATOM 948 C CB . VAL A 1 125 ? -10.823 -61.524 -73.943 1.00 47.82 ? 125 VAL A CB 1 ATOM 949 C CG1 . VAL A 1 125 ? -10.046 -62.468 -74.851 1.00 49.00 ? 125 VAL A CG1 1 ATOM 950 C CG2 . VAL A 1 125 ? -10.267 -60.095 -74.001 1.00 45.99 ? 125 VAL A CG2 1 ATOM 951 N N . VAL A 1 126 ? -13.424 -59.866 -72.893 1.00 46.10 ? 126 VAL A N 1 ATOM 952 C CA . VAL A 1 126 ? -14.026 -59.329 -71.674 1.00 45.88 ? 126 VAL A CA 1 ATOM 953 C C . VAL A 1 126 ? -15.191 -58.389 -71.993 1.00 45.59 ? 126 VAL A C 1 ATOM 954 O O . VAL A 1 126 ? -15.170 -57.675 -72.999 1.00 44.82 ? 126 VAL A O 1 ATOM 955 C CB . VAL A 1 126 ? -12.960 -58.613 -70.782 1.00 44.79 ? 126 VAL A CB 1 ATOM 956 C CG1 . VAL A 1 126 ? -13.602 -57.868 -69.621 1.00 44.51 ? 126 VAL A CG1 1 ATOM 957 C CG2 . VAL A 1 126 ? -11.941 -59.611 -70.253 1.00 45.57 ? 126 VAL A CG2 1 ATOM 958 N N . ARG A 1 127 ? -16.206 -58.420 -71.131 1.00 46.54 ? 127 ARG A N 1 ATOM 959 C CA . ARG A 1 127 ? -17.344 -57.503 -71.192 1.00 46.67 ? 127 ARG A CA 1 ATOM 960 C C . ARG A 1 127 ? -17.735 -57.039 -69.793 1.00 47.22 ? 127 ARG A C 1 ATOM 961 O O . ARG A 1 127 ? -17.584 -57.784 -68.817 1.00 48.29 ? 127 ARG A O 1 ATOM 962 C CB . ARG A 1 127 ? -18.547 -58.158 -71.887 1.00 48.33 ? 127 ARG A CB 1 ATOM 963 C CG . ARG A 1 127 ? -18.795 -59.620 -71.499 1.00 50.23 ? 127 ARG A CG 1 ATOM 964 C CD . ARG A 1 127 ? -19.987 -59.808 -70.573 1.00 51.34 ? 127 ARG A CD 1 ATOM 965 N NE . ARG A 1 127 ? -21.223 -60.026 -71.323 1.00 52.78 ? 127 ARG A NE 1 ATOM 966 C CZ . ARG A 1 127 ? -22.195 -60.863 -70.964 1.00 55.10 ? 127 ARG A CZ 1 ATOM 967 N NH1 . ARG A 1 127 ? -22.092 -61.590 -69.859 1.00 56.25 ? 127 ARG A NH1 1 ATOM 968 N NH2 . ARG A 1 127 ? -23.276 -60.980 -71.721 1.00 56.55 ? 127 ARG A NH2 1 ATOM 969 N N . PHE A 1 128 ? -18.220 -55.802 -69.694 1.00 46.69 ? 128 PHE A N 1 ATOM 970 C CA . PHE A 1 128 ? -18.826 -55.337 -68.455 1.00 47.50 ? 128 PHE A CA 1 ATOM 971 C C . PHE A 1 128 ? -20.266 -55.823 -68.417 1.00 49.66 ? 128 PHE A C 1 ATOM 972 O O . PHE A 1 128 ? -21.055 -55.524 -69.314 1.00 49.97 ? 128 PHE A O 1 ATOM 973 C CB . PHE A 1 128 ? -18.765 -53.813 -68.325 1.00 46.48 ? 128 PHE A CB 1 ATOM 974 C CG . PHE A 1 128 ? -19.012 -53.316 -66.924 1.00 47.11 ? 128 PHE A CG 1 ATOM 975 C CD1 . PHE A 1 128 ? -17.947 -53.101 -66.052 1.00 46.41 ? 128 PHE A CD1 1 ATOM 976 C CD2 . PHE A 1 128 ? -20.305 -53.074 -66.472 1.00 48.61 ? 128 PHE A CD2 1 ATOM 977 C CE1 . PHE A 1 128 ? -18.166 -52.646 -64.754 1.00 47.30 ? 128 PHE A CE1 1 ATOM 978 C CE2 . PHE A 1 128 ? -20.534 -52.619 -65.174 1.00 49.94 ? 128 PHE A CE2 1 ATOM 979 C CZ . PHE A 1 128 ? -19.462 -52.405 -64.313 1.00 48.98 ? 128 PHE A CZ 1 ATOM 980 N N . TRP A 1 129 ? -20.595 -56.585 -67.379 1.00 51.54 ? 129 TRP A N 1 ATOM 981 C CA . TRP A 1 129 ? -21.928 -57.160 -67.232 1.00 54.24 ? 129 TRP A CA 1 ATOM 982 C C . TRP A 1 129 ? -22.468 -56.933 -65.830 1.00 55.99 ? 129 TRP A C 1 ATOM 983 O O . TRP A 1 129 ? -21.934 -57.464 -64.854 1.00 56.47 ? 129 TRP A O 1 ATOM 984 C CB . TRP A 1 129 ? -21.904 -58.654 -67.562 1.00 55.51 ? 129 TRP A CB 1 ATOM 985 C CG . TRP A 1 129 ? -23.261 -59.240 -67.794 1.00 58.35 ? 129 TRP A CG 1 ATOM 986 C CD1 . TRP A 1 129 ? -23.895 -60.170 -67.023 1.00 60.94 ? 129 TRP A CD1 1 ATOM 987 C CD2 . TRP A 1 129 ? -24.158 -58.931 -68.870 1.00 58.93 ? 129 TRP A CD2 1 ATOM 988 N NE1 . TRP A 1 129 ? -25.127 -60.464 -67.553 1.00 63.48 ? 129 TRP A NE1 1 ATOM 989 C CE2 . TRP A 1 129 ? -25.315 -59.717 -68.686 1.00 62.14 ? 129 TRP A CE2 1 ATOM 990 C CE3 . TRP A 1 129 ? -24.094 -58.066 -69.972 1.00 57.39 ? 129 TRP A CE3 1 ATOM 991 C CZ2 . TRP A 1 129 ? -26.402 -59.666 -69.563 1.00 64.24 ? 129 TRP A CZ2 1 ATOM 992 C CZ3 . TRP A 1 129 ? -25.174 -58.013 -70.843 1.00 59.28 ? 129 TRP A CZ3 1 ATOM 993 C CH2 . TRP A 1 129 ? -26.314 -58.810 -70.633 1.00 62.82 ? 129 TRP A CH2 1 ATOM 994 N N . GLY A 1 130 ? -23.526 -56.132 -65.742 1.00 57.35 ? 130 GLY A N 1 ATOM 995 C CA . GLY A 1 130 ? -24.149 -55.798 -64.467 1.00 59.60 ? 130 GLY A CA 1 ATOM 996 C C . GLY A 1 130 ? -23.324 -54.835 -63.634 1.00 58.36 ? 130 GLY A C 1 ATOM 997 O O . GLY A 1 130 ? -23.414 -53.616 -63.807 1.00 57.49 ? 130 GLY A O 1 ATOM 998 N N . THR A 1 131 ? -22.516 -55.391 -62.732 1.00 58.53 ? 131 THR A N 1 ATOM 999 C CA . THR A 1 131 ? -21.731 -54.601 -61.784 1.00 58.04 ? 131 THR A CA 1 ATOM 1000 C C . THR A 1 131 ? -20.228 -54.893 -61.832 1.00 56.19 ? 131 THR A C 1 ATOM 1001 O O . THR A 1 131 ? -19.475 -54.380 -61.004 1.00 55.95 ? 131 THR A O 1 ATOM 1002 C CB . THR A 1 131 ? -22.217 -54.813 -60.323 1.00 60.74 ? 131 THR A CB 1 ATOM 1003 O OG1 . THR A 1 131 ? -22.117 -56.200 -59.975 1.00 62.07 ? 131 THR A OG1 1 ATOM 1004 C CG2 . THR A 1 131 ? -23.657 -54.337 -60.138 1.00 63.12 ? 131 THR A CG2 1 ATOM 1005 N N . SER A 1 132 ? -19.789 -55.708 -62.789 1.00 55.42 ? 132 SER A N 1 ATOM 1006 C CA . SER A 1 132 ? -18.384 -56.136 -62.832 1.00 54.28 ? 132 SER A CA 1 ATOM 1007 C C . SER A 1 132 ? -17.876 -56.481 -64.232 1.00 52.88 ? 132 SER A C 1 ATOM 1008 O O . SER A 1 132 ? -18.640 -56.490 -65.197 1.00 52.98 ? 132 SER A O 1 ATOM 1009 C CB . SER A 1 132 ? -18.160 -57.324 -61.884 1.00 55.93 ? 132 SER A CB 1 ATOM 1010 O OG . SER A 1 132 ? -19.085 -58.369 -62.138 1.00 57.75 ? 132 SER A OG 1 ATOM 1011 N N . TRP A 1 133 ? -16.572 -56.744 -64.326 1.00 52.06 ? 133 TRP A N 1 ATOM 1012 C CA . TRP A 1 133 ? -15.957 -57.268 -65.542 1.00 51.39 ? 133 TRP A CA 1 ATOM 1013 C C . TRP A 1 133 ? -16.122 -58.786 -65.582 1.00 53.09 ? 133 TRP A C 1 ATOM 1014 O O . TRP A 1 133 ? -15.976 -59.460 -64.557 1.00 54.40 ? 133 TRP A O 1 ATOM 1015 C CB . TRP A 1 133 ? -14.467 -56.918 -65.597 1.00 50.04 ? 133 TRP A CB 1 ATOM 1016 C CG . TRP A 1 133 ? -14.170 -55.447 -65.605 1.00 49.12 ? 133 TRP A CG 1 ATOM 1017 C CD1 . TRP A 1 133 ? -13.684 -54.704 -64.568 1.00 49.53 ? 133 TRP A CD1 1 ATOM 1018 C CD2 . TRP A 1 133 ? -14.330 -54.541 -66.704 1.00 48.01 ? 133 TRP A CD2 1 ATOM 1019 N NE1 . TRP A 1 133 ? -13.534 -53.393 -64.950 1.00 48.46 ? 133 TRP A NE1 1 ATOM 1020 C CE2 . TRP A 1 133 ? -13.926 -53.265 -66.256 1.00 47.73 ? 133 TRP A CE2 1 ATOM 1021 C CE3 . TRP A 1 133 ? -14.784 -54.682 -68.021 1.00 47.92 ? 133 TRP A CE3 1 ATOM 1022 C CZ2 . TRP A 1 133 ? -13.960 -52.135 -67.080 1.00 47.29 ? 133 TRP A CZ2 1 ATOM 1023 C CZ3 . TRP A 1 133 ? -14.817 -53.558 -68.841 1.00 47.09 ? 133 TRP A CZ3 1 ATOM 1024 C CH2 . TRP A 1 133 ? -14.407 -52.303 -68.367 1.00 46.70 ? 133 TRP A CH2 1 ATOM 1025 N N . GLN A 1 134 ? -16.430 -59.316 -66.762 1.00 53.43 ? 134 GLN A N 1 ATOM 1026 C CA . GLN A 1 134 ? -16.584 -60.761 -66.943 1.00 55.50 ? 134 GLN A CA 1 ATOM 1027 C C . GLN A 1 134 ? -15.869 -61.265 -68.191 1.00 55.00 ? 134 GLN A C 1 ATOM 1028 O O . GLN A 1 134 ? -15.992 -60.678 -69.268 1.00 53.95 ? 134 GLN A O 1 ATOM 1029 C CB . GLN A 1 134 ? -18.065 -61.152 -66.993 1.00 57.41 ? 134 GLN A CB 1 ATOM 1030 C CG . GLN A 1 134 ? -18.741 -61.187 -65.626 1.00 59.85 ? 134 GLN A CG 1 ATOM 1031 C CD . GLN A 1 134 ? -20.219 -61.542 -65.695 1.00 62.83 ? 134 GLN A CD 1 ATOM 1032 O OE1 . GLN A 1 134 ? -20.615 -62.508 -66.354 1.00 64.56 ? 134 GLN A OE1 1 ATOM 1033 N NE2 . GLN A 1 134 ? -21.043 -60.766 -64.999 1.00 63.47 ? 134 GLN A NE2 1 ATOM 1034 N N . THR A 1 135 ? -15.115 -62.350 -68.036 1.00 56.12 ? 135 THR A N 1 ATOM 1035 C CA . THR A 1 135 ? -14.511 -63.030 -69.175 1.00 56.40 ? 135 THR A CA 1 ATOM 1036 C C . THR A 1 135 ? -15.598 -63.780 -69.933 1.00 58.29 ? 135 THR A C 1 ATOM 1037 O O . THR A 1 135 ? -16.537 -64.307 -69.329 1.00 60.12 ? 135 THR A O 1 ATOM 1038 C CB . THR A 1 135 ? -13.390 -64.022 -68.762 1.00 57.37 ? 135 THR A CB 1 ATOM 1039 O OG1 . THR A 1 135 ? -13.903 -64.986 -67.836 1.00 59.65 ? 135 THR A OG1 1 ATOM 1040 C CG2 . THR A 1 135 ? -12.213 -63.293 -68.135 1.00 55.75 ? 135 THR A CG2 1 ATOM 1041 N N . VAL A 1 136 ? -15.474 -63.809 -71.255 1.00 58.20 ? 136 VAL A N 1 ATOM 1042 C CA . VAL A 1 136 ? -16.430 -64.511 -72.104 1.00 60.34 ? 136 VAL A CA 1 ATOM 1043 C C . VAL A 1 136 ? -16.100 -66.009 -72.159 1.00 62.99 ? 136 VAL A C 1 ATOM 1044 O O . VAL A 1 136 ? -14.995 -66.406 -71.784 1.00 62.93 ? 136 VAL A O 1 ATOM 1045 C CB . VAL A 1 136 ? -16.490 -63.890 -73.525 1.00 59.32 ? 136 VAL A CB 1 ATOM 1046 C CG1 . VAL A 1 136 ? -16.837 -62.416 -73.436 1.00 57.14 ? 136 VAL A CG1 1 ATOM 1047 C CG2 . VAL A 1 136 ? -15.176 -64.095 -74.282 1.00 58.85 ? 136 VAL A CG2 1 ATOM 1048 N N . PRO A 1 137 ? -17.062 -66.850 -72.598 1.00 65.75 ? 137 PRO A N 1 ATOM 1049 C CA . PRO A 1 137 ? -16.741 -68.271 -72.775 1.00 68.50 ? 137 PRO A CA 1 ATOM 1050 C C . PRO A 1 137 ? -15.669 -68.489 -73.847 1.00 68.27 ? 137 PRO A C 1 ATOM 1051 O O . PRO A 1 137 ? -15.700 -67.843 -74.898 1.00 67.10 ? 137 PRO A O 1 ATOM 1052 C CB . PRO A 1 137 ? -18.079 -68.891 -73.205 1.00 71.19 ? 137 PRO A CB 1 ATOM 1053 C CG . PRO A 1 137 ? -18.927 -67.738 -73.647 1.00 69.81 ? 137 PRO A CG 1 ATOM 1054 C CD . PRO A 1 137 ? -18.497 -66.583 -72.809 1.00 66.73 ? 137 PRO A CD 1 ATOM 1055 N N . GLY A 1 138 ? -14.722 -69.380 -73.560 1.00 69.68 ? 138 GLY A N 1 ATOM 1056 C CA . GLY A 1 138 ? -13.599 -69.658 -74.458 1.00 69.89 ? 138 GLY A CA 1 ATOM 1057 C C . GLY A 1 138 ? -12.498 -68.609 -74.402 1.00 67.25 ? 138 GLY A C 1 ATOM 1058 O O . GLY A 1 138 ? -11.859 -68.322 -75.418 1.00 66.90 ? 138 GLY A O 1 ATOM 1059 N N . ALA A 1 139 ? -12.278 -68.039 -73.218 1.00 65.70 ? 139 ALA A N 1 ATOM 1060 C CA . ALA A 1 139 ? -11.256 -67.008 -73.019 1.00 63.34 ? 139 ALA A CA 1 ATOM 1061 C C . ALA A 1 139 ? -10.048 -67.574 -72.267 1.00 64.17 ? 139 ALA A C 1 ATOM 1062 O O . ALA A 1 139 ? -10.203 -68.506 -71.472 1.00 66.11 ? 139 ALA A O 1 ATOM 1063 C CB . ALA A 1 139 ? -11.843 -65.813 -72.270 1.00 61.25 ? 139 ALA A CB 1 ATOM 1064 N N . PRO A 1 140 ? -8.842 -67.013 -72.508 1.00 63.03 ? 140 PRO A N 1 ATOM 1065 C CA . PRO A 1 140 ? -7.635 -67.548 -71.870 1.00 64.03 ? 140 PRO A CA 1 ATOM 1066 C C . PRO A 1 140 ? -7.691 -67.397 -70.353 1.00 63.58 ? 140 PRO A C 1 ATOM 1067 O O . PRO A 1 140 ? -8.084 -66.342 -69.851 1.00 61.61 ? 140 PRO A O 1 ATOM 1068 C CB . PRO A 1 140 ? -6.509 -66.686 -72.452 1.00 62.87 ? 140 PRO A CB 1 ATOM 1069 C CG . PRO A 1 140 ? -7.096 -65.998 -73.630 1.00 61.73 ? 140 PRO A CG 1 ATOM 1070 C CD . PRO A 1 140 ? -8.538 -65.822 -73.320 1.00 60.97 ? 140 PRO A CD 1 ATOM 1071 N N . SER A 1 141 ? -7.294 -68.451 -69.642 1.00 65.52 ? 141 SER A N 1 ATOM 1072 C CA . SER A 1 141 ? -7.442 -68.519 -68.186 1.00 65.69 ? 141 SER A CA 1 ATOM 1073 C C . SER A 1 141 ? -6.534 -67.567 -67.407 1.00 64.18 ? 141 SER A C 1 ATOM 1074 O O . SER A 1 141 ? -6.749 -67.351 -66.214 1.00 64.10 ? 141 SER A O 1 ATOM 1075 C CB . SER A 1 141 ? -7.246 -69.957 -67.694 1.00 68.79 ? 141 SER A CB 1 ATOM 1076 O OG . SER A 1 141 ? -5.935 -70.418 -67.971 1.00 70.30 ? 141 SER A OG 1 ATOM 1077 N N . TRP A 1 142 ? -5.534 -66.993 -68.078 1.00 63.14 ? 142 TRP A N 1 ATOM 1078 C CA . TRP A 1 142 ? -4.638 -66.029 -67.434 1.00 62.03 ? 142 TRP A CA 1 ATOM 1079 C C . TRP A 1 142 ? -5.307 -64.680 -67.171 1.00 59.58 ? 142 TRP A C 1 ATOM 1080 O O . TRP A 1 142 ? -4.786 -63.865 -66.412 1.00 59.09 ? 142 TRP A O 1 ATOM 1081 C CB . TRP A 1 142 ? -3.321 -65.854 -68.208 1.00 62.41 ? 142 TRP A CB 1 ATOM 1082 C CG . TRP A 1 142 ? -3.463 -65.386 -69.630 1.00 61.22 ? 142 TRP A CG 1 ATOM 1083 C CD1 . TRP A 1 142 ? -3.369 -66.155 -70.754 1.00 62.40 ? 142 TRP A CD1 1 ATOM 1084 C CD2 . TRP A 1 142 ? -3.698 -64.044 -70.082 1.00 58.86 ? 142 TRP A CD2 1 ATOM 1085 N NE1 . TRP A 1 142 ? -3.541 -65.382 -71.875 1.00 60.87 ? 142 TRP A NE1 1 ATOM 1086 C CE2 . TRP A 1 142 ? -3.746 -64.083 -71.493 1.00 58.77 ? 142 TRP A CE2 1 ATOM 1087 C CE3 . TRP A 1 142 ? -3.879 -62.815 -69.434 1.00 57.20 ? 142 TRP A CE3 1 ATOM 1088 C CZ2 . TRP A 1 142 ? -3.968 -62.939 -72.269 1.00 57.15 ? 142 TRP A CZ2 1 ATOM 1089 C CZ3 . TRP A 1 142 ? -4.102 -61.676 -70.208 1.00 55.60 ? 142 TRP A CZ3 1 ATOM 1090 C CH2 . TRP A 1 142 ? -4.145 -61.749 -71.610 1.00 55.49 ? 142 TRP A CH2 1 ATOM 1091 N N . LEU A 1 143 ? -6.461 -64.455 -67.792 1.00 58.42 ? 143 LEU A N 1 ATOM 1092 C CA . LEU A 1 143 ? -7.225 -63.226 -67.593 1.00 56.45 ? 143 LEU A CA 1 ATOM 1093 C C . LEU A 1 143 ? -7.909 -63.159 -66.227 1.00 56.82 ? 143 LEU A C 1 ATOM 1094 O O . LEU A 1 143 ? -8.293 -62.077 -65.778 1.00 55.55 ? 143 LEU A O 1 ATOM 1095 C CB . LEU A 1 143 ? -8.264 -63.056 -68.701 1.00 55.55 ? 143 LEU A CB 1 ATOM 1096 C CG . LEU A 1 143 ? -7.816 -62.413 -70.014 1.00 54.57 ? 143 LEU A CG 1 ATOM 1097 C CD1 . LEU A 1 143 ? -8.777 -62.783 -71.120 1.00 54.44 ? 143 LEU A CD1 1 ATOM 1098 C CD2 . LEU A 1 143 ? -7.712 -60.895 -69.880 1.00 52.99 ? 143 LEU A CD2 1 ATOM 1099 N N . ASP A 1 144 ? -8.050 -64.312 -65.573 1.00 58.79 ? 144 ASP A N 1 ATOM 1100 C CA . ASP A 1 144 ? -8.736 -64.419 -64.280 1.00 59.67 ? 144 ASP A CA 1 ATOM 1101 C C . ASP A 1 144 ? -8.179 -63.470 -63.221 1.00 59.03 ? 144 ASP A C 1 ATOM 1102 O O . ASP A 1 144 ? -8.938 -62.822 -62.496 1.00 58.73 ? 144 ASP A O 1 ATOM 1103 C CB . ASP A 1 144 ? -8.699 -65.866 -63.763 1.00 62.36 ? 144 ASP A CB 1 ATOM 1104 C CG . ASP A 1 144 ? -9.541 -66.821 -64.609 1.00 63.72 ? 144 ASP A CG 1 ATOM 1105 O OD1 . ASP A 1 144 ? -10.398 -66.353 -65.393 1.00 63.02 ? 144 ASP A OD1 1 ATOM 1106 O OD2 . ASP A 1 144 ? -9.345 -68.048 -64.484 1.00 65.93 ? 144 ASP A OD2 1 ATOM 1107 N N . LEU A 1 145 ? -6.854 -63.383 -63.148 1.00 59.17 ? 145 LEU A N 1 ATOM 1108 C CA . LEU A 1 145 ? -6.182 -62.537 -62.165 1.00 58.99 ? 145 LEU A CA 1 ATOM 1109 C C . LEU A 1 145 ? -6.368 -61.034 -62.444 1.00 56.82 ? 145 LEU A C 1 ATOM 1110 O O . LEU A 1 145 ? -6.791 -60.305 -61.545 1.00 56.71 ? 145 LEU A O 1 ATOM 1111 C CB . LEU A 1 145 ? -4.702 -62.934 -62.030 1.00 60.36 ? 145 LEU A CB 1 ATOM 1112 C CG . LEU A 1 145 ? -3.767 -62.268 -61.015 1.00 61.29 ? 145 LEU A CG 1 ATOM 1113 C CD1 . LEU A 1 145 ? -4.301 -62.304 -59.579 1.00 62.23 ? 145 LEU A CD1 1 ATOM 1114 C CD2 . LEU A 1 145 ? -2.399 -62.931 -61.093 1.00 63.30 ? 145 LEU A CD2 1 ATOM 1115 N N . PRO A 1 146 ? -6.067 -60.565 -63.679 1.00 55.36 ? 146 PRO A N 1 ATOM 1116 C CA . PRO A 1 146 ? -6.359 -59.165 -64.018 1.00 53.46 ? 146 PRO A CA 1 ATOM 1117 C C . PRO A 1 146 ? -7.816 -58.766 -63.777 1.00 52.63 ? 146 PRO A C 1 ATOM 1118 O O . PRO A 1 146 ? -8.075 -57.666 -63.291 1.00 52.02 ? 146 PRO A O 1 ATOM 1119 C CB . PRO A 1 146 ? -6.035 -59.095 -65.510 1.00 52.58 ? 146 PRO A CB 1 ATOM 1120 C CG . PRO A 1 146 ? -4.973 -60.100 -65.695 1.00 54.23 ? 146 PRO A CG 1 ATOM 1121 C CD . PRO A 1 146 ? -5.281 -61.219 -64.743 1.00 55.72 ? 146 PRO A CD 1 ATOM 1122 N N . ILE A 1 147 ? -8.750 -59.656 -64.110 1.00 52.98 ? 147 ILE A N 1 ATOM 1123 C CA . ILE A 1 147 ? -10.174 -59.427 -63.862 1.00 52.80 ? 147 ILE A CA 1 ATOM 1124 C C . ILE A 1 147 ? -10.446 -59.229 -62.370 1.00 53.87 ? 147 ILE A C 1 ATOM 1125 O O . ILE A 1 147 ? -11.118 -58.268 -61.984 1.00 53.53 ? 147 ILE A O 1 ATOM 1126 C CB . ILE A 1 147 ? -11.056 -60.570 -64.452 1.00 53.71 ? 147 ILE A CB 1 ATOM 1127 C CG1 . ILE A 1 147 ? -11.050 -60.531 -65.988 1.00 52.70 ? 147 ILE A CG1 1 ATOM 1128 C CG2 . ILE A 1 147 ? -12.489 -60.510 -63.922 1.00 54.58 ? 147 ILE A CG2 1 ATOM 1129 C CD1 . ILE A 1 147 ? -11.347 -59.167 -66.608 1.00 50.91 ? 147 ILE A CD1 1 ATOM 1130 N N . LYS A 1 148 ? -9.905 -60.125 -61.542 1.00 55.32 ? 148 LYS A N 1 ATOM 1131 C CA . LYS A 1 148 ? -10.026 -60.019 -60.089 1.00 56.49 ? 148 LYS A CA 1 ATOM 1132 C C . LYS A 1 148 ? -9.438 -58.701 -59.584 1.00 55.66 ? 148 LYS A C 1 ATOM 1133 O O . LYS A 1 148 ? -10.037 -58.038 -58.735 1.00 56.26 ? 148 LYS A O 1 ATOM 1134 C CB . LYS A 1 148 ? -9.352 -61.210 -59.398 1.00 58.52 ? 148 LYS A CB 1 ATOM 1135 C CG . LYS A 1 148 ? -9.618 -61.301 -57.896 1.00 60.63 ? 148 LYS A CG 1 ATOM 1136 C CD . LYS A 1 148 ? -8.892 -62.481 -57.260 1.00 63.25 ? 148 LYS A CD 1 ATOM 1137 N N . VAL A 1 149 ? -8.273 -58.329 -60.114 1.00 54.64 ? 149 VAL A N 1 ATOM 1138 C CA . VAL A 1 149 ? -7.611 -57.074 -59.753 1.00 54.05 ? 149 VAL A CA 1 ATOM 1139 C C . VAL A 1 149 ? -8.502 -55.875 -60.089 1.00 52.82 ? 149 VAL A C 1 ATOM 1140 O O . VAL A 1 149 ? -8.713 -55.000 -59.241 1.00 53.37 ? 149 VAL A O 1 ATOM 1141 C CB . VAL A 1 149 ? -6.212 -56.940 -60.427 1.00 53.69 ? 149 VAL A CB 1 ATOM 1142 C CG1 . VAL A 1 149 ? -5.651 -55.533 -60.274 1.00 52.96 ? 149 VAL A CG1 1 ATOM 1143 C CG2 . VAL A 1 149 ? -5.242 -57.949 -59.843 1.00 55.40 ? 149 VAL A CG2 1 ATOM 1144 N N . LEU A 1 150 ? -9.037 -55.856 -61.310 1.00 51.33 ? 150 LEU A N 1 ATOM 1145 C CA . LEU A 1 150 ? -9.880 -54.752 -61.777 1.00 50.22 ? 150 LEU A CA 1 ATOM 1146 C C . LEU A 1 150 ? -11.244 -54.680 -61.085 1.00 51.10 ? 150 LEU A C 1 ATOM 1147 O O . LEU A 1 150 ? -11.777 -53.586 -60.881 1.00 51.05 ? 150 LEU A O 1 ATOM 1148 C CB . LEU A 1 150 ? -10.071 -54.814 -63.293 1.00 48.84 ? 150 LEU A CB 1 ATOM 1149 C CG . LEU A 1 150 ? -8.872 -54.586 -64.218 1.00 47.96 ? 150 LEU A CG 1 ATOM 1150 C CD1 . LEU A 1 150 ? -9.268 -54.943 -65.641 1.00 47.15 ? 150 LEU A CD1 1 ATOM 1151 C CD2 . LEU A 1 150 ? -8.344 -53.156 -64.146 1.00 46.97 ? 150 LEU A CD2 1 ATOM 1152 N N . ASN A 1 151 ? -11.803 -55.837 -60.726 1.00 52.26 ? 151 ASN A N 1 ATOM 1153 C CA . ASN A 1 151 ? -13.097 -55.893 -60.032 1.00 53.53 ? 151 ASN A CA 1 ATOM 1154 C C . ASN A 1 151 ? -13.061 -55.421 -58.576 1.00 55.08 ? 151 ASN A C 1 ATOM 1155 O O . ASN A 1 151 ? -14.110 -55.197 -57.965 1.00 56.34 ? 151 ASN A O 1 ATOM 1156 C CB . ASN A 1 151 ? -13.709 -57.293 -60.123 1.00 54.67 ? 151 ASN A CB 1 ATOM 1157 C CG . ASN A 1 151 ? -14.362 -57.561 -61.470 1.00 53.77 ? 151 ASN A CG 1 ATOM 1158 O OD1 . ASN A 1 151 ? -14.750 -56.635 -62.188 1.00 52.29 ? 151 ASN A OD1 1 ATOM 1159 N ND2 . ASN A 1 151 ? -14.492 -58.836 -61.815 1.00 54.37 ? 151 ASN A ND2 1 ATOM 1160 N N . ALA A 1 152 ? -11.854 -55.266 -58.033 1.00 55.27 ? 152 ALA A N 1 ATOM 1161 C CA . ALA A 1 152 ? -11.664 -54.747 -56.680 1.00 56.80 ? 152 ALA A CA 1 ATOM 1162 C C . ALA A 1 152 ? -11.894 -53.234 -56.608 1.00 56.43 ? 152 ALA A C 1 ATOM 1163 O O . ALA A 1 152 ? -12.009 -52.671 -55.519 1.00 57.96 ? 152 ALA A O 1 ATOM 1164 C CB . ALA A 1 152 ? -10.274 -55.101 -56.170 1.00 57.36 ? 152 ALA A CB 1 ATOM 1165 N N . ASP A 1 153 ? -11.962 -52.587 -57.771 1.00 54.66 ? 153 ASP A N 1 ATOM 1166 C CA . ASP A 1 153 ? -12.156 -51.143 -57.855 1.00 54.39 ? 153 ASP A CA 1 ATOM 1167 C C . ASP A 1 153 ? -13.642 -50.787 -57.891 1.00 54.95 ? 153 ASP A C 1 ATOM 1168 O O . ASP A 1 153 ? -14.292 -50.886 -58.935 1.00 54.01 ? 153 ASP A O 1 ATOM 1169 C CB . ASP A 1 153 ? -11.430 -50.584 -59.083 1.00 52.55 ? 153 ASP A CB 1 ATOM 1170 C CG . ASP A 1 153 ? -11.417 -49.061 -59.128 1.00 52.43 ? 153 ASP A CG 1 ATOM 1171 O OD1 . ASP A 1 153 ? -12.029 -48.404 -58.260 1.00 53.36 ? 153 ASP A OD1 1 ATOM 1172 O OD2 . ASP A 1 153 ? -10.783 -48.517 -60.052 1.00 51.58 ? 153 ASP A OD2 1 ATOM 1173 N N . GLN A 1 154 ? -14.164 -50.364 -56.745 1.00 56.91 ? 154 GLN A N 1 ATOM 1174 C CA . GLN A 1 154 ? -15.585 -50.047 -56.607 1.00 58.16 ? 154 GLN A CA 1 ATOM 1175 C C . GLN A 1 154 ? -15.959 -48.725 -57.274 1.00 57.37 ? 154 GLN A C 1 ATOM 1176 O O . GLN A 1 154 ? -17.045 -48.599 -57.843 1.00 57.45 ? 154 GLN A O 1 ATOM 1177 C CB . GLN A 1 154 ? -16.000 -50.042 -55.131 1.00 60.99 ? 154 GLN A CB 1 ATOM 1178 C CG . GLN A 1 154 ? -15.719 -51.356 -54.380 1.00 62.78 ? 154 GLN A CG 1 ATOM 1179 C CD . GLN A 1 154 ? -16.341 -52.584 -55.042 0.70 62.97 ? 154 GLN A CD 1 ATOM 1180 O OE1 . GLN A 1 154 ? -17.463 -52.537 -55.554 0.70 63.31 ? 154 GLN A OE1 1 ATOM 1181 N NE2 . GLN A 1 154 ? -15.609 -53.694 -55.025 0.70 62.93 ? 154 GLN A NE2 1 ATOM 1182 N N . GLY A 1 155 ? -15.054 -47.751 -57.203 1.00 56.86 ? 155 GLY A N 1 ATOM 1183 C CA . GLY A 1 155 ? -15.251 -46.448 -57.832 1.00 56.26 ? 155 GLY A CA 1 ATOM 1184 C C . GLY A 1 155 ? -15.460 -46.530 -59.333 1.00 54.18 ? 155 GLY A C 1 ATOM 1185 O O . GLY A 1 155 ? -16.316 -45.837 -59.886 1.00 54.33 ? 155 GLY A O 1 ATOM 1186 N N . THR A 1 156 ? -14.676 -47.378 -59.992 1.00 52.53 ? 156 THR A N 1 ATOM 1187 C CA . THR A 1 156 ? -14.799 -47.575 -61.432 1.00 50.75 ? 156 THR A CA 1 ATOM 1188 C C . THR A 1 156 ? -16.103 -48.295 -61.763 1.00 51.22 ? 156 THR A C 1 ATOM 1189 O O . THR A 1 156 ? -16.833 -47.881 -62.668 1.00 50.92 ? 156 THR A O 1 ATOM 1190 C CB . THR A 1 156 ? -13.588 -48.340 -62.007 1.00 49.36 ? 156 THR A CB 1 ATOM 1191 O OG1 . THR A 1 156 ? -12.401 -47.564 -61.805 1.00 49.08 ? 156 THR A OG1 1 ATOM 1192 C CG2 . THR A 1 156 ? -13.760 -48.600 -63.498 1.00 47.58 ? 156 THR A CG2 1 ATOM 1193 N N . SER A 1 157 ? -16.394 -49.358 -61.015 1.00 52.26 ? 157 SER A N 1 ATOM 1194 C CA . SER A 1 157 ? -17.620 -50.130 -61.197 1.00 53.07 ? 157 SER A CA 1 ATOM 1195 C C . SER A 1 157 ? -18.856 -49.231 -61.168 1.00 54.28 ? 157 SER A C 1 ATOM 1196 O O . SER A 1 157 ? -19.695 -49.303 -62.062 1.00 54.40 ? 157 SER A O 1 ATOM 1197 C CB . SER A 1 157 ? -17.727 -51.228 -60.140 1.00 54.62 ? 157 SER A CB 1 ATOM 1198 O OG . SER A 1 157 ? -18.975 -51.890 -60.224 1.00 55.95 ? 157 SER A OG 1 ATOM 1199 N N . ALA A 1 158 ? -18.947 -48.378 -60.150 1.00 55.54 ? 158 ALA A N 1 ATOM 1200 C CA . ALA A 1 158 ? -20.037 -47.410 -60.031 1.00 57.08 ? 158 ALA A CA 1 ATOM 1201 C C . ALA A 1 158 ? -20.098 -46.443 -61.217 1.00 55.79 ? 158 ALA A C 1 ATOM 1202 O O . ALA A 1 158 ? -21.176 -46.177 -61.750 1.00 56.59 ? 158 ALA A O 1 ATOM 1203 C CB . ALA A 1 158 ? -19.924 -46.641 -58.715 1.00 58.91 ? 158 ALA A CB 1 ATOM 1204 N N . THR A 1 159 ? -18.940 -45.933 -61.631 1.00 54.14 ? 159 THR A N 1 ATOM 1205 C CA . THR A 1 159 ? -18.861 -44.970 -62.731 1.00 53.20 ? 159 THR A CA 1 ATOM 1206 C C . THR A 1 159 ? -19.244 -45.594 -64.076 1.00 52.03 ? 159 THR A C 1 ATOM 1207 O O . THR A 1 159 ? -19.919 -44.955 -64.887 1.00 52.30 ? 159 THR A O 1 ATOM 1208 C CB . THR A 1 159 ? -17.464 -44.313 -62.824 1.00 52.09 ? 159 THR A CB 1 ATOM 1209 O OG1 . THR A 1 159 ? -17.079 -43.816 -61.535 1.00 53.48 ? 159 THR A OG1 1 ATOM 1210 C CG2 . THR A 1 159 ? -17.473 -43.157 -63.817 1.00 51.70 ? 159 THR A CG2 1 ATOM 1211 N N . VAL A 1 160 ? -18.818 -46.835 -64.306 1.00 51.03 ? 160 VAL A N 1 ATOM 1212 C CA . VAL A 1 160 ? -19.191 -47.556 -65.524 1.00 50.23 ? 160 VAL A CA 1 ATOM 1213 C C . VAL A 1 160 ? -20.697 -47.844 -65.530 1.00 52.11 ? 160 VAL A C 1 ATOM 1214 O O . VAL A 1 160 ? -21.364 -47.654 -66.552 1.00 52.06 ? 160 VAL A O 1 ATOM 1215 C CB . VAL A 1 160 ? -18.361 -48.856 -65.720 1.00 49.16 ? 160 VAL A CB 1 ATOM 1216 C CG1 . VAL A 1 160 ? -18.877 -49.662 -66.906 1.00 48.60 ? 160 VAL A CG1 1 ATOM 1217 C CG2 . VAL A 1 160 ? -16.889 -48.520 -65.922 1.00 47.57 ? 160 VAL A CG2 1 ATOM 1218 N N . GLN A 1 161 ? -21.223 -48.275 -64.383 1.00 54.03 ? 161 GLN A N 1 ATOM 1219 C CA . GLN A 1 161 ? -22.658 -48.531 -64.226 1.00 56.53 ? 161 GLN A CA 1 ATOM 1220 C C . GLN A 1 161 ? -23.500 -47.303 -64.563 1.00 57.90 ? 161 GLN A C 1 ATOM 1221 O O . GLN A 1 161 ? -24.469 -47.405 -65.319 1.00 58.94 ? 161 GLN A O 1 ATOM 1222 C CB . GLN A 1 161 ? -22.977 -49.033 -62.816 1.00 58.40 ? 161 GLN A CB 1 ATOM 1223 C CG . GLN A 1 161 ? -22.718 -50.518 -62.623 1.00 58.15 ? 161 GLN A CG 1 ATOM 1224 C CD . GLN A 1 161 ? -22.801 -50.946 -61.174 1.00 59.47 ? 161 GLN A CD 1 ATOM 1225 O OE1 . GLN A 1 161 ? -23.853 -50.856 -60.545 1.00 62.19 ? 161 GLN A OE1 1 ATOM 1226 N NE2 . GLN A 1 161 ? -21.688 -51.425 -60.638 1.00 58.40 ? 161 GLN A NE2 1 ATOM 1227 N N . MET A 1 162 ? -23.113 -46.151 -64.016 1.00 58.31 ? 162 MET A N 1 ATOM 1228 C CA . MET A 1 162 ? -23.777 -44.877 -64.301 1.00 59.85 ? 162 MET A CA 1 ATOM 1229 C C . MET A 1 162 ? -23.760 -44.539 -65.796 1.00 58.73 ? 162 MET A C 1 ATOM 1230 O O . MET A 1 162 ? -24.754 -44.054 -66.337 1.00 60.13 ? 162 MET A O 1 ATOM 1231 C CB . MET A 1 162 ? -23.131 -43.746 -63.494 1.00 60.17 ? 162 MET A CB 1 ATOM 1232 C CG . MET A 1 162 ? -23.797 -42.382 -63.662 0.70 62.15 ? 162 MET A CG 1 ATOM 1233 S SD . MET A 1 162 ? -22.740 -40.993 -63.200 0.70 62.93 ? 162 MET A SD 1 ATOM 1234 C CE . MET A 1 162 ? -21.532 -41.006 -64.529 0.70 59.37 ? 162 MET A CE 1 ATOM 1235 N N . LEU A 1 163 ? -22.633 -44.805 -66.455 1.00 56.64 ? 163 LEU A N 1 ATOM 1236 C CA . LEU A 1 163 ? -22.479 -44.509 -67.881 1.00 55.81 ? 163 LEU A CA 1 ATOM 1237 C C . LEU A 1 163 ? -23.296 -45.429 -68.791 1.00 56.38 ? 163 LEU A C 1 ATOM 1238 O O . LEU A 1 163 ? -23.874 -44.978 -69.783 1.00 56.79 ? 163 LEU A O 1 ATOM 1239 C CB . LEU A 1 163 ? -21.002 -44.527 -68.287 1.00 53.58 ? 163 LEU A CB 1 ATOM 1240 C CG . LEU A 1 163 ? -20.108 -43.403 -67.747 1.00 53.67 ? 163 LEU A CG 1 ATOM 1241 C CD1 . LEU A 1 163 ? -18.640 -43.785 -67.879 1.00 51.82 ? 163 LEU A CD1 1 ATOM 1242 C CD2 . LEU A 1 163 ? -20.393 -42.062 -68.428 1.00 54.48 ? 163 LEU A CD2 1 ATOM 1243 N N . LEU A 1 164 ? -23.342 -46.714 -68.451 1.00 56.72 ? 164 LEU A N 1 ATOM 1244 C CA . LEU A 1 164 ? -24.088 -47.685 -69.244 1.00 57.70 ? 164 LEU A CA 1 ATOM 1245 C C . LEU A 1 164 ? -25.591 -47.621 -68.966 1.00 60.79 ? 164 LEU A C 1 ATOM 1246 O O . LEU A 1 164 ? -26.386 -47.479 -69.897 1.00 61.80 ? 164 LEU A O 1 ATOM 1247 C CB . LEU A 1 164 ? -23.545 -49.105 -69.036 1.00 56.99 ? 164 LEU A CB 1 ATOM 1248 C CG . LEU A 1 164 ? -22.080 -49.367 -69.415 1.00 54.89 ? 164 LEU A CG 1 ATOM 1249 C CD1 . LEU A 1 164 ? -21.710 -50.824 -69.167 1.00 54.99 ? 164 LEU A CD1 1 ATOM 1250 C CD2 . LEU A 1 164 ? -21.770 -48.971 -70.863 1.00 53.71 ? 164 LEU A CD2 1 ATOM 1251 N N . ASN A 1 165 ? -25.972 -47.710 -67.692 1.00 62.63 ? 165 ASN A N 1 ATOM 1252 C CA . ASN A 1 165 ? -27.385 -47.717 -67.307 1.00 66.11 ? 165 ASN A CA 1 ATOM 1253 C C . ASN A 1 165 ? -28.104 -46.388 -67.537 1.00 67.57 ? 165 ASN A C 1 ATOM 1254 O O . ASN A 1 165 ? -29.246 -46.374 -67.996 1.00 69.77 ? 165 ASN A O 1 ATOM 1255 C CB . ASN A 1 165 ? -27.554 -48.142 -65.845 1.00 67.90 ? 165 ASN A CB 1 ATOM 1256 C CG . ASN A 1 165 ? -27.111 -49.575 -65.586 1.00 67.96 ? 165 ASN A CG 1 ATOM 1257 O OD1 . ASN A 1 165 ? -26.641 -50.274 -66.490 1.00 66.43 ? 165 ASN A OD1 1 ATOM 1258 N ND2 . ASN A 1 165 ? -27.265 -50.017 -64.335 1.00 70.37 ? 165 ASN A ND2 1 ATOM 1259 N N . ASP A 1 166 ? -27.430 -45.281 -67.229 1.00 66.63 ? 166 ASP A N 1 ATOM 1260 C CA . ASP A 1 166 ? -28.067 -43.961 -67.236 1.00 68.48 ? 166 ASP A CA 1 ATOM 1261 C C . ASP A 1 166 ? -27.558 -42.996 -68.313 1.00 66.93 ? 166 ASP A C 1 ATOM 1262 O O . ASP A 1 166 ? -28.359 -42.411 -69.047 1.00 68.39 ? 166 ASP A O 1 ATOM 1263 C CB . ASP A 1 166 ? -27.966 -43.305 -65.850 1.00 69.73 ? 166 ASP A CB 1 ATOM 1264 C CG . ASP A 1 166 ? -28.748 -44.059 -64.778 1.00 72.54 ? 166 ASP A CG 1 ATOM 1265 O OD1 . ASP A 1 166 ? -29.765 -44.708 -65.106 1.00 74.67 ? 166 ASP A OD1 1 ATOM 1266 O OD2 . ASP A 1 166 ? -28.348 -43.990 -63.596 1.00 73.07 ? 166 ASP A OD2 1 ATOM 1267 N N . THR A 1 167 ? -26.239 -42.833 -68.404 1.00 64.33 ? 167 THR A N 1 ATOM 1268 C CA . THR A 1 167 ? -25.645 -41.776 -69.231 1.00 63.24 ? 167 THR A CA 1 ATOM 1269 C C . THR A 1 167 ? -25.745 -42.020 -70.738 1.00 62.41 ? 167 THR A C 1 ATOM 1270 O O . THR A 1 167 ? -26.051 -41.092 -71.488 1.00 63.29 ? 167 THR A O 1 ATOM 1271 C CB . THR A 1 167 ? -24.175 -41.492 -68.848 1.00 61.16 ? 167 THR A CB 1 ATOM 1272 O OG1 . THR A 1 167 ? -24.038 -41.495 -67.423 1.00 62.27 ? 167 THR A OG1 1 ATOM 1273 C CG2 . THR A 1 167 ? -23.727 -40.139 -69.392 1.00 61.07 ? 167 THR A CG2 1 ATOM 1274 N N . CYS A 1 168 ? -25.485 -43.251 -71.178 1.00 61.05 ? 168 CYS A N 1 ATOM 1275 C CA . CYS A 1 168 ? -25.561 -43.586 -72.607 1.00 60.42 ? 168 CYS A CA 1 ATOM 1276 C C . CYS A 1 168 ? -26.938 -43.262 -73.212 1.00 62.55 ? 168 CYS A C 1 ATOM 1277 O O . CYS A 1 168 ? -27.013 -42.478 -74.156 1.00 62.76 ? 168 CYS A O 1 ATOM 1278 C CB . CYS A 1 168 ? -25.159 -45.045 -72.875 1.00 59.38 ? 168 CYS A CB 1 ATOM 1279 S SG . CYS A 1 168 ? -24.773 -45.429 -74.614 1.00 59.03 ? 168 CYS A SG 1 ATOM 1280 N N . PRO A 1 169 ? -28.029 -43.839 -72.658 1.00 64.45 ? 169 PRO A N 1 ATOM 1281 C CA . PRO A 1 169 ? -29.350 -43.602 -73.241 1.00 66.93 ? 169 PRO A CA 1 ATOM 1282 C C . PRO A 1 169 ? -29.792 -42.141 -73.168 1.00 68.24 ? 169 PRO A C 1 ATOM 1283 O O . PRO A 1 169 ? -30.482 -41.664 -74.072 1.00 69.80 ? 169 PRO A O 1 ATOM 1284 C CB . PRO A 1 169 ? -30.280 -44.470 -72.381 1.00 69.30 ? 169 PRO A CB 1 ATOM 1285 C CG . PRO A 1 169 ? -29.395 -45.440 -71.700 1.00 67.48 ? 169 PRO A CG 1 ATOM 1286 C CD . PRO A 1 169 ? -28.119 -44.716 -71.477 1.00 64.95 ? 169 PRO A CD 1 ATOM 1287 N N . LEU A 1 170 ? -29.399 -41.445 -72.103 1.00 67.76 ? 170 LEU A N 1 ATOM 1288 C CA . LEU A 1 170 ? -29.779 -40.046 -71.910 1.00 69.22 ? 170 LEU A CA 1 ATOM 1289 C C . LEU A 1 170 ? -29.126 -39.149 -72.953 1.00 67.56 ? 170 LEU A C 1 ATOM 1290 O O . LEU A 1 170 ? -29.754 -38.226 -73.475 1.00 69.36 ? 170 LEU A O 1 ATOM 1291 C CB . LEU A 1 170 ? -29.415 -39.578 -70.496 1.00 69.59 ? 170 LEU A CB 1 ATOM 1292 C CG . LEU A 1 170 ? -29.732 -38.135 -70.086 1.00 71.74 ? 170 LEU A CG 1 ATOM 1293 C CD1 . LEU A 1 170 ? -31.236 -37.874 -70.041 0.70 75.72 ? 170 LEU A CD1 1 ATOM 1294 C CD2 . LEU A 1 170 ? -29.091 -37.825 -68.741 0.70 71.78 ? 170 LEU A CD2 1 ATOM 1295 N N . PHE A 1 171 ? -27.866 -39.439 -73.254 1.00 64.26 ? 171 PHE A N 1 ATOM 1296 C CA . PHE A 1 171 ? -27.105 -38.679 -74.233 1.00 62.80 ? 171 PHE A CA 1 ATOM 1297 C C . PHE A 1 171 ? -27.584 -38.933 -75.667 1.00 63.01 ? 171 PHE A C 1 ATOM 1298 O O . PHE A 1 171 ? -27.756 -37.986 -76.441 1.00 64.00 ? 171 PHE A O 1 ATOM 1299 C CB . PHE A 1 171 ? -25.608 -38.982 -74.091 1.00 59.87 ? 171 PHE A CB 1 ATOM 1300 C CG . PHE A 1 171 ? -24.745 -38.263 -75.084 1.00 58.82 ? 171 PHE A CG 1 ATOM 1301 C CD1 . PHE A 1 171 ? -24.612 -36.879 -75.038 1.00 59.94 ? 171 PHE A CD1 1 ATOM 1302 C CD2 . PHE A 1 171 ? -24.062 -38.970 -76.066 1.00 57.04 ? 171 PHE A CD2 1 ATOM 1303 C CE1 . PHE A 1 171 ? -23.814 -36.208 -75.957 1.00 59.45 ? 171 PHE A CE1 1 ATOM 1304 C CE2 . PHE A 1 171 ? -23.260 -38.310 -76.989 1.00 56.60 ? 171 PHE A CE2 1 ATOM 1305 C CZ . PHE A 1 171 ? -23.137 -36.926 -76.937 1.00 57.86 ? 171 PHE A CZ 1 ATOM 1306 N N . VAL A 1 172 ? -27.812 -40.204 -76.004 1.00 62.19 ? 172 VAL A N 1 ATOM 1307 C CA . VAL A 1 172 ? -28.166 -40.610 -77.372 1.00 62.28 ? 172 VAL A CA 1 ATOM 1308 C C . VAL A 1 172 ? -29.525 -40.062 -77.812 1.00 65.32 ? 172 VAL A C 1 ATOM 1309 O O . VAL A 1 172 ? -29.684 -39.635 -78.960 1.00 65.90 ? 172 VAL A O 1 ATOM 1310 C CB . VAL A 1 172 ? -28.099 -42.150 -77.564 1.00 61.35 ? 172 VAL A CB 1 ATOM 1311 C CG1 . VAL A 1 172 ? -28.408 -42.530 -79.001 1.00 61.78 ? 172 VAL A CG1 1 ATOM 1312 C CG2 . VAL A 1 172 ? -26.723 -42.666 -77.191 1.00 58.42 ? 172 VAL A CG2 1 ATOM 1313 N N . ARG A 1 173 ? -30.492 -40.072 -76.894 1.00 67.38 ? 173 ARG A N 1 ATOM 1314 C CA . ARG A 1 173 ? -31.804 -39.472 -77.139 1.00 70.71 ? 173 ARG A CA 1 ATOM 1315 C C . ARG A 1 173 ? -31.664 -37.991 -77.474 1.00 71.23 ? 173 ARG A C 1 ATOM 1316 O O . ARG A 1 173 ? -32.371 -37.475 -78.341 1.00 73.38 ? 173 ARG A O 1 ATOM 1317 C CB . ARG A 1 173 ? -32.721 -39.657 -75.931 1.00 73.17 ? 173 ARG A CB 1 ATOM 1318 C CG . ARG A 1 173 ? -33.318 -41.049 -75.807 1.00 74.33 ? 173 ARG A CG 1 ATOM 1319 C CD . ARG A 1 173 ? -34.321 -41.131 -74.660 1.00 78.02 ? 173 ARG A CD 1 ATOM 1320 N NE . ARG A 1 173 ? -33.685 -41.061 -73.345 1.00 76.66 ? 173 ARG A NE 1 ATOM 1321 N N . GLY A 1 174 ? -30.740 -37.323 -76.787 1.00 69.51 ? 174 GLY A N 1 ATOM 1322 C CA . GLY A 1 174 ? -30.401 -35.931 -77.069 1.00 69.90 ? 174 GLY A CA 1 ATOM 1323 C C . GLY A 1 174 ? -29.753 -35.757 -78.429 1.00 68.49 ? 174 GLY A C 1 ATOM 1324 O O . GLY A 1 174 ? -30.046 -34.796 -79.142 1.00 70.17 ? 174 GLY A O 1 ATOM 1325 N N . LEU A 1 175 ? -28.874 -36.692 -78.787 1.00 65.64 ? 175 LEU A N 1 ATOM 1326 C CA . LEU A 1 175 ? -28.231 -36.702 -80.101 1.00 64.38 ? 175 LEU A CA 1 ATOM 1327 C C . LEU A 1 175 ? -29.218 -36.940 -81.238 1.00 66.44 ? 175 LEU A C 1 ATOM 1328 O O . LEU A 1 175 ? -29.097 -36.335 -82.305 1.00 67.11 ? 175 LEU A O 1 ATOM 1329 C CB . LEU A 1 175 ? -27.129 -37.760 -80.165 1.00 61.35 ? 175 LEU A CB 1 ATOM 1330 C CG . LEU A 1 175 ? -25.698 -37.425 -79.748 1.00 58.77 ? 175 LEU A CG 1 ATOM 1331 C CD1 . LEU A 1 175 ? -24.820 -38.587 -80.146 1.00 56.03 ? 175 LEU A CD1 1 ATOM 1332 C CD2 . LEU A 1 175 ? -25.191 -36.138 -80.390 1.00 58.97 ? 175 LEU A CD2 1 ATOM 1333 N N . LEU A 1 176 ? -30.184 -37.827 -81.006 1.00 67.73 ? 176 LEU A N 1 ATOM 1334 C CA . LEU A 1 176 ? -31.191 -38.164 -82.014 1.00 70.10 ? 176 LEU A CA 1 ATOM 1335 C C . LEU A 1 176 ? -32.120 -36.996 -82.338 1.00 73.38 ? 176 LEU A C 1 ATOM 1336 O O . LEU A 1 176 ? -32.545 -36.842 -83.482 1.00 75.05 ? 176 LEU A O 1 ATOM 1337 C CB . LEU A 1 176 ? -31.999 -39.397 -81.593 1.00 71.05 ? 176 LEU A CB 1 ATOM 1338 C CG . LEU A 1 176 ? -31.285 -40.753 -81.652 1.00 68.58 ? 176 LEU A CG 1 ATOM 1339 C CD1 . LEU A 1 176 ? -31.996 -41.782 -80.784 1.00 69.62 ? 176 LEU A CD1 1 ATOM 1340 C CD2 . LEU A 1 176 ? -31.149 -41.253 -83.086 1.00 68.61 ? 176 LEU A CD2 1 ATOM 1341 N N . GLU A 1 177 ? -32.434 -36.179 -81.336 1.00 74.72 ? 177 GLU A N 1 ATOM 1342 C CA . GLU A 1 177 ? -33.249 -34.982 -81.558 1.00 78.18 ? 177 GLU A CA 1 ATOM 1343 C C . GLU A 1 177 ? -32.418 -33.854 -82.164 1.00 77.47 ? 177 GLU A C 1 ATOM 1344 O O . GLU A 1 177 ? -32.903 -33.115 -83.024 1.00 79.79 ? 177 GLU A O 1 ATOM 1345 C CB . GLU A 1 177 ? -33.927 -34.512 -80.265 1.00 80.27 ? 177 GLU A CB 1 ATOM 1346 C CG . GLU A 1 177 ? -35.126 -35.353 -79.842 1.00 82.92 ? 177 GLU A CG 1 ATOM 1347 C CD . GLU A 1 177 ? -36.040 -34.627 -78.870 0.70 86.64 ? 177 GLU A CD 1 ATOM 1348 O OE1 . GLU A 1 177 ? -36.677 -33.631 -79.279 0.70 89.76 ? 177 GLU A OE1 1 ATOM 1349 O OE2 . GLU A 1 177 ? -36.131 -35.057 -77.700 0.70 86.60 ? 177 GLU A OE2 1 ATOM 1350 N N . ALA A 1 178 ? -31.168 -33.738 -81.718 1.00 74.54 ? 178 ALA A N 1 ATOM 1351 C CA . ALA A 1 178 ? -30.257 -32.701 -82.199 1.00 73.98 ? 178 ALA A CA 1 ATOM 1352 C C . ALA A 1 178 ? -29.830 -32.938 -83.644 1.00 73.36 ? 178 ALA A C 1 ATOM 1353 O O . ALA A 1 178 ? -29.648 -31.986 -84.404 1.00 74.54 ? 178 ALA A O 1 ATOM 1354 C CB . ALA A 1 178 ? -29.038 -32.602 -81.295 1.00 71.28 ? 178 ALA A CB 1 ATOM 1355 N N . GLY A 1 179 ? -29.677 -34.207 -84.013 1.00 71.81 ? 179 GLY A N 1 ATOM 1356 C CA . GLY A 1 179 ? -29.235 -34.577 -85.354 1.00 71.42 ? 179 GLY A CA 1 ATOM 1357 C C . GLY A 1 179 ? -30.317 -35.179 -86.230 1.00 73.76 ? 179 GLY A C 1 ATOM 1358 O O . GLY A 1 179 ? -30.016 -35.823 -87.235 1.00 73.24 ? 179 GLY A O 1 ATOM 1359 N N . LYS A 1 180 ? -31.577 -34.960 -85.854 1.00 76.72 ? 180 LYS A N 1 ATOM 1360 C CA . LYS A 1 180 ? -32.721 -35.496 -86.593 1.00 79.56 ? 180 LYS A CA 1 ATOM 1361 C C . LYS A 1 180 ? -32.671 -35.100 -88.069 1.00 81.00 ? 180 LYS A C 1 ATOM 1362 O O . LYS A 1 180 ? -32.954 -35.920 -88.945 1.00 81.74 ? 180 LYS A O 1 ATOM 1363 C CB . LYS A 1 180 ? -34.036 -35.030 -85.956 1.00 82.98 ? 180 LYS A CB 1 ATOM 1364 C CG . LYS A 1 180 ? -35.277 -35.773 -86.445 1.00 86.04 ? 180 LYS A CG 1 ATOM 1365 C CD . LYS A 1 180 ? -36.555 -35.134 -85.919 1.00 90.06 ? 180 LYS A CD 1 ATOM 1366 N N . SER A 1 181 ? -32.292 -33.848 -88.325 1.00 81.73 ? 181 SER A N 1 ATOM 1367 C CA . SER A 1 181 ? -32.228 -33.290 -89.677 1.00 83.45 ? 181 SER A CA 1 ATOM 1368 C C . SER A 1 181 ? -31.204 -33.994 -90.579 1.00 81.30 ? 181 SER A C 1 ATOM 1369 O O . SER A 1 181 ? -31.496 -34.279 -91.744 1.00 82.92 ? 181 SER A O 1 ATOM 1370 C CB . SER A 1 181 ? -31.943 -31.787 -89.614 1.00 84.56 ? 181 SER A CB 1 ATOM 1371 O OG . SER A 1 181 ? -32.082 -31.187 -90.888 1.00 86.82 ? 181 SER A OG 1 ATOM 1372 N N . ASP A 1 182 ? -30.017 -34.268 -90.039 1.00 78.00 ? 182 ASP A N 1 ATOM 1373 C CA . ASP A 1 182 ? -28.947 -34.929 -90.795 1.00 76.07 ? 182 ASP A CA 1 ATOM 1374 C C . ASP A 1 182 ? -29.193 -36.422 -91.001 1.00 75.48 ? 182 ASP A C 1 ATOM 1375 O O . ASP A 1 182 ? -28.759 -36.996 -92.002 1.00 75.36 ? 182 ASP A O 1 ATOM 1376 C CB . ASP A 1 182 ? -27.587 -34.719 -90.118 1.00 73.11 ? 182 ASP A CB 1 ATOM 1377 C CG . ASP A 1 182 ? -26.955 -33.376 -90.459 1.00 73.88 ? 182 ASP A CG 1 ATOM 1378 O OD1 . ASP A 1 182 ? -27.585 -32.565 -91.171 1.00 76.40 ? 182 ASP A OD1 1 ATOM 1379 O OD2 . ASP A 1 182 ? -25.814 -33.132 -90.010 1.00 71.97 ? 182 ASP A OD2 1 ATOM 1380 N N . LEU A 1 183 ? -29.877 -37.047 -90.046 1.00 73.06 ? 183 LEU A N 1 ATOM 1381 C CA . LEU A 1 183 ? -30.168 -38.477 -90.116 1.00 71.36 ? 183 LEU A CA 1 ATOM 1382 C C . LEU A 1 183 ? -31.257 -38.790 -91.139 1.00 70.23 ? 183 LEU A C 1 ATOM 1383 O O . LEU A 1 183 ? -31.223 -39.839 -91.788 1.00 67.98 ? 183 LEU A O 1 ATOM 1384 C CB . LEU A 1 183 ? -30.555 -39.019 -88.738 1.00 73.43 ? 183 LEU A CB 1 ATOM 1385 C CG . LEU A 1 183 ? -29.442 -39.152 -87.692 1.00 74.33 ? 183 LEU A CG 1 ATOM 1386 C CD1 . LEU A 1 183 ? -30.034 -39.199 -86.292 1.00 77.55 ? 183 LEU A CD1 1 ATOM 1387 C CD2 . LEU A 1 183 ? -28.572 -40.376 -87.951 1.00 71.68 ? 183 LEU A CD2 1 ATOM 1388 N N . GLU A 1 184 ? -32.210 -37.870 -91.286 1.00 72.09 ? 184 GLU A N 1 ATOM 1389 C CA . GLU A 1 184 ? -33.316 -38.032 -92.236 1.00 71.61 ? 184 GLU A CA 1 ATOM 1390 C C . GLU A 1 184 ? -33.027 -37.414 -93.617 1.00 70.15 ? 184 GLU A C 1 ATOM 1391 O O . GLU A 1 184 ? -33.912 -37.337 -94.477 1.00 70.00 ? 184 GLU A O 1 ATOM 1392 C CB . GLU A 1 184 ? -34.615 -37.479 -91.637 1.00 74.59 ? 184 GLU A CB 1 ATOM 1393 C CG . GLU A 1 184 ? -35.178 -38.330 -90.499 1.00 76.17 ? 184 GLU A CG 1 ATOM 1394 C CD . GLU A 1 184 ? -36.469 -37.777 -89.906 0.90 79.92 ? 184 GLU A CD 1 ATOM 1395 O OE1 . GLU A 1 184 ? -37.242 -37.113 -90.631 0.90 80.69 ? 184 GLU A OE1 1 ATOM 1396 O OE2 . GLU A 1 184 ? -36.715 -38.020 -88.706 0.90 82.25 ? 184 GLU A OE2 1 ATOM 1397 N N . LYS A 1 185 ? -31.778 -36.998 -93.815 1.00 69.29 ? 185 LYS A N 1 ATOM 1398 C CA . LYS A 1 185 ? -31.323 -36.335 -95.033 1.00 68.34 ? 185 LYS A CA 1 ATOM 1399 C C . LYS A 1 185 ? -31.293 -37.305 -96.214 1.00 65.52 ? 185 LYS A C 1 ATOM 1400 O O . LYS A 1 185 ? -30.909 -38.467 -96.065 1.00 63.86 ? 185 LYS A O 1 ATOM 1401 C CB . LYS A 1 185 ? -29.935 -35.742 -94.785 1.00 68.57 ? 185 LYS A CB 1 ATOM 1402 C CG . LYS A 1 185 ? -29.407 -34.794 -95.847 1.00 68.95 ? 185 LYS A CG 1 ATOM 1403 C CD . LYS A 1 185 ? -28.094 -34.164 -95.384 1.00 70.21 ? 185 LYS A CD 1 ATOM 1404 C CE . LYS A 1 185 ? -27.303 -33.587 -96.548 1.00 69.94 ? 185 LYS A CE 1 ATOM 1405 N N . GLN A 1 186 ? -31.706 -36.824 -97.384 1.00 65.28 ? 186 GLN A N 1 ATOM 1406 C CA . GLN A 1 186 ? -31.770 -37.661 -98.582 1.00 62.92 ? 186 GLN A CA 1 ATOM 1407 C C . GLN A 1 186 ? -30.814 -37.177 -99.666 1.00 61.98 ? 186 GLN A C 1 ATOM 1408 O O . GLN A 1 186 ? -30.843 -36.008 -100.052 1.00 63.52 ? 186 GLN A O 1 ATOM 1409 C CB . GLN A 1 186 ? -33.204 -37.728 -99.127 1.00 63.61 ? 186 GLN A CB 1 ATOM 1410 C CG . GLN A 1 186 ? -34.220 -38.421 -98.207 1.00 64.23 ? 186 GLN A CG 1 ATOM 1411 C CD . GLN A 1 186 ? -34.044 -39.935 -98.125 1.00 62.06 ? 186 GLN A CD 1 ATOM 1412 O OE1 . GLN A 1 186 ? -34.502 -40.571 -97.175 1.00 62.12 ? 186 GLN A OE1 1 ATOM 1413 N NE2 . GLN A 1 186 ? -33.384 -40.517 -99.124 1.00 59.93 ? 186 GLN A NE2 1 ATOM 1414 N N . GLU A 1 187 ? -29.966 -38.082 -100.147 1.00 59.80 ? 187 GLU A N 1 ATOM 1415 C CA . GLU A 1 187 ? -29.024 -37.770 -101.219 1.00 58.96 ? 187 GLU A CA 1 ATOM 1416 C C . GLU A 1 187 ? -29.181 -38.724 -102.394 1.00 57.02 ? 187 GLU A C 1 ATOM 1417 O O . GLU A 1 187 ? -29.142 -39.945 -102.221 1.00 55.60 ? 187 GLU A O 1 ATOM 1418 C CB . GLU A 1 187 ? -27.581 -37.776 -100.704 1.00 58.52 ? 187 GLU A CB 1 ATOM 1419 C CG . GLU A 1 187 ? -27.211 -36.548 -99.873 1.00 61.10 ? 187 GLU A CG 1 ATOM 1420 C CD . GLU A 1 187 ? -27.363 -35.239 -100.640 0.70 63.08 ? 187 GLU A CD 1 ATOM 1421 O OE1 . GLU A 1 187 ? -28.101 -34.353 -100.158 0.70 65.07 ? 187 GLU A OE1 1 ATOM 1422 O OE2 . GLU A 1 187 ? -26.756 -35.101 -101.726 0.70 62.42 ? 187 GLU A OE2 1 ATOM 1423 N N . LYS A 1 188 ? -29.359 -38.151 -103.584 1.00 57.33 ? 188 LYS A N 1 ATOM 1424 C CA . LYS A 1 188 ? -29.608 -38.915 -104.808 1.00 55.85 ? 188 LYS A CA 1 ATOM 1425 C C . LYS A 1 188 ? -28.351 -39.610 -105.324 1.00 53.80 ? 188 LYS A C 1 ATOM 1426 O O . LYS A 1 188 ? -27.307 -38.971 -105.469 1.00 53.98 ? 188 LYS A O 1 ATOM 1427 C CB . LYS A 1 188 ? -30.189 -38.008 -105.900 1.00 57.36 ? 188 LYS A CB 1 ATOM 1428 C CG . LYS A 1 188 ? -31.615 -37.538 -105.637 1.00 59.61 ? 188 LYS A CG 1 ATOM 1429 C CD . LYS A 1 188 ? -32.021 -36.387 -106.554 1.00 61.94 ? 188 LYS A CD 1 ATOM 1430 C CE . LYS A 1 188 ? -33.428 -35.901 -106.221 1.00 64.51 ? 188 LYS A CE 1 ATOM 1431 N NZ . LYS A 1 188 ? -33.744 -34.585 -106.837 1.00 67.26 ? 188 LYS A NZ 1 ATOM 1432 N N . PRO A 1 189 ? -28.447 -40.926 -105.598 1.00 52.05 ? 189 PRO A N 1 ATOM 1433 C CA . PRO A 1 189 ? -27.346 -41.657 -106.224 1.00 50.24 ? 189 PRO A CA 1 ATOM 1434 C C . PRO A 1 189 ? -27.184 -41.313 -107.703 1.00 50.25 ? 189 PRO A C 1 ATOM 1435 O O . PRO A 1 189 ? -28.116 -40.817 -108.340 1.00 51.19 ? 189 PRO A O 1 ATOM 1436 C CB . PRO A 1 189 ? -27.775 -43.121 -106.087 1.00 48.83 ? 189 PRO A CB 1 ATOM 1437 C CG . PRO A 1 189 ? -29.254 -43.074 -106.020 1.00 49.87 ? 189 PRO A CG 1 ATOM 1438 C CD . PRO A 1 189 ? -29.575 -41.818 -105.268 1.00 51.86 ? 189 PRO A CD 1 ATOM 1439 N N . VAL A 1 190 ? -25.989 -41.572 -108.222 1.00 49.34 ? 190 VAL A N 1 ATOM 1440 C CA . VAL A 1 190 ? -25.699 -41.493 -109.647 1.00 49.19 ? 190 VAL A CA 1 ATOM 1441 C C . VAL A 1 190 ? -25.113 -42.842 -110.037 1.00 47.52 ? 190 VAL A C 1 ATOM 1442 O O . VAL A 1 190 ? -24.404 -43.469 -109.243 1.00 46.66 ? 190 VAL A O 1 ATOM 1443 C CB . VAL A 1 190 ? -24.705 -40.347 -109.968 1.00 50.35 ? 190 VAL A CB 1 ATOM 1444 C CG1 . VAL A 1 190 ? -24.179 -40.451 -111.393 1.00 50.19 ? 190 VAL A CG1 1 ATOM 1445 C CG2 . VAL A 1 190 ? -25.367 -38.983 -109.744 1.00 52.33 ? 190 VAL A CG2 1 ATOM 1446 N N . ALA A 1 191 ? -25.425 -43.294 -111.248 1.00 47.23 ? 191 ALA A N 1 ATOM 1447 C CA . ALA A 1 191 ? -24.963 -44.591 -111.715 1.00 45.57 ? 191 ALA A CA 1 ATOM 1448 C C . ALA A 1 191 ? -24.302 -44.526 -113.089 1.00 45.85 ? 191 ALA A C 1 ATOM 1449 O O . ALA A 1 191 ? -24.603 -43.648 -113.900 1.00 47.04 ? 191 ALA A O 1 ATOM 1450 C CB . ALA A 1 191 ? -26.111 -45.586 -111.715 1.00 45.17 ? 191 ALA A CB 1 ATOM 1451 N N . TRP A 1 192 ? -23.387 -45.463 -113.332 1.00 44.81 ? 192 TRP A N 1 ATOM 1452 C CA . TRP A 1 192 ? -22.763 -45.631 -114.642 1.00 45.00 ? 192 TRP A CA 1 ATOM 1453 C C . TRP A 1 192 ? -22.378 -47.085 -114.906 1.00 44.05 ? 192 TRP A C 1 ATOM 1454 O O . TRP A 1 192 ? -22.304 -47.899 -113.983 1.00 43.21 ? 192 TRP A O 1 ATOM 1455 C CB . TRP A 1 192 ? -21.569 -44.682 -114.833 1.00 45.71 ? 192 TRP A CB 1 ATOM 1456 C CG . TRP A 1 192 ? -20.384 -44.886 -113.912 1.00 44.54 ? 192 TRP A CG 1 ATOM 1457 C CD1 . TRP A 1 192 ? -19.222 -45.537 -114.209 1.00 43.67 ? 192 TRP A CD1 1 ATOM 1458 C CD2 . TRP A 1 192 ? -20.233 -44.390 -112.573 1.00 43.90 ? 192 TRP A CD2 1 ATOM 1459 N NE1 . TRP A 1 192 ? -18.367 -45.495 -113.136 1.00 43.09 ? 192 TRP A NE1 1 ATOM 1460 C CE2 . TRP A 1 192 ? -18.959 -44.795 -112.120 1.00 43.29 ? 192 TRP A CE2 1 ATOM 1461 C CE3 . TRP A 1 192 ? -21.055 -43.651 -111.709 1.00 44.70 ? 192 TRP A CE3 1 ATOM 1462 C CZ2 . TRP A 1 192 ? -18.484 -44.489 -110.837 1.00 44.01 ? 192 TRP A CZ2 1 ATOM 1463 C CZ3 . TRP A 1 192 ? -20.580 -43.343 -110.430 1.00 44.74 ? 192 TRP A CZ3 1 ATOM 1464 C CH2 . TRP A 1 192 ? -19.307 -43.764 -110.010 1.00 44.35 ? 192 TRP A CH2 1 ATOM 1465 N N . LEU A 1 193 ? -22.148 -47.407 -116.174 1.00 44.50 ? 193 LEU A N 1 ATOM 1466 C CA . LEU A 1 193 ? -21.850 -48.771 -116.572 1.00 43.69 ? 193 LEU A CA 1 ATOM 1467 C C . LEU A 1 193 ? -20.427 -48.919 -117.092 1.00 43.82 ? 193 LEU A C 1 ATOM 1468 O O . LEU A 1 193 ? -19.891 -48.015 -117.732 1.00 44.98 ? 193 LEU A O 1 ATOM 1469 C CB . LEU A 1 193 ? -22.849 -49.245 -117.637 1.00 44.40 ? 193 LEU A CB 1 ATOM 1470 C CG . LEU A 1 193 ? -24.349 -49.282 -117.310 1.00 44.48 ? 193 LEU A CG 1 ATOM 1471 C CD1 . LEU A 1 193 ? -25.134 -49.782 -118.516 1.00 45.04 ? 193 LEU A CD1 1 ATOM 1472 C CD2 . LEU A 1 193 ? -24.659 -50.137 -116.076 1.00 43.33 ? 193 LEU A CD2 1 ATOM 1473 N N . SER A 1 194 ? -19.822 -50.065 -116.796 1.00 42.82 ? 194 SER A N 1 ATOM 1474 C CA . SER A 1 194 ? -18.560 -50.471 -117.407 1.00 43.07 ? 194 SER A CA 1 ATOM 1475 C C . SER A 1 194 ? -18.517 -51.994 -117.511 1.00 42.46 ? 194 SER A C 1 ATOM 1476 O O . SER A 1 194 ? -19.436 -52.682 -117.053 1.00 41.72 ? 194 SER A O 1 ATOM 1477 C CB . SER A 1 194 ? -17.367 -49.948 -116.604 1.00 43.01 ? 194 SER A CB 1 ATOM 1478 O OG . SER A 1 194 ? -17.251 -50.621 -115.364 1.00 42.39 ? 194 SER A OG 1 ATOM 1479 N N . SER A 1 195 ? -17.457 -52.516 -118.120 1.00 42.87 ? 195 SER A N 1 ATOM 1480 C CA . SER A 1 195 ? -17.282 -53.959 -118.247 1.00 42.63 ? 195 SER A CA 1 ATOM 1481 C C . SER A 1 195 ? -15.820 -54.361 -118.171 1.00 42.97 ? 195 SER A C 1 ATOM 1482 O O . SER A 1 195 ? -14.928 -53.621 -118.589 1.00 43.98 ? 195 SER A O 1 ATOM 1483 C CB . SER A 1 195 ? -17.918 -54.493 -119.539 1.00 43.60 ? 195 SER A CB 1 ATOM 1484 O OG . SER A 1 195 ? -17.278 -53.983 -120.698 1.00 44.92 ? 195 SER A OG 1 ATOM 1485 N N . VAL A 1 196 ? -15.590 -55.552 -117.640 1.00 42.49 ? 196 VAL A N 1 ATOM 1486 C CA . VAL A 1 196 ? -14.249 -56.072 -117.450 1.00 42.85 ? 196 VAL A CA 1 ATOM 1487 C C . VAL A 1 196 ? -14.256 -57.538 -117.913 1.00 43.02 ? 196 VAL A C 1 ATOM 1488 O O . VAL A 1 196 ? -15.331 -58.141 -118.008 1.00 42.65 ? 196 VAL A O 1 ATOM 1489 C CB . VAL A 1 196 ? -13.824 -55.888 -115.962 1.00 42.26 ? 196 VAL A CB 1 ATOM 1490 C CG1 . VAL A 1 196 ? -14.342 -57.026 -115.072 1.00 41.73 ? 196 VAL A CG1 1 ATOM 1491 C CG2 . VAL A 1 196 ? -12.323 -55.716 -115.837 1.00 43.74 ? 196 VAL A CG2 1 ATOM 1492 N N . PRO A 1 197 ? -13.080 -58.106 -118.252 1.00 43.83 ? 197 PRO A N 1 ATOM 1493 C CA . PRO A 1 197 ? -13.106 -59.541 -118.553 1.00 44.27 ? 197 PRO A CA 1 ATOM 1494 C C . PRO A 1 197 ? -13.456 -60.370 -117.318 1.00 43.39 ? 197 PRO A C 1 ATOM 1495 O O . PRO A 1 197 ? -13.054 -60.027 -116.203 1.00 42.79 ? 197 PRO A O 1 ATOM 1496 C CB . PRO A 1 197 ? -11.669 -59.840 -118.994 1.00 45.59 ? 197 PRO A CB 1 ATOM 1497 C CG . PRO A 1 197 ? -11.115 -58.536 -119.419 1.00 46.04 ? 197 PRO A CG 1 ATOM 1498 C CD . PRO A 1 197 ? -11.767 -57.508 -118.553 1.00 44.81 ? 197 PRO A CD 1 ATOM 1499 N N . SER A 1 198 ? -14.225 -61.434 -117.526 1.00 43.47 ? 198 SER A N 1 ATOM 1500 C CA . SER A 1 198 ? -14.512 -62.411 -116.482 1.00 43.10 ? 198 SER A CA 1 ATOM 1501 C C . SER A 1 198 ? -13.295 -63.302 -116.280 1.00 44.28 ? 198 SER A C 1 ATOM 1502 O O . SER A 1 198 ? -12.399 -63.336 -117.124 1.00 45.42 ? 198 SER A O 1 ATOM 1503 C CB . SER A 1 198 ? -15.733 -63.252 -116.872 1.00 43.30 ? 198 SER A CB 1 ATOM 1504 O OG . SER A 1 198 ? -15.738 -64.528 -116.249 1.00 43.78 ? 198 SER A OG 1 ATOM 1505 N N . SER A 1 199 ? -13.266 -64.024 -115.165 1.00 44.28 ? 199 SER A N 1 ATOM 1506 C CA . SER A 1 199 ? -12.194 -64.984 -114.916 1.00 45.75 ? 199 SER A CA 1 ATOM 1507 C C . SER A 1 199 ? -12.348 -66.226 -115.799 1.00 47.01 ? 199 SER A C 1 ATOM 1508 O O . SER A 1 199 ? -11.379 -66.952 -116.029 1.00 48.58 ? 199 SER A O 1 ATOM 1509 C CB . SER A 1 199 ? -12.145 -65.372 -113.439 1.00 45.67 ? 199 SER A CB 1 ATOM 1510 O OG . SER A 1 199 ? -13.173 -66.292 -113.127 1.00 46.05 ? 199 SER A OG 1 ATOM 1511 N N . ALA A 1 200 ? -13.568 -66.455 -116.287 1.00 46.56 ? 200 ALA A N 1 ATOM 1512 C CA . ALA A 1 200 ? -13.873 -67.593 -117.158 1.00 48.02 ? 200 ALA A CA 1 ATOM 1513 C C . ALA A 1 200 ? -13.764 -67.210 -118.628 1.00 48.52 ? 200 ALA A C 1 ATOM 1514 O O . ALA A 1 200 ? -14.213 -66.140 -119.032 1.00 47.57 ? 200 ALA A O 1 ATOM 1515 C CB . ALA A 1 200 ? -15.258 -68.139 -116.855 1.00 47.69 ? 200 ALA A CB 1 ATOM 1516 N N . HIS A 1 201 ? -13.172 -68.099 -119.420 1.00 50.42 ? 201 HIS A N 1 ATOM 1517 C CA . HIS A 1 201 ? -12.934 -67.847 -120.838 1.00 51.46 ? 201 HIS A CA 1 ATOM 1518 C C . HIS A 1 201 ? -14.224 -67.625 -121.628 1.00 51.16 ? 201 HIS A C 1 ATOM 1519 O O . HIS A 1 201 ? -15.155 -68.435 -121.564 1.00 51.53 ? 201 HIS A O 1 ATOM 1520 C CB . HIS A 1 201 ? -12.117 -68.985 -121.456 1.00 53.87 ? 201 HIS A CB 1 ATOM 1521 C CG . HIS A 1 201 ? -11.941 -68.868 -122.937 1.00 55.55 ? 201 HIS A CG 1 ATOM 1522 N ND1 . HIS A 1 201 ? -11.081 -67.959 -123.515 1.00 56.08 ? 201 HIS A ND1 1 ATOM 1523 C CD2 . HIS A 1 201 ? -12.516 -69.545 -123.959 1.00 56.87 ? 201 HIS A CD2 1 ATOM 1524 C CE1 . HIS A 1 201 ? -11.133 -68.081 -124.830 1.00 57.63 ? 201 HIS A CE1 1 ATOM 1525 N NE2 . HIS A 1 201 ? -11.997 -69.037 -125.124 1.00 58.25 ? 201 HIS A NE2 1 ATOM 1526 N N . GLY A 1 202 ? -14.261 -66.523 -122.373 1.00 50.74 ? 202 GLY A N 1 ATOM 1527 C CA . GLY A 1 202 ? -15.394 -66.200 -123.237 1.00 50.80 ? 202 GLY A CA 1 ATOM 1528 C C . GLY A 1 202 ? -16.493 -65.428 -122.533 1.00 48.86 ? 202 GLY A C 1 ATOM 1529 O O . GLY A 1 202 ? -17.524 -65.107 -123.133 1.00 48.97 ? 202 GLY A O 1 ATOM 1530 N N . HIS A 1 203 ? -16.272 -65.128 -121.258 1.00 47.25 ? 203 HIS A N 1 ATOM 1531 C CA . HIS A 1 203 ? -17.258 -64.421 -120.455 1.00 45.49 ? 203 HIS A CA 1 ATOM 1532 C C . HIS A 1 203 ? -16.835 -62.985 -120.191 1.00 44.29 ? 203 HIS A C 1 ATOM 1533 O O . HIS A 1 203 ? -15.667 -62.621 -120.349 1.00 44.64 ? 203 HIS A O 1 ATOM 1534 C CB . HIS A 1 203 ? -17.506 -65.158 -119.139 1.00 44.94 ? 203 HIS A CB 1 ATOM 1535 C CG . HIS A 1 203 ? -18.239 -66.452 -119.298 1.00 46.39 ? 203 HIS A CG 1 ATOM 1536 N ND1 . HIS A 1 203 ? -19.482 -66.674 -118.747 1.00 46.52 ? 203 HIS A ND1 1 ATOM 1537 C CD2 . HIS A 1 203 ? -17.908 -67.592 -119.950 1.00 48.44 ? 203 HIS A CD2 1 ATOM 1538 C CE1 . HIS A 1 203 ? -19.883 -67.897 -119.047 1.00 48.26 ? 203 HIS A CE1 1 ATOM 1539 N NE2 . HIS A 1 203 ? -18.947 -68.474 -119.780 1.00 49.52 ? 203 HIS A NE2 1 ATOM 1540 N N . ARG A 1 204 ? -17.808 -62.177 -119.788 1.00 43.03 ? 204 ARG A N 1 ATOM 1541 C CA . ARG A 1 204 ? -17.601 -60.772 -119.495 1.00 42.10 ? 204 ARG A CA 1 ATOM 1542 C C . ARG A 1 204 ? -18.308 -60.437 -118.189 1.00 40.89 ? 204 ARG A C 1 ATOM 1543 O O . ARG A 1 204 ? -19.335 -61.040 -117.866 1.00 40.94 ? 204 ARG A O 1 ATOM 1544 C CB . ARG A 1 204 ? -18.154 -59.918 -120.638 1.00 42.64 ? 204 ARG A CB 1 ATOM 1545 C CG . ARG A 1 204 ? -17.148 -59.610 -121.740 1.00 43.43 ? 204 ARG A CG 1 ATOM 1546 C CD . ARG A 1 204 ? -16.678 -58.168 -121.643 1.00 42.62 ? 204 ARG A CD 1 ATOM 1547 N NE . ARG A 1 204 ? -15.236 -58.041 -121.842 1.00 43.20 ? 204 ARG A NE 1 ATOM 1548 C CZ . ARG A 1 204 ? -14.535 -56.940 -121.584 1.00 42.97 ? 204 ARG A CZ 1 ATOM 1549 N NH1 . ARG A 1 204 ? -15.141 -55.854 -121.116 1.00 41.76 ? 204 ARG A NH1 1 ATOM 1550 N NH2 . ARG A 1 204 ? -13.223 -56.923 -121.794 1.00 43.79 ? 204 ARG A NH2 1 ATOM 1551 N N . GLN A 1 205 ? -17.752 -59.495 -117.432 1.00 40.02 ? 205 GLN A N 1 ATOM 1552 C CA . GLN A 1 205 ? -18.385 -59.056 -116.198 1.00 39.11 ? 205 GLN A CA 1 ATOM 1553 C C . GLN A 1 205 ? -18.841 -57.601 -116.314 1.00 38.87 ? 205 GLN A C 1 ATOM 1554 O O . GLN A 1 205 ? -18.020 -56.679 -116.392 1.00 38.95 ? 205 GLN A O 1 ATOM 1555 C CB . GLN A 1 205 ? -17.453 -59.253 -114.997 1.00 38.85 ? 205 GLN A CB 1 ATOM 1556 C CG . GLN A 1 205 ? -18.179 -59.348 -113.658 1.00 38.39 ? 205 GLN A CG 1 ATOM 1557 C CD . GLN A 1 205 ? -17.252 -59.208 -112.457 0.90 38.96 ? 205 GLN A CD 1 ATOM 1558 O OE1 . GLN A 1 205 ? -16.648 -58.155 -112.237 0.90 38.73 ? 205 GLN A OE1 1 ATOM 1559 N NE2 . GLN A 1 205 ? -17.154 -60.267 -111.661 0.90 39.61 ? 205 GLN A NE2 1 ATOM 1560 N N . LEU A 1 206 ? -20.157 -57.411 -116.340 1.00 38.76 ? 206 LEU A N 1 ATOM 1561 C CA . LEU A 1 206 ? -20.751 -56.083 -116.425 1.00 38.69 ? 206 LEU A CA 1 ATOM 1562 C C . LEU A 1 206 ? -20.834 -55.476 -115.035 1.00 38.11 ? 206 LEU A C 1 ATOM 1563 O O . LEU A 1 206 ? -21.261 -56.138 -114.088 1.00 37.90 ? 206 LEU A O 1 ATOM 1564 C CB . LEU A 1 206 ? -22.148 -56.147 -117.052 1.00 39.09 ? 206 LEU A CB 1 ATOM 1565 C CG . LEU A 1 206 ? -22.393 -57.003 -118.301 1.00 39.75 ? 206 LEU A CG 1 ATOM 1566 C CD1 . LEU A 1 206 ? -23.833 -56.851 -118.762 1.00 39.79 ? 206 LEU A CD1 1 ATOM 1567 C CD2 . LEU A 1 206 ? -21.430 -56.661 -119.428 1.00 40.25 ? 206 LEU A CD2 1 ATOM 1568 N N . VAL A 1 207 ? -20.415 -54.220 -114.914 1.00 38.20 ? 207 VAL A N 1 ATOM 1569 C CA . VAL A 1 207 ? -20.425 -53.538 -113.626 1.00 37.84 ? 207 VAL A CA 1 ATOM 1570 C C . VAL A 1 207 ? -21.378 -52.351 -113.670 1.00 38.22 ? 207 VAL A C 1 ATOM 1571 O O . VAL A 1 207 ? -21.328 -51.533 -114.594 1.00 38.83 ? 207 VAL A O 1 ATOM 1572 C CB . VAL A 1 207 ? -19.004 -53.059 -113.203 1.00 38.00 ? 207 VAL A CB 1 ATOM 1573 C CG1 . VAL A 1 207 ? -19.037 -52.409 -111.822 1.00 37.63 ? 207 VAL A CG1 1 ATOM 1574 C CG2 . VAL A 1 207 ? -18.010 -54.213 -113.212 1.00 37.89 ? 207 VAL A CG2 1 ATOM 1575 N N . CYS A 1 208 ? -22.244 -52.276 -112.665 1.00 38.13 ? 208 CYS A N 1 ATOM 1576 C CA . CYS A 1 208 ? -23.131 -51.137 -112.471 1.00 38.70 ? 208 CYS A CA 1 ATOM 1577 C C . CYS A 1 208 ? -22.665 -50.351 -111.250 1.00 38.54 ? 208 CYS A C 1 ATOM 1578 O O . CYS A 1 208 ? -22.894 -50.762 -110.110 1.00 38.45 ? 208 CYS A O 1 ATOM 1579 C CB . CYS A 1 208 ? -24.570 -51.615 -112.280 1.00 38.93 ? 208 CYS A CB 1 ATOM 1580 S SG . CYS A 1 208 ? -25.784 -50.290 -112.181 1.00 41.05 ? 208 CYS A SG 1 ATOM 1581 N N . HIS A 1 209 ? -21.989 -49.233 -111.492 1.00 38.88 ? 209 HIS A N 1 ATOM 1582 C CA . HIS A 1 209 ? -21.477 -48.393 -110.412 1.00 38.94 ? 209 HIS A CA 1 ATOM 1583 C C . HIS A 1 209 ? -22.583 -47.483 -109.895 1.00 39.36 ? 209 HIS A C 1 ATOM 1584 O O . HIS A 1 209 ? -23.161 -46.725 -110.668 1.00 39.99 ? 209 HIS A O 1 ATOM 1585 C CB . HIS A 1 209 ? -20.321 -47.524 -110.904 1.00 39.49 ? 209 HIS A CB 1 ATOM 1586 C CG . HIS A 1 209 ? -19.209 -48.285 -111.555 1.00 39.26 ? 209 HIS A CG 1 ATOM 1587 N ND1 . HIS A 1 209 ? -18.062 -48.648 -110.881 1.00 39.45 ? 209 HIS A ND1 1 ATOM 1588 C CD2 . HIS A 1 209 ? -19.053 -48.724 -112.825 1.00 39.36 ? 209 HIS A CD2 1 ATOM 1589 C CE1 . HIS A 1 209 ? -17.251 -49.286 -111.706 1.00 39.64 ? 209 HIS A CE1 1 ATOM 1590 N NE2 . HIS A 1 209 ? -17.830 -49.347 -112.892 1.00 39.75 ? 209 HIS A NE2 1 ATOM 1591 N N . VAL A 1 210 ? -22.872 -47.563 -108.597 1.00 39.16 ? 210 VAL A N 1 ATOM 1592 C CA . VAL A 1 210 ? -23.884 -46.714 -107.962 1.00 39.83 ? 210 VAL A CA 1 ATOM 1593 C C . VAL A 1 210 ? -23.227 -45.919 -106.836 1.00 40.49 ? 210 VAL A C 1 ATOM 1594 O O . VAL A 1 210 ? -22.825 -46.491 -105.817 1.00 40.30 ? 210 VAL A O 1 ATOM 1595 C CB . VAL A 1 210 ? -25.073 -47.542 -107.396 1.00 39.65 ? 210 VAL A CB 1 ATOM 1596 C CG1 . VAL A 1 210 ? -26.186 -46.627 -106.901 1.00 40.87 ? 210 VAL A CG1 1 ATOM 1597 C CG2 . VAL A 1 210 ? -25.618 -48.502 -108.439 1.00 39.18 ? 210 VAL A CG2 1 ATOM 1598 N N . SER A 1 211 ? -23.123 -44.604 -107.017 1.00 41.57 ? 211 SER A N 1 ATOM 1599 C CA . SER A 1 211 ? -22.368 -43.769 -106.081 1.00 42.58 ? 211 SER A CA 1 ATOM 1600 C C . SER A 1 211 ? -23.076 -42.491 -105.662 1.00 44.12 ? 211 SER A C 1 ATOM 1601 O O . SER A 1 211 ? -23.769 -41.859 -106.462 1.00 44.92 ? 211 SER A O 1 ATOM 1602 C CB . SER A 1 211 ? -21.002 -43.412 -106.671 1.00 42.71 ? 211 SER A CB 1 ATOM 1603 O OG . SER A 1 211 ? -20.098 -43.012 -105.654 1.00 43.39 ? 211 SER A OG 1 ATOM 1604 N N . GLY A 1 212 ? -22.878 -42.115 -104.401 1.00 45.00 ? 212 GLY A N 1 ATOM 1605 C CA . GLY A 1 212 ? -23.302 -40.810 -103.893 1.00 46.77 ? 212 GLY A CA 1 ATOM 1606 C C . GLY A 1 212 ? -24.605 -40.785 -103.117 1.00 47.44 ? 212 GLY A C 1 ATOM 1607 O O . GLY A 1 212 ? -25.116 -39.709 -102.798 1.00 49.02 ? 212 GLY A O 1 ATOM 1608 N N . PHE A 1 213 ? -25.138 -41.962 -102.799 1.00 46.48 ? 213 PHE A N 1 ATOM 1609 C CA . PHE A 1 213 ? -26.442 -42.054 -102.153 1.00 47.35 ? 213 PHE A CA 1 ATOM 1610 C C . PHE A 1 213 ? -26.379 -42.025 -100.633 1.00 48.67 ? 213 PHE A C 1 ATOM 1611 O O . PHE A 1 213 ? -25.408 -42.479 -100.030 1.00 48.39 ? 213 PHE A O 1 ATOM 1612 C CB . PHE A 1 213 ? -27.232 -43.278 -102.643 1.00 46.09 ? 213 PHE A CB 1 ATOM 1613 C CG . PHE A 1 213 ? -26.545 -44.595 -102.414 1.00 44.33 ? 213 PHE A CG 1 ATOM 1614 C CD1 . PHE A 1 213 ? -25.683 -45.120 -103.370 1.00 42.80 ? 213 PHE A CD1 1 ATOM 1615 C CD2 . PHE A 1 213 ? -26.782 -45.326 -101.257 1.00 44.72 ? 213 PHE A CD2 1 ATOM 1616 C CE1 . PHE A 1 213 ? -25.050 -46.345 -103.169 1.00 41.78 ? 213 PHE A CE1 1 ATOM 1617 C CE2 . PHE A 1 213 ? -26.152 -46.554 -101.045 1.00 43.90 ? 213 PHE A CE2 1 ATOM 1618 C CZ . PHE A 1 213 ? -25.285 -47.064 -102.003 1.00 42.14 ? 213 PHE A CZ 1 ATOM 1619 N N . TYR A 1 214 ? -27.428 -41.464 -100.036 1.00 50.53 ? 214 TYR A N 1 ATOM 1620 C CA . TYR A 1 214 ? -27.626 -41.445 -98.590 1.00 52.10 ? 214 TYR A CA 1 ATOM 1621 C C . TYR A 1 214 ? -29.133 -41.368 -98.337 1.00 53.38 ? 214 TYR A C 1 ATOM 1622 O O . TYR A 1 214 ? -29.828 -40.630 -99.038 1.00 54.10 ? 214 TYR A O 1 ATOM 1623 C CB . TYR A 1 214 ? -26.908 -40.249 -97.953 1.00 53.78 ? 214 TYR A CB 1 ATOM 1624 C CG . TYR A 1 214 ? -26.958 -40.236 -96.441 1.00 55.72 ? 214 TYR A CG 1 ATOM 1625 C CD1 . TYR A 1 214 ? -27.978 -39.573 -95.765 1.00 58.15 ? 214 TYR A CD1 1 ATOM 1626 C CD2 . TYR A 1 214 ? -25.989 -40.896 -95.688 1.00 55.90 ? 214 TYR A CD2 1 ATOM 1627 C CE1 . TYR A 1 214 ? -28.035 -39.565 -94.379 1.00 60.63 ? 214 TYR A CE1 1 ATOM 1628 C CE2 . TYR A 1 214 ? -26.034 -40.896 -94.300 1.00 58.16 ? 214 TYR A CE2 1 ATOM 1629 C CZ . TYR A 1 214 ? -27.060 -40.228 -93.651 1.00 60.60 ? 214 TYR A CZ 1 ATOM 1630 O OH . TYR A 1 214 ? -27.110 -40.217 -92.274 1.00 63.12 ? 214 TYR A OH 1 ATOM 1631 N N . PRO A 1 215 ? -29.651 -42.128 -97.347 1.00 54.03 ? 215 PRO A N 1 ATOM 1632 C CA . PRO A 1 215 ? -28.971 -43.063 -96.445 1.00 53.80 ? 215 PRO A CA 1 ATOM 1633 C C . PRO A 1 215 ? -28.541 -44.377 -97.106 1.00 51.82 ? 215 PRO A C 1 ATOM 1634 O O . PRO A 1 215 ? -28.672 -44.536 -98.322 1.00 50.54 ? 215 PRO A O 1 ATOM 1635 C CB . PRO A 1 215 ? -30.022 -43.320 -95.356 1.00 55.56 ? 215 PRO A CB 1 ATOM 1636 C CG . PRO A 1 215 ? -31.314 -43.091 -96.021 1.00 55.73 ? 215 PRO A CG 1 ATOM 1637 C CD . PRO A 1 215 ? -31.076 -41.978 -96.992 1.00 55.61 ? 215 PRO A CD 1 ATOM 1638 N N . LYS A 1 216 ? -28.044 -45.301 -96.285 1.00 51.96 ? 216 LYS A N 1 ATOM 1639 C CA . LYS A 1 216 ? -27.413 -46.548 -96.731 1.00 50.39 ? 216 LYS A CA 1 ATOM 1640 C C . LYS A 1 216 ? -28.303 -47.483 -97.576 1.00 49.48 ? 216 LYS A C 1 ATOM 1641 O O . LYS A 1 216 ? -27.895 -47.870 -98.674 1.00 47.98 ? 216 LYS A O 1 ATOM 1642 C CB . LYS A 1 216 ? -26.840 -47.292 -95.520 1.00 51.28 ? 216 LYS A CB 1 ATOM 1643 C CG . LYS A 1 216 ? -25.587 -48.114 -95.775 1.00 50.35 ? 216 LYS A CG 1 ATOM 1644 C CD . LYS A 1 216 ? -25.273 -48.957 -94.539 1.00 52.38 ? 216 LYS A CD 1 ATOM 1645 C CE . LYS A 1 216 ? -23.984 -49.745 -94.674 1.00 52.25 ? 216 LYS A CE 1 ATOM 1646 N NZ . LYS A 1 216 ? -22.786 -48.908 -94.398 1.00 53.36 ? 216 LYS A NZ 1 ATOM 1647 N N . PRO A 1 217 ? -29.511 -47.848 -97.081 1.00 50.67 ? 217 PRO A N 1 ATOM 1648 C CA . PRO A 1 217 ? -30.332 -48.844 -97.789 1.00 50.01 ? 217 PRO A CA 1 ATOM 1649 C C . PRO A 1 217 ? -30.556 -48.530 -99.269 1.00 48.85 ? 217 PRO A C 1 ATOM 1650 O O . PRO A 1 217 ? -30.989 -47.428 -99.612 1.00 49.49 ? 217 PRO A O 1 ATOM 1651 C CB . PRO A 1 217 ? -31.662 -48.803 -97.033 1.00 51.86 ? 217 PRO A CB 1 ATOM 1652 C CG . PRO A 1 217 ? -31.290 -48.373 -95.666 1.00 53.46 ? 217 PRO A CG 1 ATOM 1653 C CD . PRO A 1 217 ? -30.184 -47.380 -95.852 1.00 52.86 ? 217 PRO A CD 1 ATOM 1654 N N . VAL A 1 218 ? -30.253 -49.506 -100.123 1.00 47.46 ? 218 VAL A N 1 ATOM 1655 C CA . VAL A 1 218 ? -30.368 -49.361 -101.572 1.00 46.36 ? 218 VAL A CA 1 ATOM 1656 C C . VAL A 1 218 ? -30.769 -50.697 -102.217 1.00 45.83 ? 218 VAL A C 1 ATOM 1657 O O . VAL A 1 218 ? -30.586 -51.760 -101.620 1.00 45.91 ? 218 VAL A O 1 ATOM 1658 C CB . VAL A 1 218 ? -29.044 -48.812 -102.184 1.00 45.19 ? 218 VAL A CB 1 ATOM 1659 C CG1 . VAL A 1 218 ? -27.992 -49.904 -102.295 1.00 44.00 ? 218 VAL A CG1 1 ATOM 1660 C CG2 . VAL A 1 218 ? -29.289 -48.164 -103.542 1.00 45.05 ? 218 VAL A CG2 1 ATOM 1661 N N . TRP A 1 219 ? -31.329 -50.626 -103.425 1.00 45.55 ? 219 TRP A N 1 ATOM 1662 C CA . TRP A 1 219 ? -31.694 -51.803 -104.215 1.00 45.07 ? 219 TRP A CA 1 ATOM 1663 C C . TRP A 1 219 ? -31.124 -51.642 -105.622 1.00 43.94 ? 219 TRP A C 1 ATOM 1664 O O . TRP A 1 219 ? -31.430 -50.664 -106.308 1.00 44.21 ? 219 TRP A O 1 ATOM 1665 C CB . TRP A 1 219 ? -33.214 -51.932 -104.272 1.00 46.47 ? 219 TRP A CB 1 ATOM 1666 C CG . TRP A 1 219 ? -33.743 -53.199 -104.894 1.00 47.02 ? 219 TRP A CG 1 ATOM 1667 C CD1 . TRP A 1 219 ? -34.064 -54.357 -104.244 1.00 48.04 ? 219 TRP A CD1 1 ATOM 1668 C CD2 . TRP A 1 219 ? -34.053 -53.421 -106.280 1.00 47.11 ? 219 TRP A CD2 1 ATOM 1669 N NE1 . TRP A 1 219 ? -34.539 -55.290 -105.136 1.00 48.01 ? 219 TRP A NE1 1 ATOM 1670 C CE2 . TRP A 1 219 ? -34.544 -54.744 -106.392 1.00 47.50 ? 219 TRP A CE2 1 ATOM 1671 C CE3 . TRP A 1 219 ? -33.955 -52.636 -107.438 1.00 46.64 ? 219 TRP A CE3 1 ATOM 1672 C CZ2 . TRP A 1 219 ? -34.942 -55.298 -107.616 1.00 47.65 ? 219 TRP A CZ2 1 ATOM 1673 C CZ3 . TRP A 1 219 ? -34.347 -53.190 -108.657 1.00 46.83 ? 219 TRP A CZ3 1 ATOM 1674 C CH2 . TRP A 1 219 ? -34.836 -54.508 -108.733 1.00 47.22 ? 219 TRP A CH2 1 ATOM 1675 N N . VAL A 1 220 ? -30.280 -52.589 -106.036 1.00 42.82 ? 220 VAL A N 1 ATOM 1676 C CA . VAL A 1 220 ? -29.661 -52.574 -107.369 1.00 41.85 ? 220 VAL A CA 1 ATOM 1677 C C . VAL A 1 220 ? -29.719 -53.969 -108.008 1.00 41.59 ? 220 VAL A C 1 ATOM 1678 O O . VAL A 1 220 ? -29.188 -54.931 -107.453 1.00 41.49 ? 220 VAL A O 1 ATOM 1679 C CB . VAL A 1 220 ? -28.180 -52.084 -107.328 1.00 40.99 ? 220 VAL A CB 1 ATOM 1680 C CG1 . VAL A 1 220 ? -27.674 -51.789 -108.729 1.00 40.51 ? 220 VAL A CG1 1 ATOM 1681 C CG2 . VAL A 1 220 ? -28.025 -50.845 -106.455 1.00 41.35 ? 220 VAL A CG2 1 ATOM 1682 N N . MET A 1 221 ? -30.365 -54.075 -109.166 1.00 41.80 ? 221 MET A N 1 ATOM 1683 C CA . MET A 1 221 ? -30.463 -55.351 -109.884 1.00 41.86 ? 221 MET A CA 1 ATOM 1684 C C . MET A 1 221 ? -30.309 -55.194 -111.390 1.00 41.79 ? 221 MET A C 1 ATOM 1685 O O . MET A 1 221 ? -30.735 -54.191 -111.966 1.00 42.34 ? 221 MET A O 1 ATOM 1686 C CB . MET A 1 221 ? -31.795 -56.055 -109.593 1.00 43.10 ? 221 MET A CB 1 ATOM 1687 C CG . MET A 1 221 ? -31.857 -56.792 -108.257 0.70 43.49 ? 221 MET A CG 1 ATOM 1688 S SD . MET A 1 221 ? -30.753 -58.211 -108.145 0.70 43.00 ? 221 MET A SD 1 ATOM 1689 C CE . MET A 1 221 ? -31.685 -59.472 -108.994 0.70 43.74 ? 221 MET A CE 1 ATOM 1690 N N . TRP A 1 222 ? -29.701 -56.196 -112.020 1.00 41.43 ? 222 TRP A N 1 ATOM 1691 C CA . TRP A 1 222 ? -29.668 -56.284 -113.473 1.00 41.63 ? 222 TRP A CA 1 ATOM 1692 C C . TRP A 1 222 ? -30.949 -56.943 -113.964 1.00 43.09 ? 222 TRP A C 1 ATOM 1693 O O . TRP A 1 222 ? -31.402 -57.950 -113.406 1.00 43.49 ? 222 TRP A O 1 ATOM 1694 C CB . TRP A 1 222 ? -28.440 -57.052 -113.951 1.00 40.99 ? 222 TRP A CB 1 ATOM 1695 C CG . TRP A 1 222 ? -27.181 -56.247 -113.914 1.00 39.46 ? 222 TRP A CG 1 ATOM 1696 C CD1 . TRP A 1 222 ? -26.335 -56.104 -112.857 1.00 38.30 ? 222 TRP A CD1 1 ATOM 1697 C CD2 . TRP A 1 222 ? -26.622 -55.471 -114.984 1.00 38.96 ? 222 TRP A CD2 1 ATOM 1698 N NE1 . TRP A 1 222 ? -25.282 -55.289 -113.198 1.00 37.56 ? 222 TRP A NE1 1 ATOM 1699 C CE2 . TRP A 1 222 ? -25.432 -54.885 -114.497 1.00 37.82 ? 222 TRP A CE2 1 ATOM 1700 C CE3 . TRP A 1 222 ? -27.010 -55.213 -116.306 1.00 39.40 ? 222 TRP A CE3 1 ATOM 1701 C CZ2 . TRP A 1 222 ? -24.623 -54.057 -115.286 1.00 37.75 ? 222 TRP A CZ2 1 ATOM 1702 C CZ3 . TRP A 1 222 ? -26.204 -54.387 -117.091 1.00 39.24 ? 222 TRP A CZ3 1 ATOM 1703 C CH2 . TRP A 1 222 ? -25.027 -53.820 -116.576 1.00 38.33 ? 222 TRP A CH2 1 ATOM 1704 N N . MET A 1 223 ? -31.531 -56.361 -115.008 1.00 44.15 ? 223 MET A N 1 ATOM 1705 C CA . MET A 1 223 ? -32.859 -56.742 -115.469 1.00 45.76 ? 223 MET A CA 1 ATOM 1706 C C . MET A 1 223 ? -32.873 -57.109 -116.942 1.00 46.75 ? 223 MET A C 1 ATOM 1707 O O . MET A 1 223 ? -32.096 -56.567 -117.731 1.00 46.47 ? 223 MET A O 1 ATOM 1708 C CB . MET A 1 223 ? -33.841 -55.585 -115.242 1.00 46.62 ? 223 MET A CB 1 ATOM 1709 C CG . MET A 1 223 ? -33.901 -55.057 -113.813 1.00 46.22 ? 223 MET A CG 1 ATOM 1710 S SD . MET A 1 223 ? -34.897 -56.084 -112.720 1.00 48.09 ? 223 MET A SD 1 ATOM 1711 C CE . MET A 1 223 ? -36.558 -55.616 -113.199 1.00 49.56 ? 223 MET A CE 1 ATOM 1712 N N . ARG A 1 224 ? -33.754 -58.045 -117.294 1.00 48.25 ? 224 ARG A N 1 ATOM 1713 C CA . ARG A 1 224 ? -34.201 -58.245 -118.674 1.00 50.08 ? 224 ARG A CA 1 ATOM 1714 C C . ARG A 1 224 ? -35.707 -58.049 -118.693 1.00 51.82 ? 224 ARG A C 1 ATOM 1715 O O . ARG A 1 224 ? -36.468 -58.997 -118.483 1.00 52.90 ? 224 ARG A O 1 ATOM 1716 C CB . ARG A 1 224 ? -33.865 -59.646 -119.186 1.00 50.61 ? 224 ARG A CB 1 ATOM 1717 C CG . ARG A 1 224 ? -32.455 -59.815 -119.687 1.00 50.25 ? 224 ARG A CG 1 ATOM 1718 C CD . ARG A 1 224 ? -32.375 -60.905 -120.755 1.00 52.48 ? 224 ARG A CD 1 ATOM 1719 N NE . ARG A 1 224 ? -31.004 -61.393 -120.915 1.00 52.13 ? 224 ARG A NE 1 ATOM 1720 C CZ . ARG A 1 224 ? -30.082 -60.831 -121.694 1.00 51.97 ? 224 ARG A CZ 1 ATOM 1721 N NH1 . ARG A 1 224 ? -30.367 -59.751 -122.414 1.00 52.43 ? 224 ARG A NH1 1 ATOM 1722 N NH2 . ARG A 1 224 ? -28.868 -61.358 -121.755 1.00 51.58 ? 224 ARG A NH2 1 ATOM 1723 N N . GLY A 1 225 ? -36.130 -56.809 -118.928 1.00 52.41 ? 225 GLY A N 1 ATOM 1724 C CA . GLY A 1 225 ? -37.539 -56.442 -118.843 1.00 54.30 ? 225 GLY A CA 1 ATOM 1725 C C . GLY A 1 225 ? -38.056 -56.647 -117.432 1.00 54.09 ? 225 GLY A C 1 ATOM 1726 O O . GLY A 1 225 ? -37.532 -56.063 -116.481 1.00 52.71 ? 225 GLY A O 1 ATOM 1727 N N . ASP A 1 226 ? -39.068 -57.500 -117.298 1.00 55.74 ? 226 ASP A N 1 ATOM 1728 C CA . ASP A 1 226 ? -39.681 -57.788 -116.003 1.00 56.09 ? 226 ASP A CA 1 ATOM 1729 C C . ASP A 1 226 ? -38.885 -58.786 -115.158 1.00 54.86 ? 226 ASP A C 1 ATOM 1730 O O . ASP A 1 226 ? -39.256 -59.067 -114.016 1.00 55.09 ? 226 ASP A O 1 ATOM 1731 C CB . ASP A 1 226 ? -41.128 -58.276 -116.186 1.00 58.64 ? 226 ASP A CB 1 ATOM 1732 C CG . ASP A 1 226 ? -41.236 -59.521 -117.066 1.00 59.73 ? 226 ASP A CG 1 ATOM 1733 O OD1 . ASP A 1 226 ? -40.205 -59.995 -117.591 1.00 58.69 ? 226 ASP A OD1 1 ATOM 1734 O OD2 . ASP A 1 226 ? -42.368 -60.027 -117.235 1.00 61.64 ? 226 ASP A OD2 1 ATOM 1735 N N . GLN A 1 227 ? -37.792 -59.305 -115.718 1.00 53.91 ? 227 GLN A N 1 ATOM 1736 C CA . GLN A 1 227 ? -37.028 -60.383 -115.089 1.00 53.18 ? 227 GLN A CA 1 ATOM 1737 C C . GLN A 1 227 ? -35.720 -59.931 -114.425 1.00 51.02 ? 227 GLN A C 1 ATOM 1738 O O . GLN A 1 227 ? -34.785 -59.492 -115.098 1.00 50.06 ? 227 GLN A O 1 ATOM 1739 C CB . GLN A 1 227 ? -36.746 -61.492 -116.109 1.00 53.94 ? 227 GLN A CB 1 ATOM 1740 C CG . GLN A 1 227 ? -36.453 -62.855 -115.488 1.00 54.49 ? 227 GLN A CG 1 ATOM 1741 C CD . GLN A 1 227 ? -37.712 -63.581 -115.035 0.70 56.89 ? 227 GLN A CD 1 ATOM 1742 O OE1 . GLN A 1 227 ? -38.614 -63.849 -115.835 0.70 58.73 ? 227 GLN A OE1 1 ATOM 1743 N NE2 . GLN A 1 227 ? -37.774 -63.909 -113.747 0.70 56.56 ? 227 GLN A NE2 1 ATOM 1744 N N . GLU A 1 228 ? -35.669 -60.053 -113.100 1.00 50.63 ? 228 GLU A N 1 ATOM 1745 C CA . GLU A 1 228 ? -34.450 -59.817 -112.327 1.00 48.89 ? 228 GLU A CA 1 ATOM 1746 C C . GLU A 1 228 ? -33.451 -60.949 -112.574 1.00 48.47 ? 228 GLU A C 1 ATOM 1747 O O . GLU A 1 228 ? -33.789 -62.127 -112.410 1.00 49.53 ? 228 GLU A O 1 ATOM 1748 C CB . GLU A 1 228 ? -34.774 -59.746 -110.834 1.00 48.97 ? 228 GLU A CB 1 ATOM 1749 C CG . GLU A 1 228 ? -35.784 -58.678 -110.434 1.00 50.15 ? 228 GLU A CG 1 ATOM 1750 C CD . GLU A 1 228 ? -36.062 -58.656 -108.935 1.00 51.24 ? 228 GLU A CD 1 ATOM 1751 O OE1 . GLU A 1 228 ? -37.098 -58.088 -108.527 1.00 52.30 ? 228 GLU A OE1 1 ATOM 1752 O OE2 . GLU A 1 228 ? -35.247 -59.209 -108.163 1.00 51.15 ? 228 GLU A OE2 1 ATOM 1753 N N . GLN A 1 229 ? -32.228 -60.596 -112.970 1.00 47.15 ? 229 GLN A N 1 ATOM 1754 C CA . GLN A 1 229 ? -31.194 -61.597 -113.254 1.00 46.87 ? 229 GLN A CA 1 ATOM 1755 C C . GLN A 1 229 ? -30.630 -62.164 -111.956 1.00 46.64 ? 229 GLN A C 1 ATOM 1756 O O . GLN A 1 229 ? -30.032 -61.440 -111.159 1.00 45.59 ? 229 GLN A O 1 ATOM 1757 C CB . GLN A 1 229 ? -30.075 -61.017 -114.126 1.00 45.78 ? 229 GLN A CB 1 ATOM 1758 C CG . GLN A 1 229 ? -30.539 -60.417 -115.446 1.00 46.27 ? 229 GLN A CG 1 ATOM 1759 C CD . GLN A 1 229 ? -31.286 -61.408 -116.324 1.00 47.99 ? 229 GLN A CD 1 ATOM 1760 O OE1 . GLN A 1 229 ? -32.518 -61.406 -116.372 1.00 49.07 ? 229 GLN A OE1 1 ATOM 1761 N NE2 . GLN A 1 229 ? -30.544 -62.264 -117.018 1.00 48.10 ? 229 GLN A NE2 1 ATOM 1762 N N . GLN A 1 230 ? -30.823 -63.465 -111.755 1.00 47.99 ? 230 GLN A N 1 ATOM 1763 C CA . GLN A 1 230 ? -30.491 -64.119 -110.484 1.00 48.34 ? 230 GLN A CA 1 ATOM 1764 C C . GLN A 1 230 ? -28.986 -64.259 -110.250 1.00 47.31 ? 230 GLN A C 1 ATOM 1765 O O . GLN A 1 230 ? -28.549 -64.620 -109.151 1.00 47.48 ? 230 GLN A O 1 ATOM 1766 C CB . GLN A 1 230 ? -31.194 -65.481 -110.374 1.00 50.32 ? 230 GLN A CB 1 ATOM 1767 C CG . GLN A 1 230 ? -32.728 -65.401 -110.311 1.00 52.16 ? 230 GLN A CG 1 ATOM 1768 C CD . GLN A 1 230 ? -33.236 -64.565 -109.140 1.00 52.79 ? 230 GLN A CD 1 ATOM 1769 O OE1 . GLN A 1 230 ? -33.668 -63.423 -109.318 1.00 52.06 ? 230 GLN A OE1 1 ATOM 1770 N NE2 . GLN A 1 230 ? -33.176 -65.128 -107.936 1.00 53.88 ? 230 GLN A NE2 1 ATOM 1771 N N . GLY A 1 231 ? -28.203 -63.956 -111.282 1.00 46.48 ? 231 GLY A N 1 ATOM 1772 C CA . GLY A 1 231 ? -26.749 -63.972 -111.185 1.00 45.67 ? 231 GLY A CA 1 ATOM 1773 C C . GLY A 1 231 ? -26.145 -62.669 -110.690 1.00 44.39 ? 231 GLY A C 1 ATOM 1774 O O . GLY A 1 231 ? -24.934 -62.588 -110.502 1.00 43.97 ? 231 GLY A O 1 ATOM 1775 N N . THR A 1 232 ? -26.982 -61.652 -110.484 1.00 44.12 ? 232 THR A N 1 ATOM 1776 C CA . THR A 1 232 ? -26.527 -60.338 -110.025 1.00 43.29 ? 232 THR A CA 1 ATOM 1777 C C . THR A 1 232 ? -25.866 -60.451 -108.657 1.00 43.51 ? 232 THR A C 1 ATOM 1778 O O . THR A 1 232 ? -26.452 -61.005 -107.726 1.00 44.56 ? 232 THR A O 1 ATOM 1779 C CB . THR A 1 232 ? -27.696 -59.329 -109.935 1.00 43.31 ? 232 THR A CB 1 ATOM 1780 O OG1 . THR A 1 232 ? -28.362 -59.242 -111.199 1.00 43.65 ? 232 THR A OG1 1 ATOM 1781 C CG2 . THR A 1 232 ? -27.196 -57.945 -109.545 1.00 42.36 ? 232 THR A CG2 1 ATOM 1782 N N . HIS A 1 233 ? -24.647 -59.930 -108.540 1.00 43.06 ? 233 HIS A N 1 ATOM 1783 C CA . HIS A 1 233 ? -23.938 -59.933 -107.263 1.00 43.39 ? 233 HIS A CA 1 ATOM 1784 C C . HIS A 1 233 ? -23.692 -58.533 -106.707 1.00 43.04 ? 233 HIS A C 1 ATOM 1785 O O . HIS A 1 233 ? -22.940 -57.745 -107.286 1.00 42.44 ? 233 HIS A O 1 ATOM 1786 C CB . HIS A 1 233 ? -22.616 -60.700 -107.366 1.00 43.50 ? 233 HIS A CB 1 ATOM 1787 C CG . HIS A 1 233 ? -21.760 -60.588 -106.141 1.00 43.85 ? 233 HIS A CG 1 ATOM 1788 N ND1 . HIS A 1 233 ? -20.631 -59.799 -106.092 1.00 43.59 ? 233 HIS A ND1 1 ATOM 1789 C CD2 . HIS A 1 233 ? -21.881 -61.146 -104.914 1.00 44.41 ? 233 HIS A CD2 1 ATOM 1790 C CE1 . HIS A 1 233 ? -20.086 -59.888 -104.893 1.00 44.01 ? 233 HIS A CE1 1 ATOM 1791 N NE2 . HIS A 1 233 ? -20.826 -60.698 -104.158 1.00 44.57 ? 233 HIS A NE2 1 ATOM 1792 N N . ARG A 1 234 ? -24.341 -58.242 -105.581 1.00 43.75 ? 234 ARG A N 1 ATOM 1793 C CA . ARG A 1 234 ? -24.082 -57.039 -104.796 1.00 43.87 ? 234 ARG A CA 1 ATOM 1794 C C . ARG A 1 234 ? -22.686 -57.100 -104.213 1.00 43.95 ? 234 ARG A C 1 ATOM 1795 O O . ARG A 1 234 ? -22.303 -58.110 -103.617 1.00 44.70 ? 234 ARG A O 1 ATOM 1796 C CB . ARG A 1 234 ? -25.056 -56.962 -103.627 1.00 45.00 ? 234 ARG A CB 1 ATOM 1797 C CG . ARG A 1 234 ? -26.259 -56.076 -103.818 1.00 45.94 ? 234 ARG A CG 1 ATOM 1798 C CD . ARG A 1 234 ? -27.203 -56.272 -102.637 1.00 48.46 ? 234 ARG A CD 1 ATOM 1799 N NE . ARG A 1 234 ? -28.079 -55.122 -102.424 0.70 49.33 ? 234 ARG A NE 1 ATOM 1800 C CZ . ARG A 1 234 ? -28.062 -54.349 -101.342 0.70 50.28 ? 234 ARG A CZ 1 ATOM 1801 N NH1 . ARG A 1 234 ? -27.217 -54.593 -100.344 0.70 50.52 ? 234 ARG A NH1 1 ATOM 1802 N NH2 . ARG A 1 234 ? -28.902 -53.330 -101.253 0.70 50.84 ? 234 ARG A NH2 1 ATOM 1803 N N . GLY A 1 235 ? -21.930 -56.018 -104.374 1.00 43.53 ? 235 GLY A N 1 ATOM 1804 C CA . GLY A 1 235 ? -20.645 -55.870 -103.693 1.00 43.73 ? 235 GLY A CA 1 ATOM 1805 C C . GLY A 1 235 ? -20.867 -55.274 -102.318 1.00 44.51 ? 235 GLY A C 1 ATOM 1806 O O . GLY A 1 235 ? -22.009 -55.077 -101.902 1.00 44.92 ? 235 GLY A O 1 ATOM 1807 N N . ASP A 1 236 ? -19.778 -54.990 -101.609 1.00 45.05 ? 236 ASP A N 1 ATOM 1808 C CA . ASP A 1 236 ? -19.849 -54.335 -100.303 1.00 45.86 ? 236 ASP A CA 1 ATOM 1809 C C . ASP A 1 236 ? -20.123 -52.839 -100.455 1.00 45.36 ? 236 ASP A C 1 ATOM 1810 O O . ASP A 1 236 ? -19.761 -52.239 -101.466 1.00 44.50 ? 236 ASP A O 1 ATOM 1811 C CB . ASP A 1 236 ? -18.542 -54.538 -99.531 1.00 47.04 ? 236 ASP A CB 1 ATOM 1812 C CG . ASP A 1 236 ? -18.111 -55.995 -99.470 0.70 48.01 ? 236 ASP A CG 1 ATOM 1813 O OD1 . ASP A 1 236 ? -18.928 -56.844 -99.052 0.70 49.02 ? 236 ASP A OD1 1 ATOM 1814 O OD2 . ASP A 1 236 ? -16.949 -56.288 -99.833 0.70 48.54 ? 236 ASP A OD2 1 ATOM 1815 N N . PHE A 1 237 ? -20.770 -52.248 -99.451 1.00 46.07 ? 237 PHE A N 1 ATOM 1816 C CA . PHE A 1 237 ? -20.912 -50.793 -99.366 1.00 46.11 ? 237 PHE A CA 1 ATOM 1817 C C . PHE A 1 237 ? -19.549 -50.167 -99.061 1.00 46.47 ? 237 PHE A C 1 ATOM 1818 O O . PHE A 1 237 ? -18.871 -50.571 -98.115 1.00 47.35 ? 237 PHE A O 1 ATOM 1819 C CB . PHE A 1 237 ? -21.916 -50.398 -98.274 1.00 47.37 ? 237 PHE A CB 1 ATOM 1820 C CG . PHE A 1 237 ? -23.344 -50.766 -98.584 1.00 47.25 ? 237 PHE A CG 1 ATOM 1821 C CD1 . PHE A 1 237 ? -24.160 -49.900 -99.304 1.00 47.12 ? 237 PHE A CD1 1 ATOM 1822 C CD2 . PHE A 1 237 ? -23.883 -51.967 -98.128 1.00 47.94 ? 237 PHE A CD2 1 ATOM 1823 C CE1 . PHE A 1 237 ? -25.485 -50.231 -99.583 1.00 47.27 ? 237 PHE A CE1 1 ATOM 1824 C CE2 . PHE A 1 237 ? -25.205 -52.308 -98.398 1.00 48.05 ? 237 PHE A CE2 1 ATOM 1825 C CZ . PHE A 1 237 ? -26.008 -51.439 -99.130 1.00 47.75 ? 237 PHE A CZ 1 ATOM 1826 N N . LEU A 1 238 ? -19.156 -49.190 -99.872 1.00 45.76 ? 238 LEU A N 1 ATOM 1827 C CA . LEU A 1 238 ? -17.873 -48.513 -99.713 1.00 46.28 ? 238 LEU A CA 1 ATOM 1828 C C . LEU A 1 238 ? -18.099 -47.022 -99.479 1.00 47.04 ? 238 LEU A C 1 ATOM 1829 O O . LEU A 1 238 ? -18.901 -46.404 -100.178 1.00 46.65 ? 238 LEU A O 1 ATOM 1830 C CB . LEU A 1 238 ? -16.991 -48.730 -100.946 1.00 45.49 ? 238 LEU A CB 1 ATOM 1831 C CG . LEU A 1 238 ? -16.761 -50.166 -101.436 1.00 44.72 ? 238 LEU A CG 1 ATOM 1832 C CD1 . LEU A 1 238 ? -15.973 -50.169 -102.734 1.00 44.07 ? 238 LEU A CD1 1 ATOM 1833 C CD2 . LEU A 1 238 ? -16.060 -51.011 -100.383 1.00 45.81 ? 238 LEU A CD2 1 ATOM 1834 N N . PRO A 1 239 ? -17.391 -46.436 -98.496 1.00 48.38 ? 239 PRO A N 1 ATOM 1835 C CA . PRO A 1 239 ? -17.672 -45.054 -98.118 1.00 49.40 ? 239 PRO A CA 1 ATOM 1836 C C . PRO A 1 239 ? -17.090 -44.017 -99.074 1.00 49.39 ? 239 PRO A C 1 ATOM 1837 O O . PRO A 1 239 ? -16.054 -44.247 -99.699 1.00 49.10 ? 239 PRO A O 1 ATOM 1838 C CB . PRO A 1 239 ? -17.007 -44.931 -96.748 1.00 51.13 ? 239 PRO A CB 1 ATOM 1839 C CG . PRO A 1 239 ? -15.869 -45.878 -96.803 1.00 50.99 ? 239 PRO A CG 1 ATOM 1840 C CD . PRO A 1 239 ? -16.300 -47.016 -97.688 1.00 49.28 ? 239 PRO A CD 1 ATOM 1841 N N . ASN A 1 240 ? -17.779 -42.888 -99.184 1.00 49.99 ? 240 ASN A N 1 ATOM 1842 C CA . ASN A 1 240 ? -17.224 -41.695 -99.801 1.00 50.78 ? 240 ASN A CA 1 ATOM 1843 C C . ASN A 1 240 ? -16.815 -40.706 -98.709 1.00 53.04 ? 240 ASN A C 1 ATOM 1844 O O . ASN A 1 240 ? -17.300 -40.785 -97.577 1.00 53.80 ? 240 ASN A O 1 ATOM 1845 C CB . ASN A 1 240 ? -18.240 -41.058 -100.749 1.00 50.39 ? 240 ASN A CB 1 ATOM 1846 C CG . ASN A 1 240 ? -18.556 -41.933 -101.947 1.00 48.50 ? 240 ASN A CG 1 ATOM 1847 O OD1 . ASN A 1 240 ? -17.655 -42.427 -102.623 1.00 48.02 ? 240 ASN A OD1 1 ATOM 1848 N ND2 . ASN A 1 240 ? -19.841 -42.110 -102.229 1.00 47.83 ? 240 ASN A ND2 1 ATOM 1849 N N . ALA A 1 241 ? -15.929 -39.776 -99.055 1.00 54.30 ? 241 ALA A N 1 ATOM 1850 C CA . ALA A 1 241 ? -15.388 -38.815 -98.091 1.00 56.76 ? 241 ALA A CA 1 ATOM 1851 C C . ALA A 1 241 ? -16.429 -37.834 -97.550 1.00 58.19 ? 241 ALA A C 1 ATOM 1852 O O . ALA A 1 241 ? -16.257 -37.283 -96.458 1.00 60.21 ? 241 ALA A O 1 ATOM 1853 C CB . ALA A 1 241 ? -14.214 -38.065 -98.696 1.00 57.87 ? 241 ALA A CB 1 ATOM 1854 N N . ASP A 1 242 ? -17.501 -37.621 -98.311 1.00 57.43 ? 242 ASP A N 1 ATOM 1855 C CA . ASP A 1 242 ? -18.569 -36.696 -97.914 1.00 58.97 ? 242 ASP A CA 1 ATOM 1856 C C . ASP A 1 242 ? -19.710 -37.394 -97.167 1.00 58.55 ? 242 ASP A C 1 ATOM 1857 O O . ASP A 1 242 ? -20.803 -36.839 -97.032 1.00 59.40 ? 242 ASP A O 1 ATOM 1858 C CB . ASP A 1 242 ? -19.104 -35.930 -99.134 1.00 58.92 ? 242 ASP A CB 1 ATOM 1859 C CG . ASP A 1 242 ? -19.801 -36.832 -100.144 1.00 56.69 ? 242 ASP A CG 1 ATOM 1860 O OD1 . ASP A 1 242 ? -20.677 -36.327 -100.876 1.00 56.72 ? 242 ASP A OD1 1 ATOM 1861 O OD2 . ASP A 1 242 ? -19.479 -38.038 -100.212 1.00 55.22 ? 242 ASP A OD2 1 ATOM 1862 N N . GLU A 1 243 ? -19.438 -38.612 -96.694 1.00 57.55 ? 243 GLU A N 1 ATOM 1863 C CA . GLU A 1 243 ? -20.373 -39.422 -95.895 1.00 57.30 ? 243 GLU A CA 1 ATOM 1864 C C . GLU A 1 243 ? -21.517 -40.044 -96.704 1.00 55.63 ? 243 GLU A C 1 ATOM 1865 O O . GLU A 1 243 ? -22.536 -40.452 -96.139 1.00 55.81 ? 243 GLU A O 1 ATOM 1866 C CB . GLU A 1 243 ? -20.916 -38.634 -94.692 1.00 59.80 ? 243 GLU A CB 1 ATOM 1867 C CG . GLU A 1 243 ? -19.845 -38.106 -93.743 0.70 61.65 ? 243 GLU A CG 1 ATOM 1868 C CD . GLU A 1 243 ? -20.413 -37.243 -92.630 0.70 63.99 ? 243 GLU A CD 1 ATOM 1869 O OE1 . GLU A 1 243 ? -21.373 -36.483 -92.879 0.70 64.19 ? 243 GLU A OE1 1 ATOM 1870 O OE2 . GLU A 1 243 ? -19.886 -37.321 -91.502 0.70 65.77 ? 243 GLU A OE2 1 ATOM 1871 N N . THR A 1 244 ? -21.341 -40.120 -98.021 1.00 54.24 ? 244 THR A N 1 ATOM 1872 C CA . THR A 1 244 ? -22.271 -40.846 -98.885 1.00 52.78 ? 244 THR A CA 1 ATOM 1873 C C . THR A 1 244 ? -21.726 -42.240 -99.188 1.00 51.15 ? 244 THR A C 1 ATOM 1874 O O . THR A 1 244 ? -20.621 -42.587 -98.768 1.00 51.33 ? 244 THR A O 1 ATOM 1875 C CB . THR A 1 244 ? -22.557 -40.093 -100.200 1.00 52.60 ? 244 THR A CB 1 ATOM 1876 O OG1 . THR A 1 244 ? -21.322 -39.700 -100.810 1.00 52.85 ? 244 THR A OG1 1 ATOM 1877 C CG2 . THR A 1 244 ? -23.415 -38.859 -99.942 1.00 54.34 ? 244 THR A CG2 1 ATOM 1878 N N . TRP A 1 245 ? -22.496 -43.038 -99.922 1.00 50.00 ? 245 TRP A N 1 ATOM 1879 C CA . TRP A 1 245 ? -22.143 -44.440 -100.122 1.00 48.75 ? 245 TRP A CA 1 ATOM 1880 C C . TRP A 1 245 ? -21.930 -44.853 -101.573 1.00 47.35 ? 245 TRP A C 1 ATOM 1881 O O . TRP A 1 245 ? -22.507 -44.276 -102.495 1.00 47.23 ? 245 TRP A O 1 ATOM 1882 C CB . TRP A 1 245 ? -23.166 -45.347 -99.436 1.00 48.78 ? 245 TRP A CB 1 ATOM 1883 C CG . TRP A 1 245 ? -23.123 -45.206 -97.957 1.00 50.50 ? 245 TRP A CG 1 ATOM 1884 C CD1 . TRP A 1 245 ? -23.990 -44.503 -97.179 1.00 52.26 ? 245 TRP A CD1 1 ATOM 1885 C CD2 . TRP A 1 245 ? -22.139 -45.753 -97.072 1.00 51.35 ? 245 TRP A CD2 1 ATOM 1886 N NE1 . TRP A 1 245 ? -23.619 -44.586 -95.860 1.00 54.16 ? 245 TRP A NE1 1 ATOM 1887 C CE2 . TRP A 1 245 ? -22.484 -45.348 -95.765 1.00 53.39 ? 245 TRP A CE2 1 ATOM 1888 C CE3 . TRP A 1 245 ? -21.003 -46.553 -97.255 1.00 50.84 ? 245 TRP A CE3 1 ATOM 1889 C CZ2 . TRP A 1 245 ? -21.734 -45.715 -94.642 1.00 54.58 ? 245 TRP A CZ2 1 ATOM 1890 C CZ3 . TRP A 1 245 ? -20.256 -46.919 -96.138 1.00 51.96 ? 245 TRP A CZ3 1 ATOM 1891 C CH2 . TRP A 1 245 ? -20.627 -46.498 -94.849 1.00 53.87 ? 245 TRP A CH2 1 ATOM 1892 N N . TYR A 1 246 ? -21.076 -45.855 -101.749 1.00 46.63 ? 246 TYR A N 1 ATOM 1893 C CA . TYR A 1 246 ? -20.780 -46.416 -103.054 1.00 45.76 ? 246 TYR A CA 1 ATOM 1894 C C . TYR A 1 246 ? -21.021 -47.919 -103.033 1.00 44.97 ? 246 TYR A C 1 ATOM 1895 O O . TYR A 1 246 ? -20.726 -48.595 -102.042 1.00 45.35 ? 246 TYR A O 1 ATOM 1896 C CB . TYR A 1 246 ? -19.335 -46.111 -103.452 1.00 45.93 ? 246 TYR A CB 1 ATOM 1897 C CG . TYR A 1 246 ? -18.893 -46.771 -104.737 1.00 45.57 ? 246 TYR A CG 1 ATOM 1898 C CD1 . TYR A 1 246 ? -19.211 -46.215 -105.971 1.00 46.29 ? 246 TYR A CD1 1 ATOM 1899 C CD2 . TYR A 1 246 ? -18.153 -47.949 -104.719 1.00 45.56 ? 246 TYR A CD2 1 ATOM 1900 C CE1 . TYR A 1 246 ? -18.804 -46.814 -107.158 1.00 45.99 ? 246 TYR A CE1 1 ATOM 1901 C CE2 . TYR A 1 246 ? -17.744 -48.557 -105.897 1.00 45.57 ? 246 TYR A CE2 1 ATOM 1902 C CZ . TYR A 1 246 ? -18.073 -47.983 -107.112 1.00 45.72 ? 246 TYR A CZ 1 ATOM 1903 O OH . TYR A 1 246 ? -17.668 -48.578 -108.284 1.00 46.50 ? 246 TYR A OH 1 ATOM 1904 N N . LEU A 1 247 ? -21.558 -48.430 -104.135 1.00 44.14 ? 247 LEU A N 1 ATOM 1905 C CA . LEU A 1 247 ? -21.858 -49.845 -104.275 1.00 43.60 ? 247 LEU A CA 1 ATOM 1906 C C . LEU A 1 247 ? -21.859 -50.211 -105.752 1.00 42.93 ? 247 LEU A C 1 ATOM 1907 O O . LEU A 1 247 ? -22.297 -49.422 -106.597 1.00 43.00 ? 247 LEU A O 1 ATOM 1908 C CB . LEU A 1 247 ? -23.230 -50.156 -103.671 1.00 44.04 ? 247 LEU A CB 1 ATOM 1909 C CG . LEU A 1 247 ? -23.700 -51.612 -103.639 1.00 44.04 ? 247 LEU A CG 1 ATOM 1910 C CD1 . LEU A 1 247 ? -23.432 -52.222 -102.284 1.00 44.77 ? 247 LEU A CD1 1 ATOM 1911 C CD2 . LEU A 1 247 ? -25.180 -51.702 -103.967 1.00 44.84 ? 247 LEU A CD2 1 ATOM 1912 N N . GLN A 1 248 ? -21.362 -51.402 -106.068 1.00 42.42 ? 248 GLN A N 1 ATOM 1913 C CA . GLN A 1 248 ? -21.479 -51.911 -107.423 1.00 41.94 ? 248 GLN A CA 1 ATOM 1914 C C . GLN A 1 248 ? -22.186 -53.254 -107.469 1.00 41.89 ? 248 GLN A C 1 ATOM 1915 O O . GLN A 1 248 ? -22.007 -54.095 -106.582 1.00 42.00 ? 248 GLN A O 1 ATOM 1916 C CB . GLN A 1 248 ? -20.124 -51.956 -108.134 1.00 41.86 ? 248 GLN A CB 1 ATOM 1917 C CG . GLN A 1 248 ? -19.092 -52.890 -107.535 1.00 41.96 ? 248 GLN A CG 1 ATOM 1918 C CD . GLN A 1 248 ? -17.831 -52.972 -108.372 1.00 42.10 ? 248 GLN A CD 1 ATOM 1919 O OE1 . GLN A 1 248 ? -17.333 -54.062 -108.651 1.00 42.47 ? 248 GLN A OE1 1 ATOM 1920 N NE2 . GLN A 1 248 ? -17.309 -51.819 -108.782 1.00 41.92 ? 248 GLN A NE2 1 ATOM 1921 N N . ALA A 1 249 ? -23.008 -53.433 -108.501 1.00 41.85 ? 249 ALA A N 1 ATOM 1922 C CA . ALA A 1 249 ? -23.673 -54.703 -108.754 1.00 41.99 ? 249 ALA A CA 1 ATOM 1923 C C . ALA A 1 249 ? -23.139 -55.305 -110.051 1.00 41.99 ? 249 ALA A C 1 ATOM 1924 O O . ALA A 1 249 ? -23.312 -54.735 -111.129 1.00 42.10 ? 249 ALA A O 1 ATOM 1925 C CB . ALA A 1 249 ? -25.176 -54.514 -108.816 1.00 42.30 ? 249 ALA A CB 1 ATOM 1926 N N . THR A 1 250 ? -22.470 -56.448 -109.933 1.00 42.21 ? 250 THR A N 1 ATOM 1927 C CA . THR A 1 250 ? -21.851 -57.106 -111.084 1.00 42.50 ? 250 THR A CA 1 ATOM 1928 C C . THR A 1 250 ? -22.725 -58.223 -111.643 1.00 42.98 ? 250 THR A C 1 ATOM 1929 O O . THR A 1 250 ? -23.533 -58.810 -110.924 1.00 43.39 ? 250 THR A O 1 ATOM 1930 C CB . THR A 1 250 ? -20.438 -57.664 -110.750 1.00 42.67 ? 250 THR A CB 1 ATOM 1931 O OG1 . THR A 1 250 ? -20.514 -58.552 -109.628 1.00 43.07 ? 250 THR A OG1 1 ATOM 1932 C CG2 . THR A 1 250 ? -19.462 -56.530 -110.430 1.00 42.42 ? 250 THR A CG2 1 ATOM 1933 N N . LEU A 1 251 ? -22.561 -58.501 -112.933 1.00 43.38 ? 251 LEU A N 1 ATOM 1934 C CA . LEU A 1 251 ? -23.263 -59.596 -113.597 1.00 44.08 ? 251 LEU A CA 1 ATOM 1935 C C . LEU A 1 251 ? -22.359 -60.248 -114.638 1.00 44.75 ? 251 LEU A C 1 ATOM 1936 O O . LEU A 1 251 ? -21.763 -59.566 -115.474 1.00 44.74 ? 251 LEU A O 1 ATOM 1937 C CB . LEU A 1 251 ? -24.562 -59.105 -114.254 1.00 44.40 ? 251 LEU A CB 1 ATOM 1938 C CG . LEU A 1 251 ? -25.409 -60.131 -115.024 1.00 45.21 ? 251 LEU A CG 1 ATOM 1939 C CD1 . LEU A 1 251 ? -26.233 -61.001 -114.080 1.00 45.13 ? 251 LEU A CD1 1 ATOM 1940 C CD2 . LEU A 1 251 ? -26.309 -59.438 -116.028 1.00 45.22 ? 251 LEU A CD2 1 ATOM 1941 N N . ASP A 1 252 ? -22.265 -61.573 -114.573 1.00 45.58 ? 252 ASP A N 1 ATOM 1942 C CA . ASP A 1 252 ? -21.456 -62.337 -115.508 1.00 46.59 ? 252 ASP A CA 1 ATOM 1943 C C . ASP A 1 252 ? -22.300 -62.759 -116.703 1.00 47.73 ? 252 ASP A C 1 ATOM 1944 O O . ASP A 1 252 ? -23.375 -63.342 -116.542 1.00 48.22 ? 252 ASP A O 1 ATOM 1945 C CB . ASP A 1 252 ? -20.842 -63.558 -114.815 1.00 47.10 ? 252 ASP A CB 1 ATOM 1946 C CG . ASP A 1 252 ? -19.912 -64.339 -115.725 1.00 48.29 ? 252 ASP A CG 1 ATOM 1947 O OD1 . ASP A 1 252 ? -20.407 -65.156 -116.537 1.00 49.08 ? 252 ASP A OD1 1 ATOM 1948 O OD2 . ASP A 1 252 ? -18.683 -64.131 -115.623 1.00 48.29 ? 252 ASP A OD2 1 ATOM 1949 N N . VAL A 1 253 ? -21.802 -62.458 -117.900 1.00 48.47 ? 253 VAL A N 1 ATOM 1950 C CA . VAL A 1 253 ? -22.502 -62.780 -119.144 1.00 49.96 ? 253 VAL A CA 1 ATOM 1951 C C . VAL A 1 253 ? -21.557 -63.376 -120.182 1.00 51.49 ? 253 VAL A C 1 ATOM 1952 O O . VAL A 1 253 ? -20.355 -63.113 -120.160 1.00 51.37 ? 253 VAL A O 1 ATOM 1953 C CB . VAL A 1 253 ? -23.193 -61.539 -119.762 1.00 49.68 ? 253 VAL A CB 1 ATOM 1954 C CG1 . VAL A 1 253 ? -24.424 -61.149 -118.962 1.00 49.00 ? 253 VAL A CG1 1 ATOM 1955 C CG2 . VAL A 1 253 ? -22.223 -60.376 -119.873 1.00 49.09 ? 253 VAL A CG2 1 ATOM 1956 N N . GLU A 1 254 ? -22.109 -64.184 -121.084 1.00 53.40 ? 254 GLU A N 1 ATOM 1957 C CA . GLU A 1 254 ? -21.353 -64.673 -122.232 1.00 55.33 ? 254 GLU A CA 1 ATOM 1958 C C . GLU A 1 254 ? -21.342 -63.595 -123.304 1.00 55.87 ? 254 GLU A C 1 ATOM 1959 O O . GLU A 1 254 ? -22.349 -62.910 -123.509 1.00 55.82 ? 254 GLU A O 1 ATOM 1960 C CB . GLU A 1 254 ? -21.945 -65.976 -122.776 1.00 57.05 ? 254 GLU A CB 1 ATOM 1961 C CG . GLU A 1 254 ? -21.919 -67.125 -121.770 1.00 57.93 ? 254 GLU A CG 1 ATOM 1962 C CD . GLU A 1 254 ? -21.753 -68.496 -122.414 1.00 61.12 ? 254 GLU A CD 1 ATOM 1963 O OE1 . GLU A 1 254 ? -22.220 -69.489 -121.813 1.00 61.64 ? 254 GLU A OE1 1 ATOM 1964 O OE2 . GLU A 1 254 ? -21.151 -68.586 -123.509 1.00 62.77 ? 254 GLU A OE2 1 ATOM 1965 N N . ALA A 1 255 ? -20.197 -63.436 -123.967 1.00 56.78 ? 255 ALA A N 1 ATOM 1966 C CA . ALA A 1 255 ? -20.039 -62.431 -125.018 1.00 57.71 ? 255 ALA A CA 1 ATOM 1967 C C . ALA A 1 255 ? -21.180 -62.522 -126.034 1.00 59.27 ? 255 ALA A C 1 ATOM 1968 O O . ALA A 1 255 ? -21.398 -63.571 -126.647 1.00 60.80 ? 255 ALA A O 1 ATOM 1969 C CB . ALA A 1 255 ? -18.684 -62.579 -125.703 1.00 58.90 ? 255 ALA A CB 1 ATOM 1970 N N . GLY A 1 256 ? -21.921 -61.424 -126.174 1.00 59.06 ? 256 GLY A N 1 ATOM 1971 C CA . GLY A 1 256 ? -23.071 -61.369 -127.077 1.00 60.62 ? 256 GLY A CA 1 ATOM 1972 C C . GLY A 1 256 ? -24.417 -61.277 -126.379 1.00 59.81 ? 256 GLY A C 1 ATOM 1973 O O . GLY A 1 256 ? -25.416 -60.905 -126.997 1.00 61.12 ? 256 GLY A O 1 ATOM 1974 N N . GLU A 1 257 ? -24.447 -61.613 -125.092 1.00 57.97 ? 257 GLU A N 1 ATOM 1975 C CA . GLU A 1 257 ? -25.689 -61.589 -124.318 1.00 57.16 ? 257 GLU A CA 1 ATOM 1976 C C . GLU A 1 257 ? -25.853 -60.305 -123.498 1.00 55.39 ? 257 GLU A C 1 ATOM 1977 O O . GLU A 1 257 ? -26.699 -60.237 -122.606 1.00 54.63 ? 257 GLU A O 1 ATOM 1978 C CB . GLU A 1 257 ? -25.780 -62.824 -123.412 1.00 56.77 ? 257 GLU A CB 1 ATOM 1979 N N . GLU A 1 258 ? -25.048 -59.292 -123.812 1.00 54.89 ? 258 GLU A N 1 ATOM 1980 C CA . GLU A 1 258 ? -25.097 -58.007 -123.111 1.00 53.47 ? 258 GLU A CA 1 ATOM 1981 C C . GLU A 1 258 ? -26.342 -57.194 -123.475 1.00 54.09 ? 258 GLU A C 1 ATOM 1982 O O . GLU A 1 258 ? -26.977 -56.598 -122.605 1.00 53.17 ? 258 GLU A O 1 ATOM 1983 C CB . GLU A 1 258 ? -23.836 -57.182 -123.395 1.00 53.37 ? 258 GLU A CB 1 ATOM 1984 C CG . GLU A 1 258 ? -22.565 -57.702 -122.721 1.00 52.87 ? 258 GLU A CG 1 ATOM 1985 C CD . GLU A 1 258 ? -21.590 -58.385 -123.677 1.00 54.61 ? 258 GLU A CD 1 ATOM 1986 O OE1 . GLU A 1 258 ? -22.034 -59.014 -124.666 1.00 56.34 ? 258 GLU A OE1 1 ATOM 1987 O OE2 . GLU A 1 258 ? -20.367 -58.291 -123.426 1.00 54.17 ? 258 GLU A OE2 1 ATOM 1988 N N . ALA A 1 259 ? -26.678 -57.182 -124.764 1.00 55.75 ? 259 ALA A N 1 ATOM 1989 C CA . ALA A 1 259 ? -27.805 -56.410 -125.288 1.00 56.75 ? 259 ALA A CA 1 ATOM 1990 C C . ALA A 1 259 ? -29.134 -56.834 -124.669 1.00 56.56 ? 259 ALA A C 1 ATOM 1991 O O . ALA A 1 259 ? -29.386 -58.025 -124.472 1.00 56.64 ? 259 ALA A O 1 ATOM 1992 C CB . ALA A 1 259 ? -27.863 -56.529 -126.801 1.00 59.09 ? 259 ALA A CB 1 ATOM 1993 N N . GLY A 1 260 ? -29.973 -55.849 -124.360 1.00 56.46 ? 260 GLY A N 1 ATOM 1994 C CA . GLY A 1 260 ? -31.269 -56.095 -123.735 1.00 56.33 ? 260 GLY A CA 1 ATOM 1995 C C . GLY A 1 260 ? -31.242 -55.932 -122.226 1.00 54.22 ? 260 GLY A C 1 ATOM 1996 O O . GLY A 1 260 ? -32.287 -55.742 -121.600 1.00 54.53 ? 260 GLY A O 1 ATOM 1997 N N . LEU A 1 261 ? -30.045 -56.005 -121.643 1.00 52.25 ? 261 LEU A N 1 ATOM 1998 C CA . LEU A 1 261 ? -29.870 -55.903 -120.196 1.00 50.22 ? 261 LEU A CA 1 ATOM 1999 C C . LEU A 1 261 ? -29.910 -54.465 -119.710 1.00 49.54 ? 261 LEU A C 1 ATOM 2000 O O . LEU A 1 261 ? -29.478 -53.554 -120.414 1.00 50.04 ? 261 LEU A O 1 ATOM 2001 C CB . LEU A 1 261 ? -28.557 -56.559 -119.763 1.00 48.93 ? 261 LEU A CB 1 ATOM 2002 C CG . LEU A 1 261 ? -28.573 -58.079 -119.609 1.00 49.14 ? 261 LEU A CG 1 ATOM 2003 C CD1 . LEU A 1 261 ? -27.165 -58.635 -119.644 1.00 48.22 ? 261 LEU A CD1 1 ATOM 2004 C CD2 . LEU A 1 261 ? -29.266 -58.470 -118.319 1.00 48.97 ? 261 LEU A CD2 1 ATOM 2005 N N . ALA A 1 262 ? -30.430 -54.274 -118.501 1.00 48.56 ? 262 ALA A N 1 ATOM 2006 C CA . ALA A 1 262 ? -30.502 -52.954 -117.883 1.00 48.13 ? 262 ALA A CA 1 ATOM 2007 C C . ALA A 1 262 ? -30.157 -53.018 -116.399 1.00 46.71 ? 262 ALA A C 1 ATOM 2008 O O . ALA A 1 262 ? -30.468 -54.003 -115.727 1.00 46.45 ? 262 ALA A O 1 ATOM 2009 C CB . ALA A 1 262 ? -31.883 -52.357 -118.076 1.00 49.46 ? 262 ALA A CB 1 ATOM 2010 N N . CYS A 1 263 ? -29.508 -51.973 -115.891 1.00 46.01 ? 263 CYS A N 1 ATOM 2011 C CA . CYS A 1 263 ? -29.276 -51.859 -114.453 1.00 44.94 ? 263 CYS A CA 1 ATOM 2012 C C . CYS A 1 263 ? -30.321 -50.943 -113.829 1.00 45.63 ? 263 CYS A C 1 ATOM 2013 O O . CYS A 1 263 ? -30.461 -49.784 -114.227 1.00 46.31 ? 263 CYS A O 1 ATOM 2014 C CB . CYS A 1 263 ? -27.865 -51.352 -114.140 1.00 44.00 ? 263 CYS A CB 1 ATOM 2015 S SG . CYS A 1 263 ? -27.556 -51.259 -112.365 1.00 43.46 ? 263 CYS A SG 1 ATOM 2016 N N . ARG A 1 264 ? -31.049 -51.480 -112.853 1.00 45.57 ? 264 ARG A N 1 ATOM 2017 C CA . ARG A 1 264 ? -32.132 -50.765 -112.189 1.00 46.49 ? 264 ARG A CA 1 ATOM 2018 C C . ARG A 1 264 ? -31.776 -50.464 -110.740 1.00 45.88 ? 264 ARG A C 1 ATOM 2019 O O . ARG A 1 264 ? -31.373 -51.356 -109.997 1.00 45.31 ? 264 ARG A O 1 ATOM 2020 C CB . ARG A 1 264 ? -33.415 -51.587 -112.254 1.00 47.57 ? 264 ARG A CB 1 ATOM 2021 C CG . ARG A 1 264 ? -34.652 -50.854 -111.783 1.00 49.53 ? 264 ARG A CG 1 ATOM 2022 C CD . ARG A 1 264 ? -35.886 -51.504 -112.363 1.00 52.13 ? 264 ARG A CD 1 ATOM 2023 N NE . ARG A 1 264 ? -36.971 -50.544 -112.544 1.00 54.61 ? 264 ARG A NE 1 ATOM 2024 C CZ . ARG A 1 264 ? -37.825 -50.566 -113.562 1.00 56.69 ? 264 ARG A CZ 1 ATOM 2025 N NH1 . ARG A 1 264 ? -37.719 -51.492 -114.510 1.00 56.68 ? 264 ARG A NH1 1 ATOM 2026 N NH2 . ARG A 1 264 ? -38.782 -49.651 -113.640 1.00 59.01 ? 264 ARG A NH2 1 ATOM 2027 N N . VAL A 1 265 ? -31.929 -49.201 -110.351 1.00 46.42 ? 265 VAL A N 1 ATOM 2028 C CA . VAL A 1 265 ? -31.595 -48.746 -109.004 1.00 46.06 ? 265 VAL A CA 1 ATOM 2029 C C . VAL A 1 265 ? -32.819 -48.125 -108.330 1.00 47.63 ? 265 VAL A C 1 ATOM 2030 O O . VAL A 1 265 ? -33.477 -47.251 -108.902 1.00 48.89 ? 265 VAL A O 1 ATOM 2031 C CB . VAL A 1 265 ? -30.427 -47.727 -109.015 1.00 45.60 ? 265 VAL A CB 1 ATOM 2032 C CG1 . VAL A 1 265 ? -30.116 -47.231 -107.607 1.00 45.55 ? 265 VAL A CG1 1 ATOM 2033 C CG2 . VAL A 1 265 ? -29.187 -48.337 -109.641 1.00 44.22 ? 265 VAL A CG2 1 ATOM 2034 N N . LYS A 1 266 ? -33.115 -48.593 -107.119 1.00 47.71 ? 266 LYS A N 1 ATOM 2035 C CA . LYS A 1 266 ? -34.191 -48.045 -106.301 1.00 49.17 ? 266 LYS A CA 1 ATOM 2036 C C . LYS A 1 266 ? -33.616 -47.425 -105.027 1.00 49.16 ? 266 LYS A C 1 ATOM 2037 O O . LYS A 1 266 ? -32.813 -48.051 -104.330 1.00 48.15 ? 266 LYS A O 1 ATOM 2038 C CB . LYS A 1 266 ? -35.205 -49.135 -105.939 1.00 49.93 ? 266 LYS A CB 1 ATOM 2039 C CG . LYS A 1 266 ? -36.000 -49.691 -107.108 1.00 50.59 ? 266 LYS A CG 1 ATOM 2040 C CD . LYS A 1 266 ? -36.946 -50.793 -106.639 1.00 52.14 ? 266 LYS A CD 1 ATOM 2041 C CE . LYS A 1 266 ? -37.507 -51.610 -107.801 1.00 52.57 ? 266 LYS A CE 1 ATOM 2042 N NZ . LYS A 1 266 ? -38.546 -50.883 -108.586 1.00 53.95 ? 266 LYS A NZ 1 ATOM 2043 N N . HIS A 1 267 ? -34.027 -46.192 -104.737 1.00 50.38 ? 267 HIS A N 1 ATOM 2044 C CA . HIS A 1 267 ? -33.581 -45.481 -103.538 1.00 50.80 ? 267 HIS A CA 1 ATOM 2045 C C . HIS A 1 267 ? -34.655 -44.531 -103.005 1.00 53.04 ? 267 HIS A C 1 ATOM 2046 O O . HIS A 1 267 ? -35.496 -44.040 -103.758 1.00 54.04 ? 267 HIS A O 1 ATOM 2047 C CB . HIS A 1 267 ? -32.269 -44.729 -103.806 1.00 49.86 ? 267 HIS A CB 1 ATOM 2048 C CG . HIS A 1 267 ? -31.540 -44.320 -102.562 1.00 49.61 ? 267 HIS A CG 1 ATOM 2049 N ND1 . HIS A 1 267 ? -31.296 -43.003 -102.240 1.00 50.13 ? 267 HIS A ND1 1 ATOM 2050 C CD2 . HIS A 1 267 ? -31.011 -45.056 -101.556 1.00 48.51 ? 267 HIS A CD2 1 ATOM 2051 C CE1 . HIS A 1 267 ? -30.641 -42.946 -101.095 1.00 49.98 ? 267 HIS A CE1 1 ATOM 2052 N NE2 . HIS A 1 267 ? -30.457 -44.178 -100.658 1.00 49.01 ? 267 HIS A NE2 1 ATOM 2053 N N . SER A 1 268 ? -34.611 -44.282 -101.698 1.00 54.11 ? 268 SER A N 1 ATOM 2054 C CA . SER A 1 268 ? -35.590 -43.438 -101.012 1.00 56.62 ? 268 SER A CA 1 ATOM 2055 C C . SER A 1 268 ? -35.559 -41.972 -101.453 1.00 57.88 ? 268 SER A C 1 ATOM 2056 O O . SER A 1 268 ? -36.534 -41.242 -101.263 1.00 60.06 ? 268 SER A O 1 ATOM 2057 C CB . SER A 1 268 ? -35.386 -43.525 -99.500 1.00 57.41 ? 268 SER A CB 1 ATOM 2058 O OG . SER A 1 268 ? -34.070 -43.140 -99.148 1.00 56.35 ? 268 SER A OG 1 ATOM 2059 N N . SER A 1 269 ? -34.440 -41.552 -102.038 1.00 56.84 ? 269 SER A N 1 ATOM 2060 C CA . SER A 1 269 ? -34.265 -40.177 -102.497 1.00 58.23 ? 269 SER A CA 1 ATOM 2061 C C . SER A 1 269 ? -34.841 -39.949 -103.893 1.00 58.78 ? 269 SER A C 1 ATOM 2062 O O . SER A 1 269 ? -34.947 -38.806 -104.347 1.00 60.27 ? 269 SER A O 1 ATOM 2063 C CB . SER A 1 269 ? -32.783 -39.800 -102.482 1.00 57.24 ? 269 SER A CB 1 ATOM 2064 O OG . SER A 1 269 ? -32.041 -40.618 -103.368 1.00 54.96 ? 269 SER A OG 1 ATOM 2065 N N . LEU A 1 270 ? -35.207 -41.037 -104.567 1.00 57.93 ? 270 LEU A N 1 ATOM 2066 C CA . LEU A 1 270 ? -35.701 -40.970 -105.941 1.00 58.48 ? 270 LEU A CA 1 ATOM 2067 C C . LEU A 1 270 ? -37.222 -40.824 -106.012 1.00 60.90 ? 270 LEU A C 1 ATOM 2068 O O . LEU A 1 270 ? -37.763 -40.349 -107.016 1.00 62.08 ? 270 LEU A O 1 ATOM 2069 C CB . LEU A 1 270 ? -35.219 -42.180 -106.749 1.00 56.30 ? 270 LEU A CB 1 ATOM 2070 C CG . LEU A 1 270 ? -33.700 -42.329 -106.914 1.00 54.36 ? 270 LEU A CG 1 ATOM 2071 C CD1 . LEU A 1 270 ? -33.355 -43.641 -107.605 1.00 52.65 ? 270 LEU A CD1 1 ATOM 2072 C CD2 . LEU A 1 270 ? -33.079 -41.146 -107.666 1.00 54.84 ? 270 LEU A CD2 1 ATOM 2073 N N . GLY A 1 271 ? -37.899 -41.238 -104.941 1.00 61.95 ? 271 GLY A N 1 ATOM 2074 C CA . GLY A 1 271 ? -39.350 -41.081 -104.810 1.00 64.61 ? 271 GLY A CA 1 ATOM 2075 C C . GLY A 1 271 ? -40.166 -41.893 -105.799 1.00 64.92 ? 271 GLY A C 1 ATOM 2076 O O . GLY A 1 271 ? -41.186 -41.422 -106.301 1.00 66.98 ? 271 GLY A O 1 ATOM 2077 N N . GLY A 1 272 ? -39.713 -43.113 -106.079 1.00 63.07 ? 272 GLY A N 1 ATOM 2078 C CA . GLY A 1 272 ? -40.409 -44.002 -107.005 1.00 63.43 ? 272 GLY A CA 1 ATOM 2079 C C . GLY A 1 272 ? -39.897 -43.947 -108.433 1.00 62.77 ? 272 GLY A C 1 ATOM 2080 O O . GLY A 1 272 ? -40.183 -44.846 -109.226 1.00 62.59 ? 272 GLY A O 1 ATOM 2081 N N . GLN A 1 273 ? -39.145 -42.895 -108.761 1.00 62.77 ? 273 GLN A N 1 ATOM 2082 C CA . GLN A 1 273 ? -38.585 -42.712 -110.106 1.00 62.33 ? 273 GLN A CA 1 ATOM 2083 C C . GLN A 1 273 ? -37.202 -43.352 -110.220 1.00 59.69 ? 273 GLN A C 1 ATOM 2084 O O . GLN A 1 273 ? -36.176 -42.695 -110.008 1.00 58.94 ? 273 GLN A O 1 ATOM 2085 C CB . GLN A 1 273 ? -38.533 -41.224 -110.481 1.00 64.10 ? 273 GLN A CB 1 ATOM 2086 C CG . GLN A 1 273 ? -39.901 -40.592 -110.765 1.00 67.33 ? 273 GLN A CG 1 ATOM 2087 C CD . GLN A 1 273 ? -39.822 -39.124 -111.181 1.00 69.52 ? 273 GLN A CD 1 ATOM 2088 O OE1 . GLN A 1 273 ? -40.751 -38.594 -111.792 1.00 72.03 ? 273 GLN A OE1 1 ATOM 2089 N NE2 . GLN A 1 273 ? -38.715 -38.464 -110.849 1.00 68.68 ? 273 GLN A NE2 1 ATOM 2090 N N . ASP A 1 274 ? -37.190 -44.639 -110.564 1.00 58.48 ? 274 ASP A N 1 ATOM 2091 C CA . ASP A 1 274 ? -35.966 -45.445 -110.578 1.00 56.24 ? 274 ASP A CA 1 ATOM 2092 C C . ASP A 1 274 ? -34.985 -45.025 -111.663 1.00 55.57 ? 274 ASP A C 1 ATOM 2093 O O . ASP A 1 274 ? -35.389 -44.602 -112.750 1.00 56.86 ? 274 ASP A O 1 ATOM 2094 C CB . ASP A 1 274 ? -36.299 -46.928 -110.772 1.00 55.66 ? 274 ASP A CB 1 ATOM 2095 C CG . ASP A 1 274 ? -37.257 -47.465 -109.724 1.00 56.93 ? 274 ASP A CG 1 ATOM 2096 O OD1 . ASP A 1 274 ? -37.626 -46.722 -108.785 1.00 58.61 ? 274 ASP A OD1 1 ATOM 2097 O OD2 . ASP A 1 274 ? -37.641 -48.646 -109.847 1.00 57.16 ? 274 ASP A OD2 1 ATOM 2098 N N . ILE A 1 275 ? -33.696 -45.155 -111.359 1.00 53.75 ? 275 ILE A N 1 ATOM 2099 C CA . ILE A 1 275 ? -32.651 -44.982 -112.360 1.00 53.05 ? 275 ILE A CA 1 ATOM 2100 C C . ILE A 1 275 ? -32.518 -46.282 -113.149 1.00 51.99 ? 275 ILE A C 1 ATOM 2101 O O . ILE A 1 275 ? -32.222 -47.336 -112.581 1.00 50.70 ? 275 ILE A O 1 ATOM 2102 C CB . ILE A 1 275 ? -31.290 -44.596 -111.726 1.00 52.05 ? 275 ILE A CB 1 ATOM 2103 C CG1 . ILE A 1 275 ? -31.402 -43.254 -110.987 1.00 53.29 ? 275 ILE A CG1 1 ATOM 2104 C CG2 . ILE A 1 275 ? -30.192 -44.544 -112.798 1.00 51.66 ? 275 ILE A CG2 1 ATOM 2105 C CD1 . ILE A 1 275 ? -30.182 -42.883 -110.161 1.00 52.39 ? 275 ILE A CD1 1 ATOM 2106 N N . ILE A 1 276 ? -32.763 -46.202 -114.453 1.00 52.70 ? 276 ILE A N 1 ATOM 2107 C CA . ILE A 1 276 ? -32.625 -47.357 -115.335 1.00 51.94 ? 276 ILE A CA 1 ATOM 2108 C C . ILE A 1 276 ? -31.600 -47.058 -116.426 1.00 51.76 ? 276 ILE A C 1 ATOM 2109 O O . ILE A 1 276 ? -31.820 -46.194 -117.278 1.00 53.43 ? 276 ILE A O 1 ATOM 2110 C CB . ILE A 1 276 ? -33.972 -47.777 -115.970 1.00 53.39 ? 276 ILE A CB 1 ATOM 2111 C CG1 . ILE A 1 276 ? -35.079 -47.831 -114.913 1.00 54.22 ? 276 ILE A CG1 1 ATOM 2112 C CG2 . ILE A 1 276 ? -33.831 -49.132 -116.656 1.00 52.85 ? 276 ILE A CG2 1 ATOM 2113 C CD1 . ILE A 1 276 ? -36.488 -47.734 -115.469 1.00 56.79 ? 276 ILE A CD1 1 ATOM 2114 N N . LEU A 1 277 ? -30.477 -47.769 -116.379 1.00 50.01 ? 277 LEU A N 1 ATOM 2115 C CA . LEU A 1 277 ? -29.429 -47.631 -117.380 1.00 49.88 ? 277 LEU A CA 1 ATOM 2116 C C . LEU A 1 277 ? -29.410 -48.859 -118.269 1.00 49.73 ? 277 LEU A C 1 ATOM 2117 O O . LEU A 1 277 ? -29.231 -49.979 -117.788 1.00 48.77 ? 277 LEU A O 1 ATOM 2118 C CB . LEU A 1 277 ? -28.056 -47.452 -116.726 1.00 48.61 ? 277 LEU A CB 1 ATOM 2119 C CG . LEU A 1 277 ? -27.818 -46.334 -115.707 1.00 48.64 ? 277 LEU A CG 1 ATOM 2120 C CD1 . LEU A 1 277 ? -26.377 -46.388 -115.254 1.00 47.64 ? 277 LEU A CD1 1 ATOM 2121 C CD2 . LEU A 1 277 ? -28.146 -44.954 -116.270 1.00 50.83 ? 277 LEU A CD2 1 ATOM 2122 N N . TYR A 1 278 ? -29.595 -48.637 -119.564 1.00 51.08 ? 278 TYR A N 1 ATOM 2123 C CA . TYR A 1 278 ? -29.615 -49.704 -120.555 1.00 51.32 ? 278 TYR A CA 1 ATOM 2124 C C . TYR A 1 278 ? -28.246 -49.872 -121.197 1.00 50.97 ? 278 TYR A C 1 ATOM 2125 O O . TYR A 1 278 ? -27.607 -48.888 -121.578 1.00 51.57 ? 278 TYR A O 1 ATOM 2126 C CB . TYR A 1 278 ? -30.663 -49.400 -121.633 1.00 53.54 ? 278 TYR A CB 1 ATOM 2127 C CG . TYR A 1 278 ? -32.086 -49.462 -121.130 1.00 54.15 ? 278 TYR A CG 1 ATOM 2128 C CD1 . TYR A 1 278 ? -32.721 -48.326 -120.628 1.00 54.70 ? 278 TYR A CD1 1 ATOM 2129 C CD2 . TYR A 1 278 ? -32.799 -50.663 -121.152 1.00 54.25 ? 278 TYR A CD2 1 ATOM 2130 C CE1 . TYR A 1 278 ? -34.032 -48.383 -120.160 1.00 55.56 ? 278 TYR A CE1 1 ATOM 2131 C CE2 . TYR A 1 278 ? -34.108 -50.733 -120.687 1.00 55.05 ? 278 TYR A CE2 1 ATOM 2132 C CZ . TYR A 1 278 ? -34.717 -49.590 -120.192 1.00 55.87 ? 278 TYR A CZ 1 ATOM 2133 O OH . TYR A 1 278 ? -36.010 -49.660 -119.731 1.00 57.31 ? 278 TYR A OH 1 ATOM 2134 N N . TRP A 1 279 ? -27.801 -51.121 -121.311 1.00 50.25 ? 279 TRP A N 1 ATOM 2135 C CA . TRP A 1 279 ? -26.555 -51.435 -122.003 1.00 50.41 ? 279 TRP A CA 1 ATOM 2136 C C . TRP A 1 279 ? -26.710 -51.202 -123.503 1.00 52.53 ? 279 TRP A C 1 ATOM 2137 O O . TRP A 1 279 ? -27.690 -51.639 -124.108 1.00 53.78 ? 279 TRP A O 1 ATOM 2138 C CB . TRP A 1 279 ? -26.120 -52.880 -121.733 1.00 49.41 ? 279 TRP A CB 1 ATOM 2139 C CG . TRP A 1 279 ? -24.770 -53.209 -122.312 1.00 49.92 ? 279 TRP A CG 1 ATOM 2140 C CD1 . TRP A 1 279 ? -24.505 -53.655 -123.577 1.00 51.37 ? 279 TRP A CD1 1 ATOM 2141 C CD2 . TRP A 1 279 ? -23.501 -53.099 -121.654 1.00 49.26 ? 279 TRP A CD2 1 ATOM 2142 N NE1 . TRP A 1 279 ? -23.154 -53.833 -123.746 1.00 51.14 ? 279 TRP A NE1 1 ATOM 2143 C CE2 . TRP A 1 279 ? -22.513 -53.501 -122.583 1.00 49.96 ? 279 TRP A CE2 1 ATOM 2144 C CE3 . TRP A 1 279 ? -23.102 -52.703 -120.368 1.00 47.94 ? 279 TRP A CE3 1 ATOM 2145 C CZ2 . TRP A 1 279 ? -21.148 -53.520 -122.268 1.00 49.49 ? 279 TRP A CZ2 1 ATOM 2146 C CZ3 . TRP A 1 279 ? -21.742 -52.724 -120.055 1.00 47.49 ? 279 TRP A CZ3 1 ATOM 2147 C CH2 . TRP A 1 279 ? -20.784 -53.127 -121.004 1.00 48.09 ? 279 TRP A CH2 1 ATOM 2148 N N . GLY A 1 280 ? -25.745 -50.499 -124.088 1.00 53.30 ? 280 GLY A N 1 ATOM 2149 C CA . GLY A 1 280 ? -25.707 -50.270 -125.530 1.00 55.70 ? 280 GLY A CA 1 ATOM 2150 C C . GLY A 1 280 ? -26.567 -49.123 -126.029 1.00 57.73 ? 280 GLY A C 1 ATOM 2151 O O . GLY A 1 280 ? -26.699 -48.925 -127.240 1.00 59.85 ? 280 GLY A O 1 ATOM 2152 N N . SER A 1 281 ? -27.148 -48.368 -125.099 1.00 57.22 ? 281 SER A N 1 ATOM 2153 C CA . SER A 1 281 ? -27.967 -47.206 -125.435 1.00 59.34 ? 281 SER A CA 1 ATOM 2154 C C . SER A 1 281 ? -27.094 -46.028 -125.873 1.00 60.79 ? 281 SER A C 1 ATOM 2155 O O . SER A 1 281 ? -25.874 -46.059 -125.700 1.00 59.99 ? 281 SER A O 1 ATOM 2156 C CB . SER A 1 281 ? -28.840 -46.810 -124.241 1.00 58.35 ? 281 SER A CB 1 ATOM 2157 O OG . SER A 1 281 ? -28.054 -46.566 -123.089 1.00 56.48 ? 281 SER A OG 1 ATOM 2158 N N . LEU A 1 282 ? -27.721 -44.997 -126.440 1.00 63.27 ? 282 LEU A N 1 ATOM 2159 C CA . LEU A 1 282 ? -27.015 -43.777 -126.837 1.00 65.14 ? 282 LEU A CA 1 ATOM 2160 C C . LEU A 1 282 ? -26.277 -43.150 -125.658 1.00 63.63 ? 282 LEU A C 1 ATOM 2161 O O . LEU A 1 282 ? -25.134 -42.710 -125.795 1.00 63.99 ? 282 LEU A O 1 ATOM 2162 C CB . LEU A 1 282 ? -27.981 -42.757 -127.449 1.00 68.09 ? 282 LEU A CB 1 ATOM 2163 N N . HIS A 1 283 ? -26.942 -43.124 -124.504 1.00 62.34 ? 283 HIS A N 1 ATOM 2164 C CA . HIS A 1 283 ? -26.370 -42.591 -123.271 1.00 61.02 ? 283 HIS A CA 1 ATOM 2165 C C . HIS A 1 283 ? -25.127 -43.375 -122.849 1.00 59.05 ? 283 HIS A C 1 ATOM 2166 O O . HIS A 1 283 ? -24.106 -42.777 -122.500 1.00 58.95 ? 283 HIS A O 1 ATOM 2167 C CB . HIS A 1 283 ? -27.419 -42.599 -122.153 1.00 60.02 ? 283 HIS A CB 1 ATOM 2168 C CG . HIS A 1 283 ? -27.022 -41.817 -120.938 1.00 59.55 ? 283 HIS A CG 1 ATOM 2169 N ND1 . HIS A 1 283 ? -26.530 -42.413 -119.796 0.70 57.27 ? 283 HIS A ND1 1 ATOM 2170 C CD2 . HIS A 1 283 ? -27.049 -40.486 -120.686 0.70 61.09 ? 283 HIS A CD2 1 ATOM 2171 C CE1 . HIS A 1 283 ? -26.269 -41.484 -118.894 0.70 57.39 ? 283 HIS A CE1 1 ATOM 2172 N NE2 . HIS A 1 283 ? -26.575 -40.306 -119.409 0.70 59.79 ? 283 HIS A NE2 1 ATOM 2173 N N . HIS A 1 284 ? -25.221 -44.706 -122.903 1.00 57.77 ? 284 HIS A N 1 ATOM 2174 C CA . HIS A 1 284 ? -24.122 -45.597 -122.506 1.00 55.97 ? 284 HIS A CA 1 ATOM 2175 C C . HIS A 1 284 ? -22.889 -45.443 -123.401 1.00 57.12 ? 284 HIS A C 1 ATOM 2176 O O . HIS A 1 284 ? -21.761 -45.431 -122.904 1.00 56.45 ? 284 HIS A O 1 ATOM 2177 C CB . HIS A 1 284 ? -24.595 -47.058 -122.464 1.00 54.76 ? 284 HIS A CB 1 ATOM 2178 C CG . HIS A 1 284 ? -23.513 -48.049 -122.144 1.00 53.00 ? 284 HIS A CG 1 ATOM 2179 N ND1 . HIS A 1 284 ? -22.485 -47.781 -121.266 1.00 51.85 ? 284 HIS A ND1 1 ATOM 2180 C CD2 . HIS A 1 284 ? -23.318 -49.319 -122.569 1.00 52.37 ? 284 HIS A CD2 1 ATOM 2181 C CE1 . HIS A 1 284 ? -21.695 -48.836 -121.177 1.00 50.74 ? 284 HIS A CE1 1 ATOM 2182 N NE2 . HIS A 1 284 ? -22.180 -49.785 -121.956 1.00 50.99 ? 284 HIS A NE2 1 ATOM 2183 N N . ILE A 1 285 ? -23.115 -45.317 -124.708 1.00 59.03 ? 285 ILE A N 1 ATOM 2184 C CA . ILE A 1 285 ? -22.041 -45.092 -125.675 1.00 60.66 ? 285 ILE A CA 1 ATOM 2185 C C . ILE A 1 285 ? -21.291 -43.787 -125.374 1.00 61.66 ? 285 ILE A C 1 ATOM 2186 O O . ILE A 1 285 ? -20.061 -43.737 -125.467 1.00 61.84 ? 285 ILE A O 1 ATOM 2187 C CB . ILE A 1 285 ? -22.577 -45.090 -127.151 1.00 63.23 ? 285 ILE A CB 1 ATOM 2188 C CG1 . ILE A 1 285 ? -23.296 -46.409 -127.498 1.00 62.60 ? 285 ILE A CG1 1 ATOM 2189 C CG2 . ILE A 1 285 ? -21.464 -44.784 -128.160 1.00 64.93 ? 285 ILE A CG2 1 ATOM 2190 C CD1 . ILE A 1 285 ? -22.478 -47.685 -127.292 1.00 60.74 ? 285 ILE A CD1 1 ATOM 2191 N N . LEU A 1 286 ? -22.039 -42.747 -125.003 1.00 62.51 ? 286 LEU A N 1 ATOM 2192 C CA . LEU A 1 286 ? -21.470 -41.427 -124.724 1.00 63.87 ? 286 LEU A CA 1 ATOM 2193 C C . LEU A 1 286 ? -20.614 -41.400 -123.459 1.00 62.09 ? 286 LEU A C 1 ATOM 2194 O O . LEU A 1 286 ? -19.567 -40.751 -123.431 1.00 63.14 ? 286 LEU A O 1 ATOM 2195 C CB . LEU A 1 286 ? -22.571 -40.363 -124.630 1.00 65.35 ? 286 LEU A CB 1 ATOM 2196 C CG . LEU A 1 286 ? -23.198 -39.797 -125.910 0.90 68.61 ? 286 LEU A CG 1 ATOM 2197 C CD1 . LEU A 1 286 ? -24.408 -38.939 -125.561 0.90 69.77 ? 286 LEU A CD1 1 ATOM 2198 C CD2 . LEU A 1 286 ? -22.196 -38.991 -126.739 0.90 71.09 ? 286 LEU A CD2 1 ATOM 2199 N N . ASP A 1 287 ? -21.063 -42.099 -122.420 1.00 59.75 ? 287 ASP A N 1 ATOM 2200 C CA . ASP A 1 287 ? -20.347 -42.140 -121.148 1.00 58.10 ? 287 ASP A CA 1 ATOM 2201 C C . ASP A 1 287 ? -19.063 -42.963 -121.242 1.00 57.36 ? 287 ASP A C 1 ATOM 2202 O O . ASP A 1 287 ? -18.050 -42.606 -120.634 1.00 57.42 ? 287 ASP A O 1 ATOM 2203 C CB . ASP A 1 287 ? -21.248 -42.682 -120.033 1.00 56.17 ? 287 ASP A CB 1 ATOM 2204 N N . ALA A 1 288 ? -19.113 -44.053 -122.007 1.00 56.92 ? 288 ALA A N 1 ATOM 2205 C CA . ALA A 1 288 ? -17.963 -44.941 -122.195 1.00 56.37 ? 288 ALA A CA 1 ATOM 2206 C C . ALA A 1 288 ? -16.788 -44.274 -122.927 1.00 58.37 ? 288 ALA A C 1 ATOM 2207 O O . ALA A 1 288 ? -15.627 -44.490 -122.563 1.00 58.09 ? 288 ALA A O 1 ATOM 2208 C CB . ALA A 1 288 ? -18.388 -46.218 -122.914 1.00 55.90 ? 288 ALA A CB 1 ATOM 2209 N N . GLN A 1 289 ? -17.089 -43.471 -123.948 1.00 60.47 ? 289 GLN A N 1 ATOM 2210 C CA . GLN A 1 289 ? -16.047 -42.789 -124.722 1.00 62.97 ? 289 GLN A CA 1 ATOM 2211 C C . GLN A 1 289 ? -15.416 -41.620 -123.959 1.00 63.59 ? 289 GLN A C 1 ATOM 2212 O O . GLN A 1 289 ? -14.326 -41.156 -124.304 1.00 65.26 ? 289 GLN A O 1 ATOM 2213 C CB . GLN A 1 289 ? -16.556 -42.356 -126.110 1.00 65.57 ? 289 GLN A CB 1 ATOM 2214 C CG . GLN A 1 289 ? -17.750 -41.400 -126.114 0.70 66.62 ? 289 GLN A CG 1 ATOM 2215 C CD . GLN A 1 289 ? -18.389 -41.243 -127.490 0.70 69.22 ? 289 GLN A CD 1 ATOM 2216 O OE1 . GLN A 1 289 ? -18.347 -42.152 -128.323 0.70 69.43 ? 289 GLN A OE1 1 ATOM 2217 N NE2 . GLN A 1 289 ? -18.995 -40.085 -127.728 0.70 71.17 ? 289 GLN A NE2 1 ATOM 2218 N N . LYS A 1 290 ? -16.104 -41.160 -122.919 1.00 62.46 ? 290 LYS A N 1 ATOM 2219 C CA . LYS A 1 290 ? -15.573 -40.140 -122.019 1.00 62.93 ? 290 LYS A CA 1 ATOM 2220 C C . LYS A 1 290 ? -14.615 -40.734 -120.978 1.00 61.33 ? 290 LYS A C 1 ATOM 2221 O O . LYS A 1 290 ? -13.923 -39.996 -120.267 1.00 61.91 ? 290 LYS A O 1 ATOM 2222 C CB . LYS A 1 290 ? -16.714 -39.390 -121.328 1.00 62.71 ? 290 LYS A CB 1 ATOM 2223 C CG . LYS A 1 290 ? -17.478 -38.437 -122.236 1.00 65.23 ? 290 LYS A CG 1 ATOM 2224 C CD . LYS A 1 290 ? -18.625 -37.770 -121.487 1.00 65.47 ? 290 LYS A CD 1 ATOM 2225 C CE . LYS A 1 290 ? -19.422 -36.846 -122.398 1.00 68.62 ? 290 LYS A CE 1 ATOM 2226 N N . MET A 1 291 ? -14.568 -42.063 -120.896 1.00 59.49 ? 291 MET A N 1 ATOM 2227 C CA . MET A 1 291 ? -13.690 -42.739 -119.943 1.00 58.23 ? 291 MET A CA 1 ATOM 2228 C C . MET A 1 291 ? -12.762 -43.792 -120.566 1.00 58.35 ? 291 MET A C 1 ATOM 2229 O O . MET A 1 291 ? -12.388 -44.762 -119.903 1.00 57.16 ? 291 MET A O 1 ATOM 2230 C CB . MET A 1 291 ? -14.495 -43.331 -118.773 1.00 55.95 ? 291 MET A CB 1 ATOM 2231 C CG . MET A 1 291 ? -15.574 -44.337 -119.154 1.00 54.99 ? 291 MET A CG 1 ATOM 2232 S SD . MET A 1 291 ? -16.324 -45.140 -117.717 1.00 53.19 ? 291 MET A SD 1 ATOM 2233 C CE . MET A 1 291 ? -15.118 -46.417 -117.354 1.00 52.34 ? 291 MET A CE 1 ATOM 2234 N N . VAL A 1 292 ? -12.387 -43.597 -121.828 1.00 60.20 ? 292 VAL A N 1 ATOM 2235 C CA . VAL A 1 292 ? -11.415 -44.477 -122.487 1.00 60.73 ? 292 VAL A CA 1 ATOM 2236 C C . VAL A 1 292 ? -10.004 -44.220 -121.957 1.00 61.58 ? 292 VAL A C 1 ATOM 2237 O O . VAL A 1 292 ? -9.631 -43.072 -121.707 1.00 62.89 ? 292 VAL A O 1 ATOM 2238 C CB . VAL A 1 292 ? -11.435 -44.342 -124.040 1.00 62.98 ? 292 VAL A CB 1 ATOM 2239 C CG1 . VAL A 1 292 ? -12.659 -45.032 -124.624 1.00 62.20 ? 292 VAL A CG1 1 ATOM 2240 C CG2 . VAL A 1 292 ? -11.371 -42.879 -124.479 1.00 65.20 ? 292 VAL A CG2 1 ATOM 2241 N N . TRP A 1 293 ? -9.232 -45.291 -121.782 1.00 61.07 ? 293 TRP A N 1 ATOM 2242 C CA . TRP A 1 293 ? -7.866 -45.200 -121.249 1.00 62.04 ? 293 TRP A CA 1 ATOM 2243 C C . TRP A 1 293 ? -6.954 -46.314 -121.783 1.00 62.85 ? 293 TRP A C 1 ATOM 2244 O O . TRP A 1 293 ? -7.422 -47.235 -122.454 1.00 62.39 ? 293 TRP A O 1 ATOM 2245 C CB . TRP A 1 293 ? -7.884 -45.176 -119.710 1.00 60.30 ? 293 TRP A CB 1 ATOM 2246 C CG . TRP A 1 293 ? -8.394 -46.433 -119.062 1.00 57.64 ? 293 TRP A CG 1 ATOM 2247 C CD1 . TRP A 1 293 ? -9.600 -47.038 -119.276 1.00 55.95 ? 293 TRP A CD1 1 ATOM 2248 C CD2 . TRP A 1 293 ? -7.717 -47.227 -118.080 1.00 56.60 ? 293 TRP A CD2 1 ATOM 2249 N NE1 . TRP A 1 293 ? -9.710 -48.166 -118.502 1.00 54.32 ? 293 TRP A NE1 1 ATOM 2250 C CE2 . TRP A 1 293 ? -8.571 -48.305 -117.755 1.00 54.76 ? 293 TRP A CE2 1 ATOM 2251 C CE3 . TRP A 1 293 ? -6.469 -47.138 -117.448 1.00 57.37 ? 293 TRP A CE3 1 ATOM 2252 C CZ2 . TRP A 1 293 ? -8.218 -49.288 -116.822 1.00 53.56 ? 293 TRP A CZ2 1 ATOM 2253 C CZ3 . TRP A 1 293 ? -6.119 -48.114 -116.519 1.00 56.21 ? 293 TRP A CZ3 1 ATOM 2254 C CH2 . TRP A 1 293 ? -6.993 -49.175 -116.217 1.00 54.72 ? 293 TRP A CH2 1 ATOM 2255 N N . ASN A 1 294 ? -5.659 -46.223 -121.481 1.00 64.41 ? 294 ASN A N 1 ATOM 2256 C CA . ASN A 1 294 ? -4.657 -47.146 -122.029 1.00 65.94 ? 294 ASN A CA 1 ATOM 2257 C C . ASN A 1 294 ? -4.613 -48.543 -121.391 1.00 64.60 ? 294 ASN A C 1 ATOM 2258 O O . ASN A 1 294 ? -3.861 -49.409 -121.843 1.00 65.72 ? 294 ASN A O 1 ATOM 2259 C CB . ASN A 1 294 ? -3.261 -46.498 -122.017 1.00 68.37 ? 294 ASN A CB 1 ATOM 2260 C CG . ASN A 1 294 ? -2.703 -46.297 -120.610 1.00 67.60 ? 294 ASN A CG 1 ATOM 2261 O OD1 . ASN A 1 294 ? -3.328 -46.661 -119.611 1.00 65.05 ? 294 ASN A OD1 1 ATOM 2262 N ND2 . ASN A 1 294 ? -1.513 -45.716 -120.534 1.00 69.50 ? 294 ASN A ND2 1 ATOM 2263 N N . HIS A 1 295 ? -5.415 -48.744 -120.344 1.00 62.74 ? 295 HIS A N 1 ATOM 2264 C CA . HIS A 1 295 ? -5.548 -50.035 -119.647 1.00 61.59 ? 295 HIS A CA 1 ATOM 2265 C C . HIS A 1 295 ? -4.271 -50.539 -118.950 1.00 62.78 ? 295 HIS A C 1 ATOM 2266 O O . HIS A 1 295 ? -4.055 -51.748 -118.827 1.00 62.60 ? 295 HIS A O 1 ATOM 2267 C CB . HIS A 1 295 ? -6.149 -51.104 -120.573 1.00 61.26 ? 295 HIS A CB 1 ATOM 2268 C CG . HIS A 1 295 ? -7.595 -50.880 -120.892 1.00 60.48 ? 295 HIS A CG 1 ATOM 2269 N ND1 . HIS A 1 295 ? -8.026 -49.877 -121.733 1.00 61.91 ? 295 HIS A ND1 1 ATOM 2270 C CD2 . HIS A 1 295 ? -8.710 -51.530 -120.480 1.00 58.98 ? 295 HIS A CD2 1 ATOM 2271 C CE1 . HIS A 1 295 ? -9.344 -49.918 -121.826 1.00 60.61 ? 295 HIS A CE1 1 ATOM 2272 N NE2 . HIS A 1 295 ? -9.783 -50.911 -121.075 1.00 58.67 ? 295 HIS A NE2 1 ATOM 2273 N N . ARG A 1 296 ? -3.442 -49.601 -118.493 1.00 64.46 ? 296 ARG A N 1 ATOM 2274 C CA . ARG A 1 296 ? -2.293 -49.893 -117.630 1.00 65.70 ? 296 ARG A CA 1 ATOM 2275 C C . ARG A 1 296 ? -2.535 -49.262 -116.254 1.00 65.13 ? 296 ARG A C 1 ATOM 2276 O O . ARG A 1 296 ? -2.944 -48.099 -116.172 1.00 65.27 ? 296 ARG A O 1 ATOM 2277 C CB . ARG A 1 296 ? -1.010 -49.305 -118.223 1.00 68.44 ? 296 ARG A CB 1 ATOM 2278 C CG . ARG A 1 296 ? -0.700 -49.716 -119.655 1.00 70.05 ? 296 ARG A CG 1 ATOM 2279 C CD . ARG A 1 296 ? 0.444 -48.891 -120.255 1.00 72.71 ? 296 ARG A CD 1 ATOM 2280 N NE . ARG A 1 296 ? 1.749 -49.259 -119.705 1.00 74.17 ? 296 ARG A NE 1 ATOM 2281 C CZ . ARG A 1 296 ? 2.399 -48.574 -118.767 1.00 74.70 ? 296 ARG A CZ 1 ATOM 2282 N NH1 . ARG A 1 296 ? 1.878 -47.463 -118.261 1.00 74.18 ? 296 ARG A NH1 1 ATOM 2283 N NH2 . ARG A 1 296 ? 3.577 -48.999 -118.334 1.00 76.09 ? 296 ARG A NH2 1 ATOM 2284 N N . HIS A 1 297 ? -2.309 -49.997 -115.165 1.00 64.96 ? 297 HIS A N 1 ATOM 2285 C CA . HIS A 1 297 ? -1.953 -51.407 -115.157 1.00 65.20 ? 297 HIS A CA 1 ATOM 2286 C C . HIS A 1 297 ? -3.177 -52.152 -114.636 1.00 63.24 ? 297 HIS A C 1 ATOM 2287 O O . HIS A 1 297 ? -3.254 -52.471 -113.446 1.00 62.50 ? 297 HIS A O 1 ATOM 2288 C CB . HIS A 1 297 ? -0.779 -51.662 -114.201 1.00 66.60 ? 297 HIS A CB 1 ATOM 2289 C CG . HIS A 1 297 ? 0.379 -50.726 -114.374 1.00 68.51 ? 297 HIS A CG 1 ATOM 2290 N ND1 . HIS A 1 297 ? 0.269 -49.362 -114.213 1.00 68.33 ? 297 HIS A ND1 1 ATOM 2291 C CD2 . HIS A 1 297 ? 1.680 -50.967 -114.659 1.00 70.75 ? 297 HIS A CD2 1 ATOM 2292 C CE1 . HIS A 1 297 ? 1.447 -48.801 -114.415 1.00 71.00 ? 297 HIS A CE1 1 ATOM 2293 N NE2 . HIS A 1 297 ? 2.322 -49.753 -114.684 1.00 72.33 ? 297 HIS A NE2 1 ATOM 2294 N N . HIS A 1 298 ? -4.136 -52.409 -115.526 1.00 62.71 ? 298 HIS A N 1 ATOM 2295 C CA . HIS A 1 298 ? -5.412 -53.052 -115.173 1.00 61.08 ? 298 HIS A CA 1 ATOM 2296 C C . HIS A 1 298 ? -5.248 -54.311 -114.308 1.00 61.06 ? 298 HIS A C 1 ATOM 2297 O O . HIS A 1 298 ? -4.226 -55.004 -114.389 1.00 62.62 ? 298 HIS A O 1 ATOM 2298 C CB . HIS A 1 298 ? -6.204 -53.387 -116.443 1.00 60.63 ? 298 HIS A CB 1 ATOM 2299 C CG . HIS A 1 298 ? -5.638 -54.533 -117.222 1.00 61.96 ? 298 HIS A CG 1 ATOM 2300 N ND1 . HIS A 1 298 ? -4.542 -54.403 -118.047 1.00 64.33 ? 298 HIS A ND1 1 ATOM 2301 C CD2 . HIS A 1 298 ? -6.010 -55.833 -117.291 1.00 61.71 ? 298 HIS A CD2 1 ATOM 2302 C CE1 . HIS A 1 298 ? -4.265 -55.572 -118.595 1.00 65.35 ? 298 HIS A CE1 1 ATOM 2303 N NE2 . HIS A 1 298 ? -5.141 -56.457 -118.153 1.00 64.07 ? 298 HIS A NE2 1 ATOM 2304 N N . HIS A 1 299 ? -6.263 -54.597 -113.493 1.00 59.76 ? 299 HIS A N 1 ATOM 2305 C CA . HIS A 1 299 ? -6.274 -55.774 -112.617 1.00 59.87 ? 299 HIS A CA 1 ATOM 2306 C C . HIS A 1 299 ? -6.196 -57.079 -113.406 1.00 60.42 ? 299 HIS A C 1 ATOM 2307 O O . HIS A 1 299 ? -6.866 -57.231 -114.428 1.00 59.93 ? 299 HIS A O 1 ATOM 2308 C CB . HIS A 1 299 ? -7.519 -55.763 -111.723 1.00 58.26 ? 299 HIS A CB 1 ATOM 2309 C CG . HIS A 1 299 ? -7.461 -54.755 -110.617 0.70 58.50 ? 299 HIS A CG 1 ATOM 2310 N ND1 . HIS A 1 299 ? -7.947 -55.011 -109.353 0.70 58.45 ? 299 HIS A ND1 1 ATOM 2311 C CD2 . HIS A 1 299 ? -6.966 -53.494 -110.580 0.70 59.32 ? 299 HIS A CD2 1 ATOM 2312 C CE1 . HIS A 1 299 ? -7.764 -53.949 -108.589 0.70 58.73 ? 299 HIS A CE1 1 ATOM 2313 N NE2 . HIS A 1 299 ? -7.168 -53.015 -109.309 0.70 59.27 ? 299 HIS A NE2 1 ATOM 2314 N N . HIS A 1 300 ? -5.373 -58.006 -112.911 1.00 61.83 ? 300 HIS A N 1 ATOM 2315 C CA . HIS A 1 300 ? -5.073 -59.283 -113.578 1.00 63.03 ? 300 HIS A CA 1 ATOM 2316 C C . HIS A 1 300 ? -6.307 -60.113 -113.925 1.00 61.98 ? 300 HIS A C 1 ATOM 2317 O O . HIS A 1 300 ? -7.311 -60.074 -113.211 1.00 60.47 ? 300 HIS A O 1 ATOM 2318 C CB . HIS A 1 300 ? -4.121 -60.118 -112.715 1.00 64.55 ? 300 HIS A CB 1 ATOM 2319 N N . HIS A 1 301 ? -6.217 -60.865 -115.023 0.70 63.03 ? 301 HIS A N 1 ATOM 2320 C CA . HIS A 1 301 ? -7.322 -61.712 -115.482 0.70 62.53 ? 301 HIS A CA 1 ATOM 2321 C C . HIS A 1 301 ? -6.877 -63.137 -115.827 0.70 64.16 ? 301 HIS A C 1 ATOM 2322 O O . HIS A 1 301 ? -6.049 -63.346 -116.719 0.70 65.71 ? 301 HIS A O 1 ATOM 2323 C CB . HIS A 1 301 ? -8.049 -61.066 -116.668 0.70 61.97 ? 301 HIS A CB 1 ATOM 2324 C CG . HIS A 1 301 ? -8.595 -59.703 -116.371 0.70 60.80 ? 301 HIS A CG 1 ATOM 2325 N ND1 . HIS A 1 301 ? -9.547 -59.479 -115.399 0.70 59.24 ? 301 HIS A ND1 1 ATOM 2326 C CD2 . HIS A 1 301 ? -8.321 -58.494 -116.916 0.70 61.06 ? 301 HIS A CD2 1 ATOM 2327 C CE1 . HIS A 1 301 ? -9.835 -58.190 -115.357 0.70 58.65 ? 301 HIS A CE1 1 ATOM 2328 N NE2 . HIS A 1 301 ? -9.105 -57.570 -116.268 0.70 59.78 ? 301 HIS A NE2 1 ATOM 2329 N N . HIS A 1 302 ? -7.437 -64.104 -115.102 0.70 63.99 ? 302 HIS A N 1 ATOM 2330 C CA . HIS A 1 302 ? -7.129 -65.524 -115.284 0.70 65.63 ? 302 HIS A CA 1 ATOM 2331 C C . HIS A 1 302 ? -8.274 -66.399 -114.772 0.70 65.01 ? 302 HIS A C 1 ATOM 2332 O O . HIS A 1 302 ? -8.670 -66.313 -113.606 0.70 64.05 ? 302 HIS A O 1 ATOM 2333 C CB . HIS A 1 302 ? -5.822 -65.894 -114.570 0.70 67.36 ? 302 HIS A CB 1 ATOM 2334 N N . GLN B 2 2 ? -2.390 -61.490 -86.875 1.00 65.11 ? 2 GLN B N 1 ATOM 2335 C CA . GLN B 2 2 ? -1.853 -60.492 -87.847 1.00 63.66 ? 2 GLN B CA 1 ATOM 2336 C C . GLN B 2 2 ? -2.478 -60.677 -89.235 1.00 62.53 ? 2 GLN B C 1 ATOM 2337 O O . GLN B 2 2 ? -2.156 -61.630 -89.951 1.00 64.35 ? 2 GLN B O 1 ATOM 2338 C CB . GLN B 2 2 ? -0.325 -60.588 -87.918 1.00 65.81 ? 2 GLN B CB 1 ATOM 2339 C CG . GLN B 2 2 ? 0.362 -59.319 -88.397 1.00 64.81 ? 2 GLN B CG 1 ATOM 2340 C CD . GLN B 2 2 ? 1.877 -59.420 -88.352 1.00 67.81 ? 2 GLN B CD 1 ATOM 2341 O OE1 . GLN B 2 2 ? 2.485 -60.219 -89.071 1.00 69.56 ? 2 GLN B OE1 1 ATOM 2342 N NE2 . GLN B 2 2 ? 2.498 -58.600 -87.509 1.00 68.24 ? 2 GLN B NE2 1 ATOM 2343 N N . LYS B 2 3 ? -3.362 -59.753 -89.605 1.00 59.81 ? 3 LYS B N 1 ATOM 2344 C CA . LYS B 2 3 ? -4.143 -59.862 -90.838 1.00 58.72 ? 3 LYS B CA 1 ATOM 2345 C C . LYS B 2 3 ? -3.722 -58.867 -91.925 1.00 57.10 ? 3 LYS B C 1 ATOM 2346 O O . LYS B 2 3 ? -3.255 -57.765 -91.630 1.00 56.12 ? 3 LYS B O 1 ATOM 2347 C CB . LYS B 2 3 ? -5.638 -59.732 -90.535 1.00 57.54 ? 3 LYS B CB 1 ATOM 2348 C CG . LYS B 2 3 ? -6.218 -60.892 -89.727 1.00 60.05 ? 3 LYS B CG 1 ATOM 2349 C CD . LYS B 2 3 ? -7.710 -60.696 -89.483 1.00 60.48 ? 3 LYS B CD 1 ATOM 2350 C CE . LYS B 2 3 ? -8.326 -61.869 -88.726 1.00 63.08 ? 3 LYS B CE 1 ATOM 2351 N NZ . LYS B 2 3 ? -9.796 -61.675 -88.523 1.00 62.41 ? 3 LYS B NZ 1 ATOM 2352 N N . THR B 2 4 ? -3.913 -59.273 -93.181 1.00 56.89 ? 4 THR B N 1 ATOM 2353 C CA . THR B 2 4 ? -3.441 -58.534 -94.354 1.00 55.83 ? 4 THR B CA 1 ATOM 2354 C C . THR B 2 4 ? -4.450 -57.479 -94.826 1.00 53.18 ? 4 THR B C 1 ATOM 2355 O O . THR B 2 4 ? -5.649 -57.760 -94.898 1.00 52.43 ? 4 THR B O 1 ATOM 2356 C CB . THR B 2 4 ? -3.139 -59.510 -95.518 1.00 57.49 ? 4 THR B CB 1 ATOM 2357 O OG1 . THR B 2 4 ? -2.429 -60.648 -95.016 1.00 60.52 ? 4 THR B OG1 1 ATOM 2358 C CG2 . THR B 2 4 ? -2.306 -58.846 -96.602 1.00 57.18 ? 4 THR B CG2 1 ATOM 2359 N N . PRO B 2 5 ? -3.964 -56.262 -95.153 1.00 52.02 ? 5 PRO B N 1 ATOM 2360 C CA . PRO B 2 5 ? -4.819 -55.192 -95.672 1.00 50.05 ? 5 PRO B CA 1 ATOM 2361 C C . PRO B 2 5 ? -5.424 -55.510 -97.039 1.00 49.72 ? 5 PRO B C 1 ATOM 2362 O O . PRO B 2 5 ? -4.774 -56.141 -97.877 1.00 50.94 ? 5 PRO B O 1 ATOM 2363 C CB . PRO B 2 5 ? -3.858 -54.001 -95.804 1.00 49.86 ? 5 PRO B CB 1 ATOM 2364 C CG . PRO B 2 5 ? -2.715 -54.316 -94.932 1.00 51.41 ? 5 PRO B CG 1 ATOM 2365 C CD . PRO B 2 5 ? -2.578 -55.798 -94.954 1.00 53.02 ? 5 PRO B CD 1 ATOM 2366 N N . GLN B 2 6 ? -6.663 -55.069 -97.246 1.00 48.33 ? 6 GLN B N 1 ATOM 2367 C CA . GLN B 2 6 ? -7.325 -55.162 -98.544 1.00 47.99 ? 6 GLN B CA 1 ATOM 2368 C C . GLN B 2 6 ? -7.506 -53.763 -99.107 1.00 46.45 ? 6 GLN B C 1 ATOM 2369 O O . GLN B 2 6 ? -8.049 -52.887 -98.437 1.00 45.71 ? 6 GLN B O 1 ATOM 2370 C CB . GLN B 2 6 ? -8.684 -55.859 -98.424 1.00 48.16 ? 6 GLN B CB 1 ATOM 2371 C CG . GLN B 2 6 ? -8.638 -57.224 -97.753 1.00 50.66 ? 6 GLN B CG 1 ATOM 2372 C CD . GLN B 2 6 ? -7.622 -58.161 -98.385 1.00 53.55 ? 6 GLN B CD 1 ATOM 2373 O OE1 . GLN B 2 6 ? -7.705 -58.483 -99.573 1.00 54.65 ? 6 GLN B OE1 1 ATOM 2374 N NE2 . GLN B 2 6 ? -6.656 -58.607 -97.586 1.00 55.00 ? 6 GLN B NE2 1 ATOM 2375 N N . ILE B 2 7 ? -7.046 -53.556 -100.337 1.00 46.28 ? 7 ILE B N 1 ATOM 2376 C CA . ILE B 2 7 ? -7.076 -52.233 -100.951 1.00 45.08 ? 7 ILE B CA 1 ATOM 2377 C C . ILE B 2 7 ? -8.092 -52.157 -102.092 1.00 44.53 ? 7 ILE B C 1 ATOM 2378 O O . ILE B 2 7 ? -8.042 -52.947 -103.039 1.00 45.28 ? 7 ILE B O 1 ATOM 2379 C CB . ILE B 2 7 ? -5.675 -51.807 -101.454 1.00 45.87 ? 7 ILE B CB 1 ATOM 2380 C CG1 . ILE B 2 7 ? -4.613 -52.080 -100.386 1.00 46.28 ? 7 ILE B CG1 1 ATOM 2381 C CG2 . ILE B 2 7 ? -5.675 -50.331 -101.856 1.00 45.27 ? 7 ILE B CG2 1 ATOM 2382 C CD1 . ILE B 2 7 ? -3.204 -52.135 -100.927 1.00 48.16 ? 7 ILE B CD1 1 ATOM 2383 N N . GLN B 2 8 ? -9.012 -51.202 -101.978 1.00 43.38 ? 8 GLN B N 1 ATOM 2384 C CA . GLN B 2 8 ? -10.014 -50.932 -103.004 1.00 42.91 ? 8 GLN B CA 1 ATOM 2385 C C . GLN B 2 8 ? -9.910 -49.473 -103.454 1.00 42.60 ? 8 GLN B C 1 ATOM 2386 O O . GLN B 2 8 ? -10.068 -48.558 -102.640 1.00 42.37 ? 8 GLN B O 1 ATOM 2387 C CB . GLN B 2 8 ? -11.420 -51.209 -102.465 1.00 42.66 ? 8 GLN B CB 1 ATOM 2388 C CG . GLN B 2 8 ? -11.772 -52.678 -102.307 1.00 43.24 ? 8 GLN B CG 1 ATOM 2389 C CD . GLN B 2 8 ? -13.030 -52.891 -101.476 1.00 43.65 ? 8 GLN B CD 1 ATOM 2390 O OE1 . GLN B 2 8 ? -13.016 -52.741 -100.250 1.00 43.57 ? 8 GLN B OE1 1 ATOM 2391 N NE2 . GLN B 2 8 ? -14.123 -53.251 -102.141 1.00 43.96 ? 8 GLN B NE2 1 ATOM 2392 N N . VAL B 2 9 ? -9.639 -49.263 -104.742 1.00 42.73 ? 9 VAL B N 1 ATOM 2393 C CA . VAL B 2 9 ? -9.520 -47.914 -105.302 1.00 42.85 ? 9 VAL B CA 1 ATOM 2394 C C . VAL B 2 9 ? -10.692 -47.614 -106.238 1.00 43.07 ? 9 VAL B C 1 ATOM 2395 O O . VAL B 2 9 ? -11.005 -48.413 -107.127 1.00 43.46 ? 9 VAL B O 1 ATOM 2396 C CB . VAL B 2 9 ? -8.171 -47.693 -106.041 1.00 43.50 ? 9 VAL B CB 1 ATOM 2397 C CG1 . VAL B 2 9 ? -7.987 -46.226 -106.395 1.00 43.90 ? 9 VAL B CG1 1 ATOM 2398 C CG2 . VAL B 2 9 ? -7.005 -48.157 -105.187 1.00 43.68 ? 9 VAL B CG2 1 ATOM 2399 N N . TYR B 2 10 ? -11.330 -46.462 -106.030 1.00 43.17 ? 10 TYR B N 1 ATOM 2400 C CA . TYR B 2 10 ? -12.542 -46.083 -106.765 1.00 43.59 ? 10 TYR B CA 1 ATOM 2401 C C . TYR B 2 10 ? -12.791 -44.578 -106.725 1.00 44.45 ? 10 TYR B C 1 ATOM 2402 O O . TYR B 2 10 ? -12.446 -43.909 -105.750 1.00 44.63 ? 10 TYR B O 1 ATOM 2403 C CB . TYR B 2 10 ? -13.767 -46.831 -106.221 1.00 43.35 ? 10 TYR B CB 1 ATOM 2404 C CG . TYR B 2 10 ? -13.978 -46.693 -104.726 1.00 42.99 ? 10 TYR B CG 1 ATOM 2405 C CD1 . TYR B 2 10 ? -13.292 -47.513 -103.827 1.00 42.45 ? 10 TYR B CD1 1 ATOM 2406 C CD2 . TYR B 2 10 ? -14.870 -45.752 -104.210 1.00 43.53 ? 10 TYR B CD2 1 ATOM 2407 C CE1 . TYR B 2 10 ? -13.477 -47.394 -102.459 1.00 42.23 ? 10 TYR B CE1 1 ATOM 2408 C CE2 . TYR B 2 10 ? -15.066 -45.626 -102.837 1.00 43.53 ? 10 TYR B CE2 1 ATOM 2409 C CZ . TYR B 2 10 ? -14.365 -46.452 -101.968 1.00 42.81 ? 10 TYR B CZ 1 ATOM 2410 O OH . TYR B 2 10 ? -14.547 -46.342 -100.609 1.00 42.48 ? 10 TYR B OH 1 ATOM 2411 N N . SER B 2 11 ? -13.399 -44.056 -107.787 1.00 45.36 ? 11 SER B N 1 ATOM 2412 C CA . SER B 2 11 ? -13.689 -42.626 -107.891 1.00 46.61 ? 11 SER B CA 1 ATOM 2413 C C . SER B 2 11 ? -15.052 -42.274 -107.306 1.00 47.18 ? 11 SER B C 1 ATOM 2414 O O . SER B 2 11 ? -15.977 -43.090 -107.326 1.00 47.08 ? 11 SER B O 1 ATOM 2415 C CB . SER B 2 11 ? -13.608 -42.163 -109.349 1.00 47.70 ? 11 SER B CB 1 ATOM 2416 O OG . SER B 2 11 ? -14.418 -42.966 -110.192 1.00 47.85 ? 11 SER B OG 1 ATOM 2417 N N . ARG B 2 12 ? -15.158 -41.052 -106.790 1.00 48.23 ? 12 ARG B N 1 ATOM 2418 C CA . ARG B 2 12 ? -16.398 -40.528 -106.223 1.00 49.30 ? 12 ARG B CA 1 ATOM 2419 C C . ARG B 2 12 ? -17.485 -40.336 -107.286 1.00 50.65 ? 12 ARG B C 1 ATOM 2420 O O . ARG B 2 12 ? -18.644 -40.686 -107.064 1.00 51.07 ? 12 ARG B O 1 ATOM 2421 C CB . ARG B 2 12 ? -16.117 -39.208 -105.483 1.00 50.66 ? 12 ARG B CB 1 ATOM 2422 C CG . ARG B 2 12 ? -17.350 -38.418 -105.023 1.00 52.41 ? 12 ARG B CG 1 ATOM 2423 C CD . ARG B 2 12 ? -18.179 -39.179 -103.995 1.00 51.10 ? 12 ARG B CD 1 ATOM 2424 N NE . ARG B 2 12 ? -19.323 -38.409 -103.508 1.00 53.17 ? 12 ARG B NE 1 ATOM 2425 C CZ . ARG B 2 12 ? -20.495 -38.305 -104.132 1.00 54.39 ? 12 ARG B CZ 1 ATOM 2426 N NH1 . ARG B 2 12 ? -20.701 -38.915 -105.295 1.00 53.23 ? 12 ARG B NH1 1 ATOM 2427 N NH2 . ARG B 2 12 ? -21.466 -37.581 -103.590 1.00 56.43 ? 12 ARG B NH2 1 ATOM 2428 N N . HIS B 2 13 ? -17.099 -39.784 -108.433 1.00 51.62 ? 13 HIS B N 1 ATOM 2429 C CA . HIS B 2 13 ? -18.028 -39.509 -109.526 1.00 53.37 ? 13 HIS B CA 1 ATOM 2430 C C . HIS B 2 13 ? -17.680 -40.355 -110.751 1.00 52.75 ? 13 HIS B C 1 ATOM 2431 O O . HIS B 2 13 ? -16.585 -40.921 -110.811 1.00 51.49 ? 13 HIS B O 1 ATOM 2432 C CB . HIS B 2 13 ? -17.983 -38.022 -109.888 1.00 55.72 ? 13 HIS B CB 1 ATOM 2433 C CG . HIS B 2 13 ? -18.320 -37.112 -108.750 1.00 57.10 ? 13 HIS B CG 1 ATOM 2434 N ND1 . HIS B 2 13 ? -19.615 -36.884 -108.339 1.00 58.74 ? 13 HIS B ND1 1 ATOM 2435 C CD2 . HIS B 2 13 ? -17.531 -36.373 -107.936 1.00 57.67 ? 13 HIS B CD2 1 ATOM 2436 C CE1 . HIS B 2 13 ? -19.609 -36.043 -107.320 1.00 60.46 ? 13 HIS B CE1 1 ATOM 2437 N NE2 . HIS B 2 13 ? -18.356 -35.718 -107.056 1.00 59.74 ? 13 HIS B NE2 1 ATOM 2438 N N . PRO B 2 14 ? -18.606 -40.452 -111.731 1.00 54.07 ? 14 PRO B N 1 ATOM 2439 C CA . PRO B 2 14 ? -18.286 -41.169 -112.970 1.00 53.85 ? 14 PRO B CA 1 ATOM 2440 C C . PRO B 2 14 ? -16.991 -40.641 -113.594 1.00 53.88 ? 14 PRO B C 1 ATOM 2441 O O . PRO B 2 14 ? -16.843 -39.428 -113.753 1.00 55.37 ? 14 PRO B O 1 ATOM 2442 C CB . PRO B 2 14 ? -19.475 -40.850 -113.881 1.00 55.84 ? 14 PRO B CB 1 ATOM 2443 C CG . PRO B 2 14 ? -20.586 -40.525 -112.965 1.00 56.74 ? 14 PRO B CG 1 ATOM 2444 C CD . PRO B 2 14 ? -19.984 -39.926 -111.736 1.00 56.05 ? 14 PRO B CD 1 ATOM 2445 N N . PRO B 2 15 ? -16.048 -41.544 -113.919 1.00 52.67 ? 15 PRO B N 1 ATOM 2446 C CA . PRO B 2 15 ? -14.770 -41.141 -114.506 1.00 52.97 ? 15 PRO B CA 1 ATOM 2447 C C . PRO B 2 15 ? -14.952 -40.453 -115.852 1.00 54.91 ? 15 PRO B C 1 ATOM 2448 O O . PRO B 2 15 ? -15.495 -41.044 -116.786 1.00 55.46 ? 15 PRO B O 1 ATOM 2449 C CB . PRO B 2 15 ? -14.026 -42.472 -114.685 1.00 51.64 ? 15 PRO B CB 1 ATOM 2450 C CG . PRO B 2 15 ? -14.665 -43.400 -113.718 1.00 50.60 ? 15 PRO B CG 1 ATOM 2451 C CD . PRO B 2 15 ? -16.105 -42.995 -113.677 1.00 51.39 ? 15 PRO B CD 1 ATOM 2452 N N . GLU B 2 16 ? -14.523 -39.199 -115.931 1.00 56.41 ? 16 GLU B N 1 ATOM 2453 C CA . GLU B 2 16 ? -14.539 -38.456 -117.185 1.00 58.59 ? 16 GLU B CA 1 ATOM 2454 C C . GLU B 2 16 ? -13.172 -37.830 -117.421 1.00 59.29 ? 16 GLU B C 1 ATOM 2455 O O . GLU B 2 16 ? -12.666 -37.083 -116.579 1.00 59.75 ? 16 GLU B O 1 ATOM 2456 C CB . GLU B 2 16 ? -15.632 -37.384 -117.180 1.00 60.68 ? 16 GLU B CB 1 ATOM 2457 C CG . GLU B 2 16 ? -17.042 -37.914 -117.432 1.00 61.38 ? 16 GLU B CG 1 ATOM 2458 C CD . GLU B 2 16 ? -18.111 -36.826 -117.368 0.90 64.34 ? 16 GLU B CD 1 ATOM 2459 O OE1 . GLU B 2 16 ? -17.920 -35.750 -117.982 0.90 66.38 ? 16 GLU B OE1 1 ATOM 2460 O OE2 . GLU B 2 16 ? -19.150 -37.053 -116.708 0.90 64.42 ? 16 GLU B OE2 1 ATOM 2461 N N . ASN B 2 17 ? -12.574 -38.153 -118.563 1.00 59.68 ? 17 ASN B N 1 ATOM 2462 C CA . ASN B 2 17 ? -11.273 -37.614 -118.931 1.00 60.74 ? 17 ASN B CA 1 ATOM 2463 C C . ASN B 2 17 ? -11.294 -36.086 -119.000 1.00 63.28 ? 17 ASN B C 1 ATOM 2464 O O . ASN B 2 17 ? -12.093 -35.497 -119.735 1.00 65.00 ? 17 ASN B O 1 ATOM 2465 C CB . ASN B 2 17 ? -10.798 -38.215 -120.258 1.00 61.19 ? 17 ASN B CB 1 ATOM 2466 C CG . ASN B 2 17 ? -10.568 -39.718 -120.174 1.00 59.25 ? 17 ASN B CG 1 ATOM 2467 O OD1 . ASN B 2 17 ? -9.957 -40.214 -119.228 1.00 58.02 ? 17 ASN B OD1 1 ATOM 2468 N ND2 . ASN B 2 17 ? -11.051 -40.446 -121.173 1.00 59.27 ? 17 ASN B ND2 1 ATOM 2469 N N . GLY B 2 18 ? -10.431 -35.457 -118.206 1.00 63.74 ? 18 GLY B N 1 ATOM 2470 C CA . GLY B 2 18 ? -10.300 -34.001 -118.197 1.00 66.52 ? 18 GLY B CA 1 ATOM 2471 C C . GLY B 2 18 ? -11.103 -33.296 -117.118 1.00 67.06 ? 18 GLY B C 1 ATOM 2472 O O . GLY B 2 18 ? -10.861 -32.120 -116.833 1.00 69.56 ? 18 GLY B O 1 ATOM 2473 N N . LYS B 2 19 ? -12.052 -34.013 -116.517 1.00 64.95 ? 19 LYS B N 1 ATOM 2474 C CA . LYS B 2 19 ? -12.929 -33.444 -115.491 1.00 65.45 ? 19 LYS B CA 1 ATOM 2475 C C . LYS B 2 19 ? -12.455 -33.773 -114.070 1.00 63.68 ? 19 LYS B C 1 ATOM 2476 O O . LYS B 2 19 ? -12.111 -34.920 -113.785 1.00 61.09 ? 19 LYS B O 1 ATOM 2477 C CB . LYS B 2 19 ? -14.371 -33.918 -115.698 1.00 64.97 ? 19 LYS B CB 1 ATOM 2478 N N . PRO B 2 20 ? -12.430 -32.761 -113.178 1.00 65.38 ? 20 PRO B N 1 ATOM 2479 C CA . PRO B 2 20 ? -12.020 -32.939 -111.781 1.00 64.16 ? 20 PRO B CA 1 ATOM 2480 C C . PRO B 2 20 ? -12.890 -33.945 -111.024 1.00 61.59 ? 20 PRO B C 1 ATOM 2481 O O . PRO B 2 20 ? -14.103 -34.004 -111.241 1.00 61.87 ? 20 PRO B O 1 ATOM 2482 C CB . PRO B 2 20 ? -12.188 -31.538 -111.188 1.00 67.38 ? 20 PRO B CB 1 ATOM 2483 C CG . PRO B 2 20 ? -12.028 -30.626 -112.349 1.00 70.27 ? 20 PRO B CG 1 ATOM 2484 C CD . PRO B 2 20 ? -12.681 -31.341 -113.490 1.00 69.01 ? 20 PRO B CD 1 ATOM 2485 N N . ASN B 2 21 ? -12.255 -34.716 -110.142 1.00 59.33 ? 21 ASN B N 1 ATOM 2486 C CA . ASN B 2 21 ? -12.891 -35.819 -109.424 1.00 56.73 ? 21 ASN B CA 1 ATOM 2487 C C . ASN B 2 21 ? -12.209 -36.031 -108.065 1.00 55.77 ? 21 ASN B C 1 ATOM 2488 O O . ASN B 2 21 ? -11.342 -35.250 -107.673 1.00 57.14 ? 21 ASN B O 1 ATOM 2489 C CB . ASN B 2 21 ? -12.817 -37.097 -110.277 1.00 54.66 ? 21 ASN B CB 1 ATOM 2490 C CG . ASN B 2 21 ? -13.979 -38.062 -110.027 1.00 53.21 ? 21 ASN B CG 1 ATOM 2491 O OD1 . ASN B 2 21 ? -14.437 -38.243 -108.898 1.00 52.26 ? 21 ASN B OD1 1 ATOM 2492 N ND2 . ASN B 2 21 ? -14.444 -38.701 -111.094 1.00 52.89 ? 21 ASN B ND2 1 ATOM 2493 N N . ILE B 2 22 ? -12.617 -37.077 -107.348 1.00 53.69 ? 22 ILE B N 1 ATOM 2494 C CA . ILE B 2 22 ? -12.000 -37.475 -106.083 1.00 52.64 ? 22 ILE B CA 1 ATOM 2495 C C . ILE B 2 22 ? -11.738 -38.985 -106.122 1.00 50.23 ? 22 ILE B C 1 ATOM 2496 O O . ILE B 2 22 ? -12.647 -39.770 -106.399 1.00 49.25 ? 22 ILE B O 1 ATOM 2497 C CB . ILE B 2 22 ? -12.892 -37.118 -104.852 1.00 53.24 ? 22 ILE B CB 1 ATOM 2498 C CG1 . ILE B 2 22 ? -13.192 -35.614 -104.804 1.00 56.31 ? 22 ILE B CG1 1 ATOM 2499 C CG2 . ILE B 2 22 ? -12.227 -37.559 -103.547 1.00 52.06 ? 22 ILE B CG2 1 ATOM 2500 C CD1 . ILE B 2 22 ? -14.349 -35.232 -103.889 1.00 57.74 ? 22 ILE B CD1 1 ATOM 2501 N N . LEU B 2 23 ? -10.495 -39.379 -105.856 1.00 49.67 ? 23 LEU B N 1 ATOM 2502 C CA . LEU B 2 23 ? -10.110 -40.790 -105.860 1.00 47.92 ? 23 LEU B CA 1 ATOM 2503 C C . LEU B 2 23 ? -10.044 -41.325 -104.436 1.00 47.12 ? 23 LEU B C 1 ATOM 2504 O O . LEU B 2 23 ? -9.445 -40.697 -103.561 1.00 47.99 ? 23 LEU B O 1 ATOM 2505 C CB . LEU B 2 23 ? -8.758 -40.977 -106.558 1.00 48.19 ? 23 LEU B CB 1 ATOM 2506 C CG . LEU B 2 23 ? -8.308 -42.391 -106.940 1.00 46.81 ? 23 LEU B CG 1 ATOM 2507 C CD1 . LEU B 2 23 ? -9.141 -42.957 -108.073 1.00 46.14 ? 23 LEU B CD1 1 ATOM 2508 C CD2 . LEU B 2 23 ? -6.847 -42.367 -107.332 1.00 47.88 ? 23 LEU B CD2 1 ATOM 2509 N N . ASN B 2 24 ? -10.658 -42.484 -104.215 1.00 45.74 ? 24 ASN B N 1 ATOM 2510 C CA . ASN B 2 24 ? -10.726 -43.080 -102.887 1.00 45.16 ? 24 ASN B CA 1 ATOM 2511 C C . ASN B 2 24 ? -9.870 -44.337 -102.761 1.00 44.45 ? 24 ASN B C 1 ATOM 2512 O O . ASN B 2 24 ? -9.901 -45.214 -103.631 1.00 43.96 ? 24 ASN B O 1 ATOM 2513 C CB . ASN B 2 24 ? -12.177 -43.410 -102.508 1.00 44.83 ? 24 ASN B CB 1 ATOM 2514 C CG . ASN B 2 24 ? -13.085 -42.185 -102.488 1.00 46.34 ? 24 ASN B CG 1 ATOM 2515 O OD1 . ASN B 2 24 ? -12.688 -41.098 -102.070 1.00 47.80 ? 24 ASN B OD1 1 ATOM 2516 N ND2 . ASN B 2 24 ? -14.322 -42.369 -102.925 1.00 46.90 ? 24 ASN B ND2 1 ATOM 2517 N N . CYS B 2 25 ? -9.101 -44.409 -101.678 1.00 44.66 ? 25 CYS B N 1 ATOM 2518 C CA . CYS B 2 25 ? -8.403 -45.631 -101.302 1.00 44.17 ? 25 CYS B CA 1 ATOM 2519 C C . CYS B 2 25 ? -8.963 -46.114 -99.975 1.00 43.58 ? 25 CYS B C 1 ATOM 2520 O O . CYS B 2 25 ? -8.787 -45.472 -98.940 1.00 44.15 ? 25 CYS B O 1 ATOM 2521 C CB . CYS B 2 25 ? -6.888 -45.425 -101.211 1.00 45.05 ? 25 CYS B CB 1 ATOM 2522 S SG . CYS B 2 25 ? -5.994 -46.984 -100.938 1.00 45.79 ? 25 CYS B SG 1 ATOM 2523 N N . TYR B 2 26 ? -9.653 -47.246 -100.025 1.00 42.86 ? 26 TYR B N 1 ATOM 2524 C CA . TYR B 2 26 ? -10.322 -47.811 -98.866 1.00 42.43 ? 26 TYR B CA 1 ATOM 2525 C C . TYR B 2 26 ? -9.607 -49.095 -98.458 1.00 42.36 ? 26 TYR B C 1 ATOM 2526 O O . TYR B 2 26 ? -9.709 -50.120 -99.140 1.00 42.34 ? 26 TYR B O 1 ATOM 2527 C CB . TYR B 2 26 ? -11.796 -48.064 -99.204 1.00 42.26 ? 26 TYR B CB 1 ATOM 2528 C CG . TYR B 2 26 ? -12.659 -48.551 -98.062 1.00 42.41 ? 26 TYR B CG 1 ATOM 2529 C CD1 . TYR B 2 26 ? -12.629 -47.925 -96.816 1.00 42.64 ? 26 TYR B CD1 1 ATOM 2530 C CD2 . TYR B 2 26 ? -13.532 -49.625 -98.239 1.00 42.45 ? 26 TYR B CD2 1 ATOM 2531 C CE1 . TYR B 2 26 ? -13.430 -48.370 -95.772 1.00 42.98 ? 26 TYR B CE1 1 ATOM 2532 C CE2 . TYR B 2 26 ? -14.341 -50.072 -97.202 1.00 42.71 ? 26 TYR B CE2 1 ATOM 2533 C CZ . TYR B 2 26 ? -14.283 -49.440 -95.973 1.00 42.92 ? 26 TYR B CZ 1 ATOM 2534 O OH . TYR B 2 26 ? -15.078 -49.879 -94.943 1.00 44.04 ? 26 TYR B OH 1 ATOM 2535 N N . VAL B 2 27 ? -8.865 -49.018 -97.354 1.00 42.49 ? 27 VAL B N 1 ATOM 2536 C CA . VAL B 2 27 ? -8.040 -50.129 -96.876 1.00 42.73 ? 27 VAL B CA 1 ATOM 2537 C C . VAL B 2 27 ? -8.717 -50.810 -95.688 1.00 42.64 ? 27 VAL B C 1 ATOM 2538 O O . VAL B 2 27 ? -9.040 -50.153 -94.696 1.00 42.81 ? 27 VAL B O 1 ATOM 2539 C CB . VAL B 2 27 ? -6.619 -49.659 -96.482 1.00 43.51 ? 27 VAL B CB 1 ATOM 2540 C CG1 . VAL B 2 27 ? -5.698 -50.851 -96.287 1.00 44.32 ? 27 VAL B CG1 1 ATOM 2541 C CG2 . VAL B 2 27 ? -6.044 -48.726 -97.540 1.00 43.78 ? 27 VAL B CG2 1 ATOM 2542 N N . THR B 2 28 ? -8.923 -52.124 -95.795 1.00 42.63 ? 28 THR B N 1 ATOM 2543 C CA . THR B 2 28 ? -9.724 -52.869 -94.818 1.00 42.63 ? 28 THR B CA 1 ATOM 2544 C C . THR B 2 28 ? -9.102 -54.192 -94.369 1.00 43.59 ? 28 THR B C 1 ATOM 2545 O O . THR B 2 28 ? -8.153 -54.687 -94.983 1.00 44.18 ? 28 THR B O 1 ATOM 2546 C CB . THR B 2 28 ? -11.138 -53.185 -95.371 1.00 42.63 ? 28 THR B CB 1 ATOM 2547 O OG1 . THR B 2 28 ? -11.029 -53.909 -96.605 1.00 42.65 ? 28 THR B OG1 1 ATOM 2548 C CG2 . THR B 2 28 ? -11.938 -51.911 -95.594 1.00 41.83 ? 28 THR B CG2 1 ATOM 2549 N N . GLN B 2 29 ? -9.663 -54.753 -93.295 1.00 43.86 ? 29 GLN B N 1 ATOM 2550 C CA . GLN B 2 29 ? -9.348 -56.106 -92.808 1.00 45.13 ? 29 GLN B CA 1 ATOM 2551 C C . GLN B 2 29 ? -7.932 -56.275 -92.258 1.00 45.76 ? 29 GLN B C 1 ATOM 2552 O O . GLN B 2 29 ? -7.431 -57.401 -92.165 1.00 47.22 ? 29 GLN B O 1 ATOM 2553 C CB . GLN B 2 29 ? -9.633 -57.177 -93.883 1.00 46.16 ? 29 GLN B CB 1 ATOM 2554 C CG . GLN B 2 29 ? -11.082 -57.242 -94.393 1.00 46.24 ? 29 GLN B CG 1 ATOM 2555 C CD . GLN B 2 29 ? -12.116 -57.374 -93.279 0.70 46.97 ? 29 GLN B CD 1 ATOM 2556 O OE1 . GLN B 2 29 ? -13.048 -56.574 -93.192 0.70 46.61 ? 29 GLN B OE1 1 ATOM 2557 N NE2 . GLN B 2 29 ? -11.953 -58.381 -92.423 0.70 48.24 ? 29 GLN B NE2 1 ATOM 2558 N N . PHE B 2 30 ? -7.299 -55.166 -91.880 1.00 44.97 ? 30 PHE B N 1 ATOM 2559 C CA . PHE B 2 30 ? -5.930 -55.203 -91.359 1.00 45.76 ? 30 PHE B CA 1 ATOM 2560 C C . PHE B 2 30 ? -5.844 -55.109 -89.833 1.00 46.31 ? 30 PHE B C 1 ATOM 2561 O O . PHE B 2 30 ? -6.770 -54.634 -89.172 1.00 45.58 ? 30 PHE B O 1 ATOM 2562 C CB . PHE B 2 30 ? -5.045 -54.145 -92.034 1.00 45.21 ? 30 PHE B CB 1 ATOM 2563 C CG . PHE B 2 30 ? -5.446 -52.727 -91.741 1.00 43.88 ? 30 PHE B CG 1 ATOM 2564 C CD1 . PHE B 2 30 ? -6.367 -52.070 -92.548 1.00 42.18 ? 30 PHE B CD1 1 ATOM 2565 C CD2 . PHE B 2 30 ? -4.879 -52.037 -90.672 1.00 44.24 ? 30 PHE B CD2 1 ATOM 2566 C CE1 . PHE B 2 30 ? -6.732 -50.753 -92.285 1.00 41.84 ? 30 PHE B CE1 1 ATOM 2567 C CE2 . PHE B 2 30 ? -5.236 -50.720 -90.402 1.00 43.50 ? 30 PHE B CE2 1 ATOM 2568 C CZ . PHE B 2 30 ? -6.165 -50.077 -91.208 1.00 42.47 ? 30 PHE B CZ 1 ATOM 2569 N N . HIS B 2 31 ? -4.713 -55.577 -89.304 1.00 47.86 ? 31 HIS B N 1 ATOM 2570 C CA . HIS B 2 31 ? -4.425 -55.649 -87.873 1.00 48.80 ? 31 HIS B CA 1 ATOM 2571 C C . HIS B 2 31 ? -2.966 -56.078 -87.734 1.00 50.81 ? 31 HIS B C 1 ATOM 2572 O O . HIS B 2 31 ? -2.554 -57.044 -88.377 1.00 51.80 ? 31 HIS B O 1 ATOM 2573 C CB . HIS B 2 31 ? -5.327 -56.682 -87.195 1.00 49.19 ? 31 HIS B CB 1 ATOM 2574 C CG . HIS B 2 31 ? -5.329 -56.598 -85.701 1.00 49.82 ? 31 HIS B CG 1 ATOM 2575 N ND1 . HIS B 2 31 ? -6.408 -56.124 -84.985 1.00 48.89 ? 31 HIS B ND1 1 ATOM 2576 C CD2 . HIS B 2 31 ? -4.388 -56.933 -84.787 1.00 51.04 ? 31 HIS B CD2 1 ATOM 2577 C CE1 . HIS B 2 31 ? -6.129 -56.167 -83.694 1.00 49.59 ? 31 HIS B CE1 1 ATOM 2578 N NE2 . HIS B 2 31 ? -4.910 -56.653 -83.548 1.00 51.01 ? 31 HIS B NE2 1 ATOM 2579 N N . PRO B 2 32 ? -2.167 -55.376 -86.904 1.00 51.87 ? 32 PRO B N 1 ATOM 2580 C CA . PRO B 2 32 ? -2.402 -54.224 -86.026 1.00 51.62 ? 32 PRO B CA 1 ATOM 2581 C C . PRO B 2 32 ? -2.711 -52.924 -86.780 1.00 50.40 ? 32 PRO B C 1 ATOM 2582 O O . PRO B 2 32 ? -2.473 -52.848 -87.985 1.00 49.92 ? 32 PRO B O 1 ATOM 2583 C CB . PRO B 2 32 ? -1.069 -54.084 -85.277 1.00 53.78 ? 32 PRO B CB 1 ATOM 2584 C CG . PRO B 2 32 ? -0.383 -55.388 -85.449 1.00 55.32 ? 32 PRO B CG 1 ATOM 2585 C CD . PRO B 2 32 ? -0.770 -55.829 -86.808 1.00 54.14 ? 32 PRO B CD 1 ATOM 2586 N N . PRO B 2 33 ? -3.230 -51.902 -86.069 1.00 50.32 ? 33 PRO B N 1 ATOM 2587 C CA . PRO B 2 33 ? -3.708 -50.674 -86.714 1.00 49.54 ? 33 PRO B CA 1 ATOM 2588 C C . PRO B 2 33 ? -2.631 -49.856 -87.438 1.00 50.65 ? 33 PRO B C 1 ATOM 2589 O O . PRO B 2 33 ? -2.938 -49.204 -88.437 1.00 49.85 ? 33 PRO B O 1 ATOM 2590 C CB . PRO B 2 33 ? -4.297 -49.871 -85.547 1.00 49.93 ? 33 PRO B CB 1 ATOM 2591 C CG . PRO B 2 33 ? -3.610 -50.399 -84.332 1.00 51.18 ? 33 PRO B CG 1 ATOM 2592 C CD . PRO B 2 33 ? -3.415 -51.854 -84.605 1.00 51.19 ? 33 PRO B CD 1 ATOM 2593 N N . HIS B 2 34 ? -1.392 -49.894 -86.946 1.00 52.90 ? 34 HIS B N 1 ATOM 2594 C CA . HIS B 2 34 ? -0.306 -49.098 -87.520 1.00 54.57 ? 34 HIS B CA 1 ATOM 2595 C C . HIS B 2 34 ? -0.096 -49.412 -88.995 1.00 54.02 ? 34 HIS B C 1 ATOM 2596 O O . HIS B 2 34 ? 0.178 -50.558 -89.364 1.00 54.29 ? 34 HIS B O 1 ATOM 2597 C CB . HIS B 2 34 ? 0.998 -49.298 -86.747 1.00 57.20 ? 34 HIS B CB 1 ATOM 2598 C CG . HIS B 2 34 ? 2.141 -48.488 -87.277 1.00 59.74 ? 34 HIS B CG 1 ATOM 2599 N ND1 . HIS B 2 34 ? 2.303 -47.150 -86.987 0.90 61.51 ? 34 HIS B ND1 1 ATOM 2600 C CD2 . HIS B 2 34 ? 3.174 -48.825 -88.087 0.90 61.71 ? 34 HIS B CD2 1 ATOM 2601 C CE1 . HIS B 2 34 ? 3.389 -46.699 -87.591 0.90 63.82 ? 34 HIS B CE1 1 ATOM 2602 N NE2 . HIS B 2 34 ? 3.937 -47.696 -88.264 0.90 63.74 ? 34 HIS B NE2 1 ATOM 2603 N N . ILE B 2 35 ? -0.219 -48.379 -89.827 1.00 53.72 ? 35 ILE B N 1 ATOM 2604 C CA . ILE B 2 35 ? -0.189 -48.530 -91.280 1.00 52.96 ? 35 ILE B CA 1 ATOM 2605 C C . ILE B 2 35 ? 0.300 -47.250 -91.977 1.00 53.80 ? 35 ILE B C 1 ATOM 2606 O O . ILE B 2 35 ? 0.060 -46.141 -91.497 1.00 54.32 ? 35 ILE B O 1 ATOM 2607 C CB . ILE B 2 35 ? -1.590 -48.968 -91.810 1.00 50.72 ? 35 ILE B CB 1 ATOM 2608 C CG1 . ILE B 2 35 ? -1.462 -49.789 -93.098 1.00 50.55 ? 35 ILE B CG1 1 ATOM 2609 C CG2 . ILE B 2 35 ? -2.537 -47.771 -91.965 1.00 49.70 ? 35 ILE B CG2 1 ATOM 2610 C CD1 . ILE B 2 35 ? -2.653 -50.695 -93.368 1.00 49.03 ? 35 ILE B CD1 1 ATOM 2611 N N . GLU B 2 36 ? 0.999 -47.412 -93.098 1.00 54.38 ? 36 GLU B N 1 ATOM 2612 C CA . GLU B 2 36 ? 1.411 -46.277 -93.924 1.00 55.29 ? 36 GLU B CA 1 ATOM 2613 C C . GLU B 2 36 ? 0.720 -46.351 -95.281 1.00 53.76 ? 36 GLU B C 1 ATOM 2614 O O . GLU B 2 36 ? 0.827 -47.358 -95.981 1.00 53.40 ? 36 GLU B O 1 ATOM 2615 C CB . GLU B 2 36 ? 2.933 -46.250 -94.096 1.00 57.92 ? 36 GLU B CB 1 ATOM 2616 N N . ILE B 2 37 ? -0.000 -45.290 -95.642 1.00 53.22 ? 37 ILE B N 1 ATOM 2617 C CA . ILE B 2 37 ? -0.763 -45.263 -96.894 1.00 51.87 ? 37 ILE B CA 1 ATOM 2618 C C . ILE B 2 37 ? -0.369 -44.086 -97.782 1.00 53.23 ? 37 ILE B C 1 ATOM 2619 O O . ILE B 2 37 ? -0.417 -42.932 -97.356 1.00 54.46 ? 37 ILE B O 1 ATOM 2620 C CB . ILE B 2 37 ? -2.289 -45.239 -96.637 1.00 49.89 ? 37 ILE B CB 1 ATOM 2621 C CG1 . ILE B 2 37 ? -2.722 -46.503 -95.894 1.00 48.78 ? 37 ILE B CG1 1 ATOM 2622 C CG2 . ILE B 2 37 ? -3.063 -45.106 -97.949 1.00 48.82 ? 37 ILE B CG2 1 ATOM 2623 C CD1 . ILE B 2 37 ? -4.062 -46.387 -95.230 1.00 47.84 ? 37 ILE B CD1 1 ATOM 2624 N N . GLN B 2 38 ? 0.018 -44.395 -99.017 1.00 53.47 ? 38 GLN B N 1 ATOM 2625 C CA . GLN B 2 38 ? 0.374 -43.385 -100.008 1.00 54.82 ? 38 GLN B CA 1 ATOM 2626 C C . GLN B 2 38 ? -0.493 -43.540 -101.247 1.00 53.30 ? 38 GLN B C 1 ATOM 2627 O O . GLN B 2 38 ? -0.725 -44.658 -101.714 1.00 52.20 ? 38 GLN B O 1 ATOM 2628 C CB . GLN B 2 38 ? 1.840 -43.525 -100.424 1.00 57.12 ? 38 GLN B CB 1 ATOM 2629 C CG . GLN B 2 38 ? 2.868 -43.180 -99.361 1.00 59.89 ? 38 GLN B CG 1 ATOM 2630 C CD . GLN B 2 38 ? 4.299 -43.402 -99.841 1.00 63.10 ? 38 GLN B CD 1 ATOM 2631 O OE1 . GLN B 2 38 ? 4.530 -43.933 -100.930 1.00 63.11 ? 38 GLN B OE1 1 ATOM 2632 N NE2 . GLN B 2 38 ? 5.266 -42.994 -99.025 1.00 65.81 ? 38 GLN B NE2 1 ATOM 2633 N N . MET B 2 39 ? -0.966 -42.415 -101.775 1.00 53.53 ? 39 MET B N 1 ATOM 2634 C CA . MET B 2 39 ? -1.614 -42.389 -103.082 1.00 52.71 ? 39 MET B CA 1 ATOM 2635 C C . MET B 2 39 ? -0.654 -41.772 -104.095 1.00 54.66 ? 39 MET B C 1 ATOM 2636 O O . MET B 2 39 ? -0.035 -40.738 -103.832 1.00 56.72 ? 39 MET B O 1 ATOM 2637 C CB . MET B 2 39 ? -2.937 -41.625 -103.029 1.00 51.97 ? 39 MET B CB 1 ATOM 2638 C CG . MET B 2 39 ? -3.986 -42.279 -102.141 1.00 50.62 ? 39 MET B CG 1 ATOM 2639 S SD . MET B 2 39 ? -5.559 -41.398 -102.104 1.00 51.15 ? 39 MET B SD 1 ATOM 2640 C CE . MET B 2 39 ? -6.317 -42.004 -103.609 1.00 49.98 ? 39 MET B CE 1 ATOM 2641 N N . LEU B 2 40 ? -0.527 -42.417 -105.250 1.00 54.33 ? 40 LEU B N 1 ATOM 2642 C CA . LEU B 2 40 ? 0.499 -42.053 -106.222 1.00 56.31 ? 40 LEU B CA 1 ATOM 2643 C C . LEU B 2 40 ? -0.078 -41.644 -107.569 1.00 56.31 ? 40 LEU B C 1 ATOM 2644 O O . LEU B 2 40 ? -1.026 -42.257 -108.063 1.00 54.60 ? 40 LEU B O 1 ATOM 2645 C CB . LEU B 2 40 ? 1.475 -43.215 -106.421 1.00 56.84 ? 40 LEU B CB 1 ATOM 2646 C CG . LEU B 2 40 ? 1.967 -43.983 -105.191 1.00 56.73 ? 40 LEU B CG 1 ATOM 2647 C CD1 . LEU B 2 40 ? 2.455 -45.362 -105.599 1.00 57.15 ? 40 LEU B CD1 1 ATOM 2648 C CD2 . LEU B 2 40 ? 3.049 -43.221 -104.431 1.00 59.00 ? 40 LEU B CD2 1 ATOM 2649 N N . LYS B 2 41 ? 0.501 -40.596 -108.150 1.00 58.57 ? 41 LYS B N 1 ATOM 2650 C CA . LYS B 2 41 ? 0.235 -40.224 -109.534 1.00 59.14 ? 41 LYS B CA 1 ATOM 2651 C C . LYS B 2 41 ? 1.527 -40.369 -110.327 1.00 61.38 ? 41 LYS B C 1 ATOM 2652 O O . LYS B 2 41 ? 2.514 -39.678 -110.054 1.00 63.79 ? 41 LYS B O 1 ATOM 2653 C CB . LYS B 2 41 ? -0.301 -38.794 -109.638 1.00 60.33 ? 41 LYS B CB 1 ATOM 2654 C CG . LYS B 2 41 ? -0.612 -38.361 -111.068 1.00 61.23 ? 41 LYS B CG 1 ATOM 2655 C CD . LYS B 2 41 ? -1.042 -36.908 -111.138 1.00 63.26 ? 41 LYS B CD 1 ATOM 2656 C CE . LYS B 2 41 ? -1.247 -36.475 -112.580 1.00 64.64 ? 41 LYS B CE 1 ATOM 2657 N NZ . LYS B 2 41 ? -1.445 -35.008 -112.701 1.00 67.55 ? 41 LYS B NZ 1 ATOM 2658 N N . ASN B 2 42 ? 1.505 -41.281 -111.298 1.00 60.88 ? 42 ASN B N 1 ATOM 2659 C CA . ASN B 2 42 ? 2.671 -41.613 -112.124 1.00 63.02 ? 42 ASN B CA 1 ATOM 2660 C C . ASN B 2 42 ? 3.869 -42.104 -111.309 1.00 64.50 ? 42 ASN B C 1 ATOM 2661 O O . ASN B 2 42 ? 5.023 -41.842 -111.655 1.00 67.23 ? 42 ASN B O 1 ATOM 2662 C CB . ASN B 2 42 ? 3.051 -40.438 -113.032 1.00 65.39 ? 42 ASN B CB 1 ATOM 2663 C CG . ASN B 2 42 ? 1.967 -40.106 -114.039 1.00 64.41 ? 42 ASN B CG 1 ATOM 2664 O OD1 . ASN B 2 42 ? 1.437 -40.987 -114.716 1.00 62.91 ? 42 ASN B OD1 1 ATOM 2665 N ND2 . ASN B 2 42 ? 1.633 -38.826 -114.145 1.00 65.70 ? 42 ASN B ND2 1 ATOM 2666 N N . GLY B 2 43 ? 3.576 -42.818 -110.223 1.00 62.93 ? 43 GLY B N 1 ATOM 2667 C CA . GLY B 2 43 ? 4.601 -43.373 -109.342 1.00 64.42 ? 43 GLY B CA 1 ATOM 2668 C C . GLY B 2 43 ? 5.078 -42.432 -108.249 1.00 65.89 ? 43 GLY B C 1 ATOM 2669 O O . GLY B 2 43 ? 5.709 -42.868 -107.285 1.00 66.49 ? 43 GLY B O 1 ATOM 2670 N N . LYS B 2 44 ? 4.780 -41.143 -108.403 1.00 66.86 ? 44 LYS B N 1 ATOM 2671 C CA . LYS B 2 44 ? 5.194 -40.118 -107.445 1.00 68.85 ? 44 LYS B CA 1 ATOM 2672 C C . LYS B 2 44 ? 4.106 -39.871 -106.404 1.00 66.84 ? 44 LYS B C 1 ATOM 2673 O O . LYS B 2 44 ? 2.915 -39.898 -106.722 1.00 64.63 ? 44 LYS B O 1 ATOM 2674 C CB . LYS B 2 44 ? 5.544 -38.812 -108.166 1.00 71.58 ? 44 LYS B CB 1 ATOM 2675 C CG . LYS B 2 44 ? 6.786 -38.889 -109.046 1.00 74.53 ? 44 LYS B CG 1 ATOM 2676 N N . LYS B 2 45 ? 4.530 -39.630 -105.166 1.00 68.02 ? 45 LYS B N 1 ATOM 2677 C CA . LYS B 2 45 ? 3.619 -39.404 -104.042 1.00 66.56 ? 45 LYS B CA 1 ATOM 2678 C C . LYS B 2 45 ? 2.784 -38.139 -104.246 1.00 67.09 ? 45 LYS B C 1 ATOM 2679 O O . LYS B 2 45 ? 3.317 -37.085 -104.605 1.00 70.04 ? 45 LYS B O 1 ATOM 2680 C CB . LYS B 2 45 ? 4.416 -39.312 -102.736 1.00 68.16 ? 45 LYS B CB 1 ATOM 2681 C CG . LYS B 2 45 ? 3.580 -39.376 -101.468 1.00 66.57 ? 45 LYS B CG 1 ATOM 2682 N N . ILE B 2 46 ? 1.475 -38.255 -104.033 1.00 64.69 ? 46 ILE B N 1 ATOM 2683 C CA . ILE B 2 46 ? 0.586 -37.096 -104.084 1.00 65.33 ? 46 ILE B CA 1 ATOM 2684 C C . ILE B 2 46 ? 0.633 -36.378 -102.729 1.00 66.87 ? 46 ILE B C 1 ATOM 2685 O O . ILE B 2 46 ? 0.322 -36.979 -101.697 1.00 65.28 ? 46 ILE B O 1 ATOM 2686 C CB . ILE B 2 46 ? -0.870 -37.484 -104.471 1.00 62.50 ? 46 ILE B CB 1 ATOM 2687 C CG1 . ILE B 2 46 ? -0.894 -38.206 -105.825 1.00 61.27 ? 46 ILE B CG1 1 ATOM 2688 C CG2 . ILE B 2 46 ? -1.768 -36.246 -104.516 1.00 63.59 ? 46 ILE B CG2 1 ATOM 2689 C CD1 . ILE B 2 46 ? -2.173 -38.980 -106.110 1.00 58.02 ? 46 ILE B CD1 1 ATOM 2690 N N . PRO B 2 47 ? 1.045 -35.095 -102.728 1.00 70.31 ? 47 PRO B N 1 ATOM 2691 C CA . PRO B 2 47 ? 1.219 -34.338 -101.482 1.00 72.51 ? 47 PRO B CA 1 ATOM 2692 C C . PRO B 2 47 ? -0.097 -34.014 -100.771 1.00 71.45 ? 47 PRO B C 1 ATOM 2693 O O . PRO B 2 47 ? -0.153 -34.051 -99.541 1.00 71.61 ? 47 PRO B O 1 ATOM 2694 C CB . PRO B 2 47 ? 1.909 -33.043 -101.942 1.00 76.67 ? 47 PRO B CB 1 ATOM 2695 C CG . PRO B 2 47 ? 2.399 -33.320 -103.331 1.00 76.65 ? 47 PRO B CG 1 ATOM 2696 C CD . PRO B 2 47 ? 1.442 -34.304 -103.905 1.00 72.62 ? 47 PRO B CD 1 ATOM 2697 N N . LYS B 2 48 ? -1.139 -33.700 -101.536 1.00 70.69 ? 48 LYS B N 1 ATOM 2698 C CA . LYS B 2 48 ? -2.429 -33.333 -100.959 1.00 70.19 ? 48 LYS B CA 1 ATOM 2699 C C . LYS B 2 48 ? -3.351 -34.548 -100.839 1.00 66.41 ? 48 LYS B C 1 ATOM 2700 O O . LYS B 2 48 ? -4.237 -34.760 -101.673 1.00 64.95 ? 48 LYS B O 1 ATOM 2701 C CB . LYS B 2 48 ? -3.091 -32.218 -101.776 1.00 72.19 ? 48 LYS B CB 1 ATOM 2702 N N . VAL B 2 49 ? -3.119 -35.350 -99.801 1.00 65.01 ? 49 VAL B N 1 ATOM 2703 C CA . VAL B 2 49 ? -3.938 -36.527 -99.525 1.00 61.65 ? 49 VAL B CA 1 ATOM 2704 C C . VAL B 2 49 ? -4.536 -36.413 -98.126 1.00 61.68 ? 49 VAL B C 1 ATOM 2705 O O . VAL B 2 49 ? -3.809 -36.321 -97.134 1.00 62.91 ? 49 VAL B O 1 ATOM 2706 C CB . VAL B 2 49 ? -3.132 -37.849 -99.679 1.00 59.96 ? 49 VAL B CB 1 ATOM 2707 C CG1 . VAL B 2 49 ? -3.894 -39.036 -99.095 1.00 57.14 ? 49 VAL B CG1 1 ATOM 2708 C CG2 . VAL B 2 49 ? -2.803 -38.109 -101.143 1.00 59.61 ? 49 VAL B CG2 1 ATOM 2709 N N . GLU B 2 50 ? -5.864 -36.397 -98.063 1.00 60.60 ? 50 GLU B N 1 ATOM 2710 C CA . GLU B 2 50 ? -6.582 -36.339 -96.796 1.00 60.57 ? 50 GLU B CA 1 ATOM 2711 C C . GLU B 2 50 ? -6.957 -37.741 -96.328 1.00 57.64 ? 50 GLU B C 1 ATOM 2712 O O . GLU B 2 50 ? -7.369 -38.585 -97.123 1.00 55.67 ? 50 GLU B O 1 ATOM 2713 C CB . GLU B 2 50 ? -7.827 -35.456 -96.917 1.00 61.76 ? 50 GLU B CB 1 ATOM 2714 N N . MET B 2 51 ? -6.808 -37.973 -95.030 1.00 57.77 ? 51 MET B N 1 ATOM 2715 C CA . MET B 2 51 ? -7.045 -39.276 -94.427 1.00 55.57 ? 51 MET B CA 1 ATOM 2716 C C . MET B 2 51 ? -8.179 -39.158 -93.413 1.00 55.56 ? 51 MET B C 1 ATOM 2717 O O . MET B 2 51 ? -8.242 -38.190 -92.652 1.00 57.56 ? 51 MET B O 1 ATOM 2718 C CB . MET B 2 51 ? -5.770 -39.751 -93.725 1.00 56.08 ? 51 MET B CB 1 ATOM 2719 C CG . MET B 2 51 ? -5.604 -41.256 -93.618 1.00 54.39 ? 51 MET B CG 1 ATOM 2720 S SD . MET B 2 51 ? -4.806 -41.998 -95.061 1.00 54.58 ? 51 MET B SD 1 ATOM 2721 C CE . MET B 2 51 ? -3.159 -41.291 -94.981 1.00 57.16 ? 51 MET B CE 1 ATOM 2722 N N . SER B 2 52 ? -9.075 -40.142 -93.412 1.00 53.48 ? 52 SER B N 1 ATOM 2723 C CA . SER B 2 52 ? -10.141 -40.214 -92.413 1.00 53.48 ? 52 SER B CA 1 ATOM 2724 C C . SER B 2 52 ? -9.611 -40.834 -91.122 1.00 53.34 ? 52 SER B C 1 ATOM 2725 O O . SER B 2 52 ? -8.512 -41.392 -91.098 1.00 52.88 ? 52 SER B O 1 ATOM 2726 C CB . SER B 2 52 ? -11.326 -41.034 -92.939 1.00 51.88 ? 52 SER B CB 1 ATOM 2727 O OG . SER B 2 52 ? -11.019 -42.419 -92.979 1.00 49.91 ? 52 SER B OG 1 ATOM 2728 N N . ASP B 2 53 ? -10.394 -40.733 -90.051 1.00 53.92 ? 53 ASP B N 1 ATOM 2729 C CA . ASP B 2 53 ? -10.052 -41.390 -88.796 1.00 53.81 ? 53 ASP B CA 1 ATOM 2730 C C . ASP B 2 53 ? -10.151 -42.909 -88.937 1.00 51.71 ? 53 ASP B C 1 ATOM 2731 O O . ASP B 2 53 ? -11.085 -43.428 -89.556 1.00 50.51 ? 53 ASP B O 1 ATOM 2732 C CB . ASP B 2 53 ? -10.963 -40.908 -87.669 1.00 55.21 ? 53 ASP B CB 1 ATOM 2733 C CG . ASP B 2 53 ? -10.842 -39.416 -87.411 1.00 58.04 ? 53 ASP B CG 1 ATOM 2734 O OD1 . ASP B 2 53 ? -9.727 -38.864 -87.533 1.00 59.18 ? 53 ASP B OD1 1 ATOM 2735 O OD2 . ASP B 2 53 ? -11.871 -38.793 -87.073 1.00 59.53 ? 53 ASP B OD2 1 ATOM 2736 N N . MET B 2 54 ? -9.176 -43.612 -88.370 1.00 51.50 ? 54 MET B N 1 ATOM 2737 C CA . MET B 2 54 ? -9.196 -45.065 -88.359 1.00 50.07 ? 54 MET B CA 1 ATOM 2738 C C . MET B 2 54 ? -10.261 -45.578 -87.401 1.00 50.05 ? 54 MET B C 1 ATOM 2739 O O . MET B 2 54 ? -10.459 -45.029 -86.313 1.00 51.43 ? 54 MET B O 1 ATOM 2740 C CB . MET B 2 54 ? -7.828 -45.643 -87.988 1.00 50.40 ? 54 MET B CB 1 ATOM 2741 C CG . MET B 2 54 ? -7.726 -47.148 -88.230 1.00 49.64 ? 54 MET B CG 1 ATOM 2742 S SD . MET B 2 54 ? -6.071 -47.824 -88.051 1.00 51.47 ? 54 MET B SD 1 ATOM 2743 C CE . MET B 2 54 ? -5.211 -47.010 -89.397 1.00 51.56 ? 54 MET B CE 1 ATOM 2744 N N . SER B 2 55 ? -10.942 -46.634 -87.828 1.00 48.84 ? 55 SER B N 1 ATOM 2745 C CA . SER B 2 55 ? -11.967 -47.290 -87.035 1.00 49.02 ? 55 SER B CA 1 ATOM 2746 C C . SER B 2 55 ? -11.837 -48.804 -87.216 1.00 48.13 ? 55 SER B C 1 ATOM 2747 O O . SER B 2 55 ? -10.912 -49.276 -87.887 1.00 47.50 ? 55 SER B O 1 ATOM 2748 C CB . SER B 2 55 ? -13.352 -46.801 -87.465 1.00 49.19 ? 55 SER B CB 1 ATOM 2749 O OG . SER B 2 55 ? -14.370 -47.384 -86.674 1.00 50.26 ? 55 SER B OG 1 ATOM 2750 N N . PHE B 2 56 ? -12.744 -49.559 -86.603 1.00 48.25 ? 56 PHE B N 1 ATOM 2751 C CA . PHE B 2 56 ? -12.785 -51.005 -86.791 1.00 47.93 ? 56 PHE B CA 1 ATOM 2752 C C . PHE B 2 56 ? -14.212 -51.540 -86.899 1.00 48.48 ? 56 PHE B C 1 ATOM 2753 O O . PHE B 2 56 ? -15.172 -50.852 -86.542 1.00 49.09 ? 56 PHE B O 1 ATOM 2754 C CB . PHE B 2 56 ? -11.970 -51.743 -85.718 1.00 48.57 ? 56 PHE B CB 1 ATOM 2755 C CG . PHE B 2 56 ? -12.359 -51.416 -84.305 1.00 48.90 ? 56 PHE B CG 1 ATOM 2756 C CD1 . PHE B 2 56 ? -13.339 -52.153 -83.652 1.00 49.03 ? 56 PHE B CD1 1 ATOM 2757 C CD2 . PHE B 2 56 ? -11.719 -50.393 -83.615 1.00 49.02 ? 56 PHE B CD2 1 ATOM 2758 C CE1 . PHE B 2 56 ? -13.691 -51.865 -82.343 1.00 49.97 ? 56 PHE B CE1 1 ATOM 2759 C CE2 . PHE B 2 56 ? -12.065 -50.097 -82.306 1.00 50.02 ? 56 PHE B CE2 1 ATOM 2760 C CZ . PHE B 2 56 ? -13.052 -50.836 -81.668 1.00 50.60 ? 56 PHE B CZ 1 ATOM 2761 N N . SER B 2 57 ? -14.342 -52.760 -87.413 1.00 48.68 ? 57 SER B N 1 ATOM 2762 C CA . SER B 2 57 ? -15.653 -53.357 -87.662 1.00 49.68 ? 57 SER B CA 1 ATOM 2763 C C . SER B 2 57 ? -15.993 -54.445 -86.648 1.00 51.06 ? 57 SER B C 1 ATOM 2764 O O . SER B 2 57 ? -15.248 -54.665 -85.691 1.00 51.56 ? 57 SER B O 1 ATOM 2765 C CB . SER B 2 57 ? -15.735 -53.901 -89.094 1.00 49.23 ? 57 SER B CB 1 ATOM 2766 O OG . SER B 2 57 ? -14.750 -54.893 -89.316 1.00 49.87 ? 57 SER B OG 1 ATOM 2767 N N . LYS B 2 58 ? -17.121 -55.119 -86.873 1.00 52.16 ? 58 LYS B N 1 ATOM 2768 C CA . LYS B 2 58 ? -17.654 -56.131 -85.951 1.00 53.89 ? 58 LYS B CA 1 ATOM 2769 C C . LYS B 2 58 ? -16.717 -57.311 -85.692 1.00 54.38 ? 58 LYS B C 1 ATOM 2770 O O . LYS B 2 58 ? -16.855 -57.995 -84.677 1.00 55.90 ? 58 LYS B O 1 ATOM 2771 C CB . LYS B 2 58 ? -19.012 -56.640 -86.446 1.00 55.28 ? 58 LYS B CB 1 ATOM 2772 C CG . LYS B 2 58 ? -20.167 -55.683 -86.187 1.00 56.15 ? 58 LYS B CG 1 ATOM 2773 N N . ASP B 2 59 ? -15.779 -57.549 -86.609 1.00 53.38 ? 59 ASP B N 1 ATOM 2774 C CA . ASP B 2 59 ? -14.785 -58.611 -86.443 1.00 54.19 ? 59 ASP B CA 1 ATOM 2775 C C . ASP B 2 59 ? -13.458 -58.075 -85.884 1.00 53.12 ? 59 ASP B C 1 ATOM 2776 O O . ASP B 2 59 ? -12.435 -58.765 -85.912 1.00 53.74 ? 59 ASP B O 1 ATOM 2777 C CB . ASP B 2 59 ? -14.581 -59.387 -87.757 1.00 54.56 ? 59 ASP B CB 1 ATOM 2778 C CG . ASP B 2 59 ? -13.824 -58.588 -88.813 1.00 53.43 ? 59 ASP B CG 1 ATOM 2779 O OD1 . ASP B 2 59 ? -13.843 -57.337 -88.761 1.00 52.92 ? 59 ASP B OD1 1 ATOM 2780 O OD2 . ASP B 2 59 ? -13.209 -59.219 -89.704 1.00 53.87 ? 59 ASP B OD2 1 ATOM 2781 N N . TRP B 2 60 ? -13.502 -56.840 -85.380 1.00 51.88 ? 60 TRP B N 1 ATOM 2782 C CA . TRP B 2 60 ? -12.359 -56.150 -84.744 1.00 51.22 ? 60 TRP B CA 1 ATOM 2783 C C . TRP B 2 60 ? -11.200 -55.789 -85.690 1.00 50.12 ? 60 TRP B C 1 ATOM 2784 O O . TRP B 2 60 ? -10.145 -55.333 -85.237 1.00 50.32 ? 60 TRP B O 1 ATOM 2785 C CB . TRP B 2 60 ? -11.838 -56.928 -83.524 1.00 52.60 ? 60 TRP B CB 1 ATOM 2786 C CG . TRP B 2 60 ? -12.894 -57.253 -82.510 1.00 53.47 ? 60 TRP B CG 1 ATOM 2787 C CD1 . TRP B 2 60 ? -13.584 -58.423 -82.396 1.00 54.59 ? 60 TRP B CD1 1 ATOM 2788 C CD2 . TRP B 2 60 ? -13.380 -56.397 -81.468 1.00 53.18 ? 60 TRP B CD2 1 ATOM 2789 N NE1 . TRP B 2 60 ? -14.468 -58.352 -81.348 1.00 55.44 ? 60 TRP B NE1 1 ATOM 2790 C CE2 . TRP B 2 60 ? -14.363 -57.120 -80.761 1.00 54.47 ? 60 TRP B CE2 1 ATOM 2791 C CE3 . TRP B 2 60 ? -13.076 -55.091 -81.061 1.00 52.36 ? 60 TRP B CE3 1 ATOM 2792 C CZ2 . TRP B 2 60 ? -15.048 -56.583 -79.667 1.00 55.19 ? 60 TRP B CZ2 1 ATOM 2793 C CZ3 . TRP B 2 60 ? -13.758 -54.557 -79.976 1.00 53.21 ? 60 TRP B CZ3 1 ATOM 2794 C CH2 . TRP B 2 60 ? -14.732 -55.303 -79.292 1.00 54.61 ? 60 TRP B CH2 1 ATOM 2795 N N . SER B 2 61 ? -11.398 -55.985 -86.992 1.00 49.14 ? 61 SER B N 1 ATOM 2796 C CA . SER B 2 61 ? -10.389 -55.621 -87.986 1.00 48.09 ? 61 SER B CA 1 ATOM 2797 C C . SER B 2 61 ? -10.498 -54.139 -88.330 1.00 46.62 ? 61 SER B C 1 ATOM 2798 O O . SER B 2 61 ? -11.599 -53.593 -88.407 1.00 46.23 ? 61 SER B O 1 ATOM 2799 C CB . SER B 2 61 ? -10.528 -56.479 -89.246 1.00 48.20 ? 61 SER B CB 1 ATOM 2800 O OG . SER B 2 61 ? -11.782 -56.270 -89.875 1.00 47.61 ? 61 SER B OG 1 ATOM 2801 N N . PHE B 2 62 ? -9.355 -53.499 -88.547 1.00 46.09 ? 62 PHE B N 1 ATOM 2802 C CA . PHE B 2 62 ? -9.310 -52.056 -88.752 1.00 45.30 ? 62 PHE B CA 1 ATOM 2803 C C . PHE B 2 62 ? -9.582 -51.638 -90.196 1.00 44.37 ? 62 PHE B C 1 ATOM 2804 O O . PHE B 2 62 ? -9.319 -52.396 -91.131 1.00 44.39 ? 62 PHE B O 1 ATOM 2805 C CB . PHE B 2 62 ? -7.969 -51.494 -88.273 1.00 45.75 ? 62 PHE B CB 1 ATOM 2806 C CG . PHE B 2 62 ? -7.743 -51.653 -86.797 1.00 46.72 ? 62 PHE B CG 1 ATOM 2807 C CD1 . PHE B 2 62 ? -7.008 -52.726 -86.304 1.00 47.38 ? 62 PHE B CD1 1 ATOM 2808 C CD2 . PHE B 2 62 ? -8.275 -50.734 -85.896 1.00 46.77 ? 62 PHE B CD2 1 ATOM 2809 C CE1 . PHE B 2 62 ? -6.804 -52.878 -84.938 1.00 48.59 ? 62 PHE B CE1 1 ATOM 2810 C CE2 . PHE B 2 62 ? -8.075 -50.880 -84.528 1.00 47.78 ? 62 PHE B CE2 1 ATOM 2811 C CZ . PHE B 2 62 ? -7.338 -51.952 -84.049 1.00 48.60 ? 62 PHE B CZ 1 ATOM 2812 N N . TYR B 2 63 ? -10.121 -50.432 -90.362 1.00 43.82 ? 63 TYR B N 1 ATOM 2813 C CA . TYR B 2 63 ? -10.333 -49.850 -91.683 1.00 43.08 ? 63 TYR B CA 1 ATOM 2814 C C . TYR B 2 63 ? -10.131 -48.332 -91.682 1.00 43.36 ? 63 TYR B C 1 ATOM 2815 O O . TYR B 2 63 ? -10.353 -47.660 -90.671 1.00 44.04 ? 63 TYR B O 1 ATOM 2816 C CB . TYR B 2 63 ? -11.717 -50.214 -92.225 1.00 42.68 ? 63 TYR B CB 1 ATOM 2817 C CG . TYR B 2 63 ? -12.875 -49.555 -91.508 1.00 43.36 ? 63 TYR B CG 1 ATOM 2818 C CD1 . TYR B 2 63 ? -13.354 -48.305 -91.915 1.00 43.76 ? 63 TYR B CD1 1 ATOM 2819 C CD2 . TYR B 2 63 ? -13.507 -50.186 -90.436 1.00 43.92 ? 63 TYR B CD2 1 ATOM 2820 C CE1 . TYR B 2 63 ? -14.424 -47.697 -91.264 1.00 44.57 ? 63 TYR B CE1 1 ATOM 2821 C CE2 . TYR B 2 63 ? -14.579 -49.586 -89.779 1.00 44.94 ? 63 TYR B CE2 1 ATOM 2822 C CZ . TYR B 2 63 ? -15.032 -48.343 -90.200 1.00 45.40 ? 63 TYR B CZ 1 ATOM 2823 O OH . TYR B 2 63 ? -16.093 -47.747 -89.556 1.00 47.04 ? 63 TYR B OH 1 ATOM 2824 N N . ILE B 2 64 ? -9.718 -47.801 -92.828 1.00 43.03 ? 64 ILE B N 1 ATOM 2825 C CA . ILE B 2 64 ? -9.432 -46.375 -92.971 1.00 43.53 ? 64 ILE B CA 1 ATOM 2826 C C . ILE B 2 64 ? -9.616 -45.939 -94.435 1.00 43.06 ? 64 ILE B C 1 ATOM 2827 O O . ILE B 2 64 ? -9.301 -46.696 -95.360 1.00 42.40 ? 64 ILE B O 1 ATOM 2828 C CB . ILE B 2 64 ? -8.010 -46.036 -92.417 1.00 44.42 ? 64 ILE B CB 1 ATOM 2829 C CG1 . ILE B 2 64 ? -7.770 -44.524 -92.359 1.00 46.01 ? 64 ILE B CG1 1 ATOM 2830 C CG2 . ILE B 2 64 ? -6.914 -46.769 -93.202 1.00 44.30 ? 64 ILE B CG2 1 ATOM 2831 C CD1 . ILE B 2 64 ? -6.684 -44.111 -91.365 1.00 47.57 ? 64 ILE B CD1 1 ATOM 2832 N N . LEU B 2 65 ? -10.159 -44.737 -94.634 1.00 43.56 ? 65 LEU B N 1 ATOM 2833 C CA . LEU B 2 65 ? -10.355 -44.188 -95.977 1.00 43.37 ? 65 LEU B CA 1 ATOM 2834 C C . LEU B 2 65 ? -9.396 -43.034 -96.256 1.00 44.58 ? 65 LEU B C 1 ATOM 2835 O O . LEU B 2 65 ? -9.287 -42.099 -95.460 1.00 46.02 ? 65 LEU B O 1 ATOM 2836 C CB . LEU B 2 65 ? -11.807 -43.739 -96.186 1.00 43.50 ? 65 LEU B CB 1 ATOM 2837 C CG . LEU B 2 65 ? -12.189 -43.146 -97.552 1.00 43.62 ? 65 LEU B CG 1 ATOM 2838 C CD1 . LEU B 2 65 ? -12.318 -44.226 -98.616 1.00 42.55 ? 65 LEU B CD1 1 ATOM 2839 C CD2 . LEU B 2 65 ? -13.479 -42.346 -97.462 1.00 44.54 ? 65 LEU B CD2 1 ATOM 2840 N N . ALA B 2 66 ? -8.696 -43.125 -97.384 1.00 44.40 ? 66 ALA B N 1 ATOM 2841 C CA . ALA B 2 66 ? -7.836 -42.051 -97.874 1.00 45.79 ? 66 ALA B CA 1 ATOM 2842 C C . ALA B 2 66 ? -8.421 -41.512 -99.168 1.00 46.10 ? 66 ALA B C 1 ATOM 2843 O O . ALA B 2 66 ? -8.877 -42.282 -100.021 1.00 44.86 ? 66 ALA B O 1 ATOM 2844 C CB . ALA B 2 66 ? -6.430 -42.562 -98.108 1.00 45.82 ? 66 ALA B CB 1 ATOM 2845 N N . HIS B 2 67 ? -8.417 -40.192 -99.316 1.00 47.99 ? 67 HIS B N 1 ATOM 2846 C CA . HIS B 2 67 ? -8.957 -39.570 -100.522 1.00 48.78 ? 67 HIS B CA 1 ATOM 2847 C C . HIS B 2 67 ? -8.166 -38.346 -100.965 1.00 51.05 ? 67 HIS B C 1 ATOM 2848 O O . HIS B 2 67 ? -7.632 -37.600 -100.140 1.00 52.66 ? 67 HIS B O 1 ATOM 2849 C CB . HIS B 2 67 ? -10.437 -39.216 -100.340 1.00 48.99 ? 67 HIS B CB 1 ATOM 2850 C CG . HIS B 2 67 ? -10.679 -38.136 -99.333 1.00 51.22 ? 67 HIS B CG 1 ATOM 2851 N ND1 . HIS B 2 67 ? -10.674 -38.371 -97.975 1.00 51.25 ? 67 HIS B ND1 1 ATOM 2852 C CD2 . HIS B 2 67 ? -10.931 -36.814 -99.487 1.00 53.75 ? 67 HIS B CD2 1 ATOM 2853 C CE1 . HIS B 2 67 ? -10.914 -37.240 -97.336 1.00 53.75 ? 67 HIS B CE1 1 ATOM 2854 N NE2 . HIS B 2 67 ? -11.076 -36.281 -98.229 1.00 55.37 ? 67 HIS B NE2 1 ATOM 2855 N N . THR B 2 68 ? -8.103 -38.152 -102.279 1.00 51.44 ? 68 THR B N 1 ATOM 2856 C CA . THR B 2 68 ? -7.457 -36.983 -102.860 1.00 53.88 ? 68 THR B CA 1 ATOM 2857 C C . THR B 2 68 ? -8.200 -36.481 -104.096 1.00 54.59 ? 68 THR B C 1 ATOM 2858 O O . THR B 2 68 ? -8.845 -37.257 -104.810 1.00 53.04 ? 68 THR B O 1 ATOM 2859 C CB . THR B 2 68 ? -5.965 -37.250 -103.203 1.00 54.31 ? 68 THR B CB 1 ATOM 2860 O OG1 . THR B 2 68 ? -5.349 -36.032 -103.643 1.00 57.34 ? 68 THR B OG1 1 ATOM 2861 C CG2 . THR B 2 68 ? -5.819 -38.311 -104.292 1.00 52.33 ? 68 THR B CG2 1 ATOM 2862 N N . GLU B 2 69 ? -8.102 -35.175 -104.329 1.00 57.29 ? 69 GLU B N 1 ATOM 2863 C CA . GLU B 2 69 ? -8.624 -34.544 -105.533 1.00 58.57 ? 69 GLU B CA 1 ATOM 2864 C C . GLU B 2 69 ? -7.736 -34.929 -106.722 1.00 58.22 ? 69 GLU B C 1 ATOM 2865 O O . GLU B 2 69 ? -6.510 -34.810 -106.648 1.00 59.17 ? 69 GLU B O 1 ATOM 2866 C CB . GLU B 2 69 ? -8.644 -33.025 -105.336 1.00 62.06 ? 69 GLU B CB 1 ATOM 2867 C CG . GLU B 2 69 ? -9.658 -32.266 -106.187 1.00 64.22 ? 69 GLU B CG 1 ATOM 2868 C CD . GLU B 2 69 ? -9.723 -30.777 -105.846 0.70 68.31 ? 69 GLU B CD 1 ATOM 2869 O OE1 . GLU B 2 69 ? -9.465 -30.409 -104.679 0.70 69.20 ? 69 GLU B OE1 1 ATOM 2870 O OE2 . GLU B 2 69 ? -10.039 -29.972 -106.749 0.70 70.56 ? 69 GLU B OE2 1 ATOM 2871 N N . PHE B 2 70 ? -8.349 -35.413 -107.803 1.00 57.15 ? 70 PHE B N 1 ATOM 2872 C CA . PHE B 2 70 ? -7.600 -35.836 -108.995 1.00 56.96 ? 70 PHE B CA 1 ATOM 2873 C C . PHE B 2 70 ? -8.361 -35.604 -110.304 1.00 57.47 ? 70 PHE B C 1 ATOM 2874 O O . PHE B 2 70 ? -9.563 -35.333 -110.296 1.00 57.69 ? 70 PHE B O 1 ATOM 2875 C CB . PHE B 2 70 ? -7.151 -37.305 -108.868 1.00 54.57 ? 70 PHE B CB 1 ATOM 2876 C CG . PHE B 2 70 ? -8.141 -38.315 -109.409 1.00 52.67 ? 70 PHE B CG 1 ATOM 2877 C CD1 . PHE B 2 70 ? -9.440 -38.395 -108.909 1.00 51.91 ? 70 PHE B CD1 1 ATOM 2878 C CD2 . PHE B 2 70 ? -7.756 -39.207 -110.404 1.00 51.93 ? 70 PHE B CD2 1 ATOM 2879 C CE1 . PHE B 2 70 ? -10.341 -39.334 -109.409 1.00 50.45 ? 70 PHE B CE1 1 ATOM 2880 C CE2 . PHE B 2 70 ? -8.650 -40.151 -110.904 1.00 50.68 ? 70 PHE B CE2 1 ATOM 2881 C CZ . PHE B 2 70 ? -9.945 -40.214 -110.405 1.00 49.85 ? 70 PHE B CZ 1 ATOM 2882 N N . THR B 2 71 ? -7.644 -35.714 -111.420 1.00 57.92 ? 71 THR B N 1 ATOM 2883 C CA . THR B 2 71 ? -8.231 -35.603 -112.753 1.00 58.35 ? 71 THR B CA 1 ATOM 2884 C C . THR B 2 71 ? -7.834 -36.817 -113.606 1.00 56.79 ? 71 THR B C 1 ATOM 2885 O O . THR B 2 71 ? -6.658 -36.977 -113.956 1.00 57.39 ? 71 THR B O 1 ATOM 2886 C CB . THR B 2 71 ? -7.804 -34.288 -113.446 1.00 61.47 ? 71 THR B CB 1 ATOM 2887 O OG1 . THR B 2 71 ? -8.218 -33.175 -112.647 1.00 63.50 ? 71 THR B OG1 1 ATOM 2888 C CG2 . THR B 2 71 ? -8.429 -34.164 -114.828 1.00 62.13 ? 71 THR B CG2 1 ATOM 2889 N N . PRO B 2 72 ? -8.812 -37.684 -113.935 1.00 55.06 ? 72 PRO B N 1 ATOM 2890 C CA . PRO B 2 72 ? -8.502 -38.855 -114.750 1.00 53.89 ? 72 PRO B CA 1 ATOM 2891 C C . PRO B 2 72 ? -8.200 -38.461 -116.189 1.00 55.55 ? 72 PRO B C 1 ATOM 2892 O O . PRO B 2 72 ? -8.818 -37.537 -116.718 1.00 57.07 ? 72 PRO B O 1 ATOM 2893 C CB . PRO B 2 72 ? -9.790 -39.692 -114.691 1.00 52.34 ? 72 PRO B CB 1 ATOM 2894 C CG . PRO B 2 72 ? -10.694 -39.016 -113.709 1.00 52.39 ? 72 PRO B CG 1 ATOM 2895 C CD . PRO B 2 72 ? -10.248 -37.599 -113.618 1.00 54.61 ? 72 PRO B CD 1 ATOM 2896 N N . THR B 2 73 ? -7.233 -39.144 -116.797 1.00 55.63 ? 73 THR B N 1 ATOM 2897 C CA . THR B 2 73 ? -6.925 -38.977 -118.219 1.00 57.29 ? 73 THR B CA 1 ATOM 2898 C C . THR B 2 73 ? -6.799 -40.347 -118.888 1.00 56.45 ? 73 THR B C 1 ATOM 2899 O O . THR B 2 73 ? -7.039 -41.379 -118.254 1.00 54.70 ? 73 THR B O 1 ATOM 2900 C CB . THR B 2 73 ? -5.625 -38.158 -118.458 1.00 59.43 ? 73 THR B CB 1 ATOM 2901 O OG1 . THR B 2 73 ? -4.535 -38.768 -117.761 1.00 58.76 ? 73 THR B OG1 1 ATOM 2902 C CG2 . THR B 2 73 ? -5.784 -36.710 -118.002 1.00 60.93 ? 73 THR B CG2 1 ATOM 2903 N N . GLU B 2 74 ? -6.430 -40.351 -120.167 1.00 57.96 ? 74 GLU B N 1 ATOM 2904 C CA . GLU B 2 74 ? -6.242 -41.593 -120.914 1.00 57.86 ? 74 GLU B CA 1 ATOM 2905 C C . GLU B 2 74 ? -4.952 -42.308 -120.513 1.00 58.06 ? 74 GLU B C 1 ATOM 2906 O O . GLU B 2 74 ? -4.862 -43.533 -120.618 1.00 57.50 ? 74 GLU B O 1 ATOM 2907 C CB . GLU B 2 74 ? -6.231 -41.325 -122.424 1.00 59.71 ? 74 GLU B CB 1 ATOM 2908 C CG . GLU B 2 74 ? -7.554 -40.814 -122.994 1.00 60.14 ? 74 GLU B CG 1 ATOM 2909 C CD . GLU B 2 74 ? -7.593 -40.796 -124.519 0.70 62.02 ? 74 GLU B CD 1 ATOM 2910 O OE1 . GLU B 2 74 ? -6.520 -40.844 -125.160 0.70 63.75 ? 74 GLU B OE1 1 ATOM 2911 O OE2 . GLU B 2 74 ? -8.706 -40.728 -125.082 0.70 62.05 ? 74 GLU B OE2 1 ATOM 2912 N N . THR B 2 75 ? -3.968 -41.540 -120.042 1.00 59.21 ? 75 THR B N 1 ATOM 2913 C CA . THR B 2 75 ? -2.599 -42.043 -119.860 1.00 60.15 ? 75 THR B CA 1 ATOM 2914 C C . THR B 2 75 ? -2.034 -41.954 -118.436 1.00 59.55 ? 75 THR B C 1 ATOM 2915 O O . THR B 2 75 ? -1.161 -42.751 -118.077 1.00 59.85 ? 75 THR B O 1 ATOM 2916 C CB . THR B 2 75 ? -1.608 -41.358 -120.837 1.00 62.94 ? 75 THR B CB 1 ATOM 2917 O OG1 . THR B 2 75 ? -1.831 -39.942 -120.837 1.00 64.03 ? 75 THR B OG1 1 ATOM 2918 C CG2 . THR B 2 75 ? -1.783 -41.897 -122.255 1.00 63.82 ? 75 THR B CG2 1 ATOM 2919 N N . ASP B 2 76 ? -2.513 -40.995 -117.638 1.00 59.00 ? 76 ASP B N 1 ATOM 2920 C CA . ASP B 2 76 ? -2.044 -40.828 -116.255 1.00 58.38 ? 76 ASP B CA 1 ATOM 2921 C C . ASP B 2 76 ? -2.473 -42.000 -115.377 1.00 56.00 ? 76 ASP B C 1 ATOM 2922 O O . ASP B 2 76 ? -3.655 -42.328 -115.305 1.00 54.36 ? 76 ASP B O 1 ATOM 2923 C CB . ASP B 2 76 ? -2.557 -39.517 -115.646 1.00 58.73 ? 76 ASP B CB 1 ATOM 2924 C CG . ASP B 2 76 ? -1.816 -38.295 -116.159 1.00 61.81 ? 76 ASP B CG 1 ATOM 2925 O OD1 . ASP B 2 76 ? -0.581 -38.210 -115.975 1.00 63.55 ? 76 ASP B OD1 1 ATOM 2926 O OD2 . ASP B 2 76 ? -2.478 -37.401 -116.728 1.00 63.00 ? 76 ASP B OD2 1 ATOM 2927 N N . THR B 2 77 ? -1.507 -42.628 -114.715 1.00 56.18 ? 77 THR B N 1 ATOM 2928 C CA . THR B 2 77 ? -1.795 -43.758 -113.833 1.00 54.49 ? 77 THR B CA 1 ATOM 2929 C C . THR B 2 77 ? -1.986 -43.288 -112.399 1.00 53.60 ? 77 THR B C 1 ATOM 2930 O O . THR B 2 77 ? -1.321 -42.351 -111.948 1.00 54.92 ? 77 THR B O 1 ATOM 2931 C CB . THR B 2 77 ? -0.674 -44.827 -113.854 1.00 55.43 ? 77 THR B CB 1 ATOM 2932 O OG1 . THR B 2 77 ? 0.485 -44.331 -113.172 1.00 56.93 ? 77 THR B OG1 1 ATOM 2933 C CG2 . THR B 2 77 ? -0.307 -45.213 -115.281 1.00 57.00 ? 77 THR B CG2 1 ATOM 2934 N N . TYR B 2 78 ? -2.896 -43.951 -111.691 1.00 51.63 ? 78 TYR B N 1 ATOM 2935 C CA . TYR B 2 78 ? -3.132 -43.688 -110.281 1.00 50.65 ? 78 TYR B CA 1 ATOM 2936 C C . TYR B 2 78 ? -3.094 -44.982 -109.481 1.00 49.65 ? 78 TYR B C 1 ATOM 2937 O O . TYR B 2 78 ? -3.619 -46.010 -109.916 1.00 48.80 ? 78 TYR B O 1 ATOM 2938 C CB . TYR B 2 78 ? -4.465 -42.971 -110.087 1.00 49.69 ? 78 TYR B CB 1 ATOM 2939 C CG . TYR B 2 78 ? -4.445 -41.537 -110.552 1.00 51.19 ? 78 TYR B CG 1 ATOM 2940 C CD1 . TYR B 2 78 ? -4.845 -41.196 -111.843 1.00 51.85 ? 78 TYR B CD1 1 ATOM 2941 C CD2 . TYR B 2 78 ? -4.016 -40.516 -109.701 1.00 52.31 ? 78 TYR B CD2 1 ATOM 2942 C CE1 . TYR B 2 78 ? -4.822 -39.872 -112.277 1.00 53.60 ? 78 TYR B CE1 1 ATOM 2943 C CE2 . TYR B 2 78 ? -3.991 -39.193 -110.124 1.00 54.24 ? 78 TYR B CE2 1 ATOM 2944 C CZ . TYR B 2 78 ? -4.395 -38.879 -111.412 1.00 54.88 ? 78 TYR B CZ 1 ATOM 2945 O OH . TYR B 2 78 ? -4.371 -37.571 -111.831 1.00 57.29 ? 78 TYR B OH 1 ATOM 2946 N N . ALA B 2 79 ? -2.463 -44.922 -108.311 1.00 49.90 ? 79 ALA B N 1 ATOM 2947 C CA . ALA B 2 79 ? -2.265 -46.102 -107.475 1.00 49.28 ? 79 ALA B CA 1 ATOM 2948 C C . ALA B 2 79 ? -2.330 -45.774 -105.988 1.00 48.82 ? 79 ALA B C 1 ATOM 2949 O O . ALA B 2 79 ? -2.133 -44.628 -105.580 1.00 49.38 ? 79 ALA B O 1 ATOM 2950 C CB . ALA B 2 79 ? -0.932 -46.765 -107.810 1.00 50.86 ? 79 ALA B CB 1 ATOM 2951 N N . CYS B 2 80 ? -2.610 -46.796 -105.187 1.00 48.06 ? 80 CYS B N 1 ATOM 2952 C CA . CYS B 2 80 ? -2.560 -46.686 -103.738 1.00 47.91 ? 80 CYS B CA 1 ATOM 2953 C C . CYS B 2 80 ? -1.549 -47.698 -103.206 1.00 48.77 ? 80 CYS B C 1 ATOM 2954 O O . CYS B 2 80 ? -1.646 -48.892 -103.495 1.00 48.62 ? 80 CYS B O 1 ATOM 2955 C CB . CYS B 2 80 ? -3.942 -46.933 -103.139 1.00 46.30 ? 80 CYS B CB 1 ATOM 2956 S SG . CYS B 2 80 ? -4.056 -46.567 -101.387 1.00 46.81 ? 80 CYS B SG 1 ATOM 2957 N N . ARG B 2 81 ? -0.568 -47.207 -102.452 1.00 50.09 ? 81 ARG B N 1 ATOM 2958 C CA . ARG B 2 81 ? 0.492 -48.048 -101.898 1.00 51.37 ? 81 ARG B CA 1 ATOM 2959 C C . ARG B 2 81 ? 0.384 -48.108 -100.378 1.00 51.10 ? 81 ARG B C 1 ATOM 2960 O O . ARG B 2 81 ? 0.316 -47.076 -99.705 1.00 51.14 ? 81 ARG B O 1 ATOM 2961 C CB . ARG B 2 81 ? 1.874 -47.543 -102.330 1.00 53.74 ? 81 ARG B CB 1 ATOM 2962 C CG . ARG B 2 81 ? 3.043 -48.412 -101.865 1.00 55.85 ? 81 ARG B CG 1 ATOM 2963 C CD . ARG B 2 81 ? 4.376 -47.874 -102.367 1.00 59.18 ? 81 ARG B CD 1 ATOM 2964 N NE . ARG B 2 81 ? 4.573 -48.142 -103.791 0.70 60.49 ? 81 ARG B NE 1 ATOM 2965 C CZ . ARG B 2 81 ? 5.553 -47.630 -104.531 0.70 62.96 ? 81 ARG B CZ 1 ATOM 2966 N NH1 . ARG B 2 81 ? 6.444 -46.805 -103.993 0.70 65.25 ? 81 ARG B NH1 1 ATOM 2967 N NH2 . ARG B 2 81 ? 5.641 -47.942 -105.817 0.70 63.37 ? 81 ARG B NH2 1 ATOM 2968 N N . VAL B 2 82 ? 0.370 -49.330 -99.850 1.00 51.07 ? 82 VAL B N 1 ATOM 2969 C CA . VAL B 2 82 ? 0.143 -49.565 -98.426 1.00 50.78 ? 82 VAL B CA 1 ATOM 2970 C C . VAL B 2 82 ? 1.295 -50.354 -97.803 1.00 52.70 ? 82 VAL B C 1 ATOM 2971 O O . VAL B 2 82 ? 1.666 -51.421 -98.296 1.00 53.72 ? 82 VAL B O 1 ATOM 2972 C CB . VAL B 2 82 ? -1.211 -50.292 -98.192 1.00 48.95 ? 82 VAL B CB 1 ATOM 2973 C CG1 . VAL B 2 82 ? -1.327 -50.789 -96.766 1.00 49.08 ? 82 VAL B CG1 1 ATOM 2974 C CG2 . VAL B 2 82 ? -2.378 -49.371 -98.525 1.00 47.32 ? 82 VAL B CG2 1 ATOM 2975 N N . LYS B 2 83 ? 1.853 -49.813 -96.722 1.00 53.63 ? 83 LYS B N 1 ATOM 2976 C CA . LYS B 2 83 ? 2.922 -50.464 -95.967 1.00 55.71 ? 83 LYS B CA 1 ATOM 2977 C C . LYS B 2 83 ? 2.373 -50.968 -94.632 1.00 55.07 ? 83 LYS B C 1 ATOM 2978 O O . LYS B 2 83 ? 1.817 -50.195 -93.846 1.00 54.28 ? 83 LYS B O 1 ATOM 2979 C CB . LYS B 2 83 ? 4.083 -49.489 -95.743 1.00 57.88 ? 83 LYS B CB 1 ATOM 2980 C CG . LYS B 2 83 ? 5.414 -50.148 -95.406 1.00 60.95 ? 83 LYS B CG 1 ATOM 2981 N N . HIS B 2 84 ? 2.519 -52.267 -94.389 1.00 55.76 ? 84 HIS B N 1 ATOM 2982 C CA . HIS B 2 84 ? 2.000 -52.904 -93.181 1.00 55.45 ? 84 HIS B CA 1 ATOM 2983 C C . HIS B 2 84 ? 2.925 -54.045 -92.760 1.00 58.04 ? 84 HIS B C 1 ATOM 2984 O O . HIS B 2 84 ? 3.649 -54.602 -93.589 1.00 59.73 ? 84 HIS B O 1 ATOM 2985 C CB . HIS B 2 84 ? 0.575 -53.416 -93.426 1.00 53.32 ? 84 HIS B CB 1 ATOM 2986 C CG . HIS B 2 84 ? -0.166 -53.790 -92.179 1.00 52.44 ? 84 HIS B CG 1 ATOM 2987 N ND1 . HIS B 2 84 ? -0.316 -55.096 -91.766 1.00 52.72 ? 84 HIS B ND1 1 ATOM 2988 C CD2 . HIS B 2 84 ? -0.805 -53.029 -91.258 1.00 51.17 ? 84 HIS B CD2 1 ATOM 2989 C CE1 . HIS B 2 84 ? -1.011 -55.124 -90.643 1.00 51.93 ? 84 HIS B CE1 1 ATOM 2990 N NE2 . HIS B 2 84 ? -1.319 -53.883 -90.312 1.00 50.73 ? 84 HIS B NE2 1 ATOM 2991 N N . ALA B 2 85 ? 2.898 -54.386 -91.473 1.00 58.71 ? 85 ALA B N 1 ATOM 2992 C CA . ALA B 2 85 ? 3.808 -55.390 -90.912 1.00 61.49 ? 85 ALA B CA 1 ATOM 2993 C C . ALA B 2 85 ? 3.494 -56.827 -91.344 1.00 62.11 ? 85 ALA B C 1 ATOM 2994 O O . ALA B 2 85 ? 4.364 -57.700 -91.276 1.00 64.84 ? 85 ALA B O 1 ATOM 2995 C CB . ALA B 2 85 ? 3.848 -55.282 -89.389 1.00 62.16 ? 85 ALA B CB 1 ATOM 2996 N N . SER B 2 86 ? 2.258 -57.062 -91.787 1.00 59.92 ? 86 SER B N 1 ATOM 2997 C CA . SER B 2 86 ? 1.830 -58.379 -92.272 1.00 60.73 ? 86 SER B CA 1 ATOM 2998 C C . SER B 2 86 ? 2.350 -58.684 -93.684 1.00 61.79 ? 86 SER B C 1 ATOM 2999 O O . SER B 2 86 ? 2.181 -59.796 -94.193 1.00 62.98 ? 86 SER B O 1 ATOM 3000 C CB . SER B 2 86 ? 0.305 -58.489 -92.236 1.00 58.41 ? 86 SER B CB 1 ATOM 3001 O OG . SER B 2 86 ? -0.290 -57.538 -93.101 1.00 56.30 ? 86 SER B OG 1 ATOM 3002 N N . MET B 2 87 ? 2.978 -57.686 -94.302 1.00 61.61 ? 87 MET B N 1 ATOM 3003 C CA . MET B 2 87 ? 3.574 -57.810 -95.629 1.00 62.89 ? 87 MET B CA 1 ATOM 3004 C C . MET B 2 87 ? 5.060 -57.464 -95.589 1.00 65.49 ? 87 MET B C 1 ATOM 3005 O O . MET B 2 87 ? 5.466 -56.524 -94.903 1.00 65.40 ? 87 MET B O 1 ATOM 3006 C CB . MET B 2 87 ? 2.861 -56.880 -96.610 1.00 60.37 ? 87 MET B CB 1 ATOM 3007 C CG . MET B 2 87 ? 1.676 -57.501 -97.329 1.00 59.22 ? 87 MET B CG 1 ATOM 3008 S SD . MET B 2 87 ? 0.302 -56.361 -97.629 1.00 56.48 ? 87 MET B SD 1 ATOM 3009 C CE . MET B 2 87 ? 1.123 -54.769 -97.755 1.00 56.02 ? 87 MET B CE 1 ATOM 3010 N N . ALA B 2 88 ? 5.864 -58.228 -96.327 1.00 68.24 ? 88 ALA B N 1 ATOM 3011 C CA . ALA B 2 88 ? 7.302 -57.980 -96.422 1.00 71.22 ? 88 ALA B CA 1 ATOM 3012 C C . ALA B 2 88 ? 7.578 -56.721 -97.241 1.00 70.32 ? 88 ALA B C 1 ATOM 3013 O O . ALA B 2 88 ? 8.329 -55.841 -96.812 1.00 71.21 ? 88 ALA B O 1 ATOM 3014 C CB . ALA B 2 88 ? 8.014 -59.186 -97.024 1.00 74.70 ? 88 ALA B CB 1 ATOM 3015 N N . GLU B 2 89 ? 6.960 -56.647 -98.418 1.00 68.81 ? 89 GLU B N 1 ATOM 3016 C CA . GLU B 2 89 ? 7.040 -55.474 -99.283 1.00 67.81 ? 89 GLU B CA 1 ATOM 3017 C C . GLU B 2 89 ? 5.697 -54.741 -99.294 1.00 64.02 ? 89 GLU B C 1 ATOM 3018 O O . GLU B 2 89 ? 4.656 -55.362 -99.065 1.00 62.38 ? 89 GLU B O 1 ATOM 3019 C CB . GLU B 2 89 ? 7.438 -55.881 -100.707 1.00 69.42 ? 89 GLU B CB 1 ATOM 3020 C CG . GLU B 2 89 ? 8.920 -56.174 -100.887 0.90 73.56 ? 89 GLU B CG 1 ATOM 3021 N N . PRO B 2 90 ? 5.714 -53.416 -99.545 1.00 63.04 ? 90 PRO B N 1 ATOM 3022 C CA . PRO B 2 90 ? 4.462 -52.659 -99.634 1.00 59.88 ? 90 PRO B CA 1 ATOM 3023 C C . PRO B 2 90 ? 3.606 -53.095 -100.823 1.00 58.58 ? 90 PRO B C 1 ATOM 3024 O O . PRO B 2 90 ? 4.145 -53.462 -101.867 1.00 60.04 ? 90 PRO B O 1 ATOM 3025 C CB . PRO B 2 90 ? 4.936 -51.211 -99.812 1.00 60.29 ? 90 PRO B CB 1 ATOM 3026 C CG . PRO B 2 90 ? 6.345 -51.320 -100.312 1.00 63.29 ? 90 PRO B CG 1 ATOM 3027 C CD . PRO B 2 90 ? 6.894 -52.537 -99.652 1.00 65.16 ? 90 PRO B CD 1 ATOM 3028 N N . LYS B 2 91 ? 2.285 -53.062 -100.650 1.00 56.11 ? 91 LYS B N 1 ATOM 3029 C CA . LYS B 2 91 ? 1.349 -53.484 -101.692 1.00 54.96 ? 91 LYS B CA 1 ATOM 3030 C C . LYS B 2 91 ? 0.827 -52.288 -102.473 1.00 53.38 ? 91 LYS B C 1 ATOM 3031 O O . LYS B 2 91 ? 0.337 -51.318 -101.892 1.00 52.01 ? 91 LYS B O 1 ATOM 3032 C CB . LYS B 2 91 ? 0.174 -54.275 -101.097 1.00 53.70 ? 91 LYS B CB 1 ATOM 3033 C CG . LYS B 2 91 ? -0.712 -54.974 -102.135 1.00 53.74 ? 91 LYS B CG 1 ATOM 3034 C CD . LYS B 2 91 ? -1.935 -55.645 -101.505 0.70 53.31 ? 91 LYS B CD 1 ATOM 3035 C CE . LYS B 2 91 ? -1.616 -57.039 -100.966 0.70 55.47 ? 91 LYS B CE 1 ATOM 3036 N NZ . LYS B 2 91 ? -2.797 -57.661 -100.299 0.70 54.63 ? 91 LYS B NZ 1 ATOM 3037 N N . THR B 2 92 ? 0.929 -52.380 -103.795 1.00 53.82 ? 92 THR B N 1 ATOM 3038 C CA . THR B 2 92 ? 0.455 -51.337 -104.693 1.00 52.61 ? 92 THR B CA 1 ATOM 3039 C C . THR B 2 92 ? -0.729 -51.844 -105.521 1.00 51.28 ? 92 THR B C 1 ATOM 3040 O O . THR B 2 92 ? -0.621 -52.846 -106.232 1.00 52.40 ? 92 THR B O 1 ATOM 3041 C CB . THR B 2 92 ? 1.592 -50.845 -105.623 1.00 54.64 ? 92 THR B CB 1 ATOM 3042 O OG1 . THR B 2 92 ? 2.760 -50.552 -104.843 1.00 56.21 ? 92 THR B OG1 1 ATOM 3043 C CG2 . THR B 2 92 ? 1.171 -49.600 -106.391 1.00 53.69 ? 92 THR B CG2 1 ATOM 3044 N N . VAL B 2 93 ? -1.859 -51.152 -105.405 1.00 49.20 ? 93 VAL B N 1 ATOM 3045 C CA . VAL B 2 93 ? -3.044 -51.444 -106.208 1.00 48.04 ? 93 VAL B CA 1 ATOM 3046 C C . VAL B 2 93 ? -3.398 -50.219 -107.049 1.00 47.38 ? 93 VAL B C 1 ATOM 3047 O O . VAL B 2 93 ? -3.661 -49.143 -106.513 1.00 46.62 ? 93 VAL B O 1 ATOM 3048 C CB . VAL B 2 93 ? -4.249 -51.874 -105.327 1.00 46.77 ? 93 VAL B CB 1 ATOM 3049 C CG1 . VAL B 2 93 ? -5.532 -51.959 -106.153 1.00 45.95 ? 93 VAL B CG1 1 ATOM 3050 C CG2 . VAL B 2 93 ? -3.967 -53.210 -104.641 1.00 47.38 ? 93 VAL B CG2 1 ATOM 3051 N N . TYR B 2 94 ? -3.387 -50.395 -108.367 1.00 48.02 ? 94 TYR B N 1 ATOM 3052 C CA . TYR B 2 94 ? -3.682 -49.319 -109.312 1.00 47.80 ? 94 TYR B CA 1 ATOM 3053 C C . TYR B 2 94 ? -5.181 -49.130 -109.516 1.00 46.57 ? 94 TYR B C 1 ATOM 3054 O O . TYR B 2 94 ? -5.956 -50.084 -109.437 1.00 46.23 ? 94 TYR B O 1 ATOM 3055 C CB . TYR B 2 94 ? -3.019 -49.595 -110.663 1.00 49.26 ? 94 TYR B CB 1 ATOM 3056 C CG . TYR B 2 94 ? -1.522 -49.386 -110.678 1.00 50.63 ? 94 TYR B CG 1 ATOM 3057 C CD1 . TYR B 2 94 ? -0.651 -50.397 -110.267 1.00 51.35 ? 94 TYR B CD1 1 ATOM 3058 C CD2 . TYR B 2 94 ? -0.972 -48.179 -111.117 1.00 50.70 ? 94 TYR B CD2 1 ATOM 3059 C CE1 . TYR B 2 94 ? 0.728 -50.209 -110.281 1.00 52.78 ? 94 TYR B CE1 1 ATOM 3060 C CE2 . TYR B 2 94 ? 0.406 -47.982 -111.134 1.00 52.14 ? 94 TYR B CE2 1 ATOM 3061 C CZ . TYR B 2 94 ? 1.247 -49.001 -110.715 1.00 53.09 ? 94 TYR B CZ 1 ATOM 3062 O OH . TYR B 2 94 ? 2.606 -48.816 -110.730 1.00 55.20 ? 94 TYR B OH 1 ATOM 3063 N N . TRP B 2 95 ? -5.575 -47.891 -109.786 1.00 46.38 ? 95 TRP B N 1 ATOM 3064 C CA . TRP B 2 95 ? -6.962 -47.563 -110.088 1.00 45.71 ? 95 TRP B CA 1 ATOM 3065 C C . TRP B 2 95 ? -7.375 -48.093 -111.457 1.00 46.28 ? 95 TRP B C 1 ATOM 3066 O O . TRP B 2 95 ? -6.794 -47.731 -112.483 1.00 47.23 ? 95 TRP B O 1 ATOM 3067 C CB . TRP B 2 95 ? -7.190 -46.049 -110.015 1.00 45.89 ? 95 TRP B CB 1 ATOM 3068 C CG . TRP B 2 95 ? -8.589 -45.616 -110.378 1.00 45.87 ? 95 TRP B CG 1 ATOM 3069 C CD1 . TRP B 2 95 ? -9.758 -46.049 -109.816 1.00 45.16 ? 95 TRP B CD1 1 ATOM 3070 C CD2 . TRP B 2 95 ? -8.957 -44.648 -111.369 1.00 47.04 ? 95 TRP B CD2 1 ATOM 3071 N NE1 . TRP B 2 95 ? -10.830 -45.417 -110.399 1.00 45.56 ? 95 TRP B NE1 1 ATOM 3072 C CE2 . TRP B 2 95 ? -10.368 -44.551 -111.355 1.00 46.73 ? 95 TRP B CE2 1 ATOM 3073 C CE3 . TRP B 2 95 ? -8.233 -43.854 -112.269 1.00 48.15 ? 95 TRP B CE3 1 ATOM 3074 C CZ2 . TRP B 2 95 ? -11.070 -43.694 -112.208 1.00 47.66 ? 95 TRP B CZ2 1 ATOM 3075 C CZ3 . TRP B 2 95 ? -8.933 -43.000 -113.117 1.00 49.12 ? 95 TRP B CZ3 1 ATOM 3076 C CH2 . TRP B 2 95 ? -10.337 -42.930 -113.080 1.00 48.71 ? 95 TRP B CH2 1 ATOM 3077 N N . ASP B 2 96 ? -8.379 -48.963 -111.445 1.00 45.93 ? 96 ASP B N 1 ATOM 3078 C CA . ASP B 2 96 ? -8.995 -49.484 -112.651 1.00 46.65 ? 96 ASP B CA 1 ATOM 3079 C C . ASP B 2 96 ? -10.445 -49.019 -112.647 1.00 46.16 ? 96 ASP B C 1 ATOM 3080 O O . ASP B 2 96 ? -11.253 -49.482 -111.838 1.00 45.81 ? 96 ASP B O 1 ATOM 3081 C CB . ASP B 2 96 ? -8.916 -51.014 -112.658 1.00 47.34 ? 96 ASP B CB 1 ATOM 3082 C CG . ASP B 2 96 ? -9.349 -51.632 -113.986 1.00 48.95 ? 96 ASP B CG 1 ATOM 3083 O OD1 . ASP B 2 96 ? -10.282 -51.117 -114.643 1.00 49.06 ? 96 ASP B OD1 1 ATOM 3084 O OD2 . ASP B 2 96 ? -8.756 -52.660 -114.365 1.00 50.41 ? 96 ASP B OD2 1 ATOM 3085 N N . ARG B 2 97 ? -10.763 -48.091 -113.547 1.00 46.57 ? 97 ARG B N 1 ATOM 3086 C CA . ARG B 2 97 ? -12.100 -47.497 -113.623 1.00 46.41 ? 97 ARG B CA 1 ATOM 3087 C C . ARG B 2 97 ? -13.181 -48.483 -114.078 1.00 47.10 ? 97 ARG B C 1 ATOM 3088 O O . ARG B 2 97 ? -14.360 -48.285 -113.790 1.00 47.18 ? 97 ARG B O 1 ATOM 3089 C CB . ARG B 2 97 ? -12.089 -46.252 -114.518 1.00 47.13 ? 97 ARG B CB 1 ATOM 3090 C CG . ARG B 2 97 ? -11.673 -46.501 -115.964 1.00 47.81 ? 97 ARG B CG 1 ATOM 3091 C CD . ARG B 2 97 ? -11.457 -45.202 -116.712 1.00 48.29 ? 97 ARG B CD 1 ATOM 3092 N NE . ARG B 2 97 ? -10.168 -44.594 -116.388 1.00 48.45 ? 97 ARG B NE 1 ATOM 3093 C CZ . ARG B 2 97 ? -9.707 -43.463 -116.918 1.00 49.26 ? 97 ARG B CZ 1 ATOM 3094 N NH1 . ARG B 2 97 ? -10.424 -42.791 -117.813 1.00 50.21 ? 97 ARG B NH1 1 ATOM 3095 N NH2 . ARG B 2 97 ? -8.519 -43.004 -116.551 1.00 49.40 ? 97 ARG B NH2 1 ATOM 3096 N N . ASP B 2 98 ? -12.770 -49.538 -114.779 1.00 48.06 ? 98 ASP B N 1 ATOM 3097 C CA . ASP B 2 98 ? -13.692 -50.561 -115.280 1.00 49.44 ? 98 ASP B CA 1 ATOM 3098 C C . ASP B 2 98 ? -14.102 -51.554 -114.193 1.00 49.26 ? 98 ASP B C 1 ATOM 3099 O O . ASP B 2 98 ? -15.209 -52.096 -114.227 1.00 50.04 ? 98 ASP B O 1 ATOM 3100 C CB . ASP B 2 98 ? -13.079 -51.303 -116.473 1.00 50.96 ? 98 ASP B CB 1 ATOM 3101 C CG . ASP B 2 98 ? -12.593 -50.359 -117.564 1.00 51.67 ? 98 ASP B CG 1 ATOM 3102 O OD1 . ASP B 2 98 ? -13.269 -49.341 -117.830 1.00 52.07 ? 98 ASP B OD1 1 ATOM 3103 O OD2 . ASP B 2 98 ? -11.532 -50.641 -118.159 1.00 52.77 ? 98 ASP B OD2 1 ATOM 3104 N N . MET B 2 99 ? -13.198 -51.792 -113.241 1.00 48.56 ? 99 MET B N 1 ATOM 3105 C CA . MET B 2 99 ? -13.495 -52.581 -112.047 1.00 48.36 ? 99 MET B CA 1 ATOM 3106 C C . MET B 2 99 ? -14.415 -51.778 -111.139 1.00 47.50 ? 99 MET B C 1 ATOM 3107 O O . MET B 2 99 ? -15.573 -52.138 -110.945 1.00 48.30 ? 99 MET B O 1 ATOM 3108 C CB . MET B 2 99 ? -12.211 -52.929 -111.287 1.00 47.88 ? 99 MET B CB 1 ATOM 3109 C CG . MET B 2 99 ? -11.265 -53.873 -112.017 0.70 49.42 ? 99 MET B CG 1 ATOM 3110 S SD . MET B 2 99 ? -11.838 -55.579 -112.050 0.70 51.56 ? 99 MET B SD 1 ATOM 3111 N N . THR C 3 1 ? 6.265 -31.736 -55.504 1.00 63.73 ? 1 THR C N 1 ATOM 3112 C CA . THR C 3 1 ? 5.498 -32.602 -54.561 1.00 59.74 ? 1 THR C CA 1 ATOM 3113 C C . THR C 3 1 ? 3.996 -32.405 -54.763 1.00 58.58 ? 1 THR C C 1 ATOM 3114 O O . THR C 3 1 ? 3.511 -31.274 -54.866 1.00 60.28 ? 1 THR C O 1 ATOM 3115 C CB . THR C 3 1 ? 5.886 -32.323 -53.088 1.00 58.62 ? 1 THR C CB 1 ATOM 3116 O OG1 . THR C 3 1 ? 7.308 -32.411 -52.945 1.00 60.55 ? 1 THR C OG1 1 ATOM 3117 C CG2 . THR C 3 1 ? 5.238 -33.332 -52.147 1.00 55.39 ? 1 THR C CG2 1 ATOM 3118 N N . GLN C 3 2 ? 3.271 -33.519 -54.816 1.00 56.09 ? 2 GLN C N 1 ATOM 3119 C CA . GLN C 3 2 ? 1.836 -33.512 -55.087 1.00 55.20 ? 2 GLN C CA 1 ATOM 3120 C C . GLN C 3 2 ? 0.976 -33.613 -53.822 1.00 52.62 ? 2 GLN C C 1 ATOM 3121 O O . GLN C 3 2 ? -0.251 -33.582 -53.898 1.00 52.22 ? 2 GLN C O 1 ATOM 3122 C CB . GLN C 3 2 ? 1.488 -34.629 -56.079 1.00 55.01 ? 2 GLN C CB 1 ATOM 3123 C CG . GLN C 3 2 ? 1.990 -34.369 -57.498 1.00 58.27 ? 2 GLN C CG 1 ATOM 3124 C CD . GLN C 3 2 ? 1.964 -35.605 -58.384 1.00 58.67 ? 2 GLN C CD 1 ATOM 3125 O OE1 . GLN C 3 2 ? 1.202 -36.545 -58.147 1.00 57.24 ? 2 GLN C OE1 1 ATOM 3126 N NE2 . GLN C 3 2 ? 2.802 -35.606 -59.415 1.00 61.10 ? 2 GLN C NE2 1 ATOM 3127 N N . VAL C 3 3 ? 1.624 -33.741 -52.666 1.00 51.21 ? 3 VAL C N 1 ATOM 3128 C CA . VAL C 3 3 ? 0.933 -33.756 -51.374 1.00 49.26 ? 3 VAL C CA 1 ATOM 3129 C C . VAL C 3 3 ? 1.655 -32.820 -50.408 1.00 49.70 ? 3 VAL C C 1 ATOM 3130 O O . VAL C 3 3 ? 2.776 -33.109 -49.983 1.00 49.72 ? 3 VAL C O 1 ATOM 3131 C CB . VAL C 3 3 ? 0.861 -35.182 -50.759 1.00 47.18 ? 3 VAL C CB 1 ATOM 3132 C CG1 . VAL C 3 3 ? 0.061 -35.168 -49.462 1.00 46.29 ? 3 VAL C CG1 1 ATOM 3133 C CG2 . VAL C 3 3 ? 0.250 -36.177 -51.739 1.00 46.87 ? 3 VAL C CG2 1 ATOM 3134 N N . GLU C 3 4 ? 1.014 -31.703 -50.070 1.00 50.45 ? 4 GLU C N 1 ATOM 3135 C CA . GLU C 3 4 ? 1.614 -30.706 -49.177 1.00 51.27 ? 4 GLU C CA 1 ATOM 3136 C C . GLU C 3 4 ? 0.876 -30.614 -47.848 1.00 49.77 ? 4 GLU C C 1 ATOM 3137 O O . GLU C 3 4 ? -0.355 -30.576 -47.816 1.00 49.65 ? 4 GLU C O 1 ATOM 3138 C CB . GLU C 3 4 ? 1.664 -29.324 -49.843 1.00 54.51 ? 4 GLU C CB 1 ATOM 3139 C CG . GLU C 3 4 ? 2.416 -29.268 -51.176 1.00 57.16 ? 4 GLU C CG 1 ATOM 3140 C CD . GLU C 3 4 ? 3.933 -29.241 -51.025 0.70 58.84 ? 4 GLU C CD 1 ATOM 3141 O OE1 . GLU C 3 4 ? 4.509 -30.192 -50.451 0.70 57.14 ? 4 GLU C OE1 1 ATOM 3142 O OE2 . GLU C 3 4 ? 4.555 -28.271 -51.506 0.70 62.44 ? 4 GLU C OE2 1 ATOM 3143 N N . GLN C 3 5 ? 1.641 -30.573 -46.758 1.00 48.98 ? 5 GLN C N 1 ATOM 3144 C CA . GLN C 3 5 ? 1.086 -30.486 -45.409 1.00 47.77 ? 5 GLN C CA 1 ATOM 3145 C C . GLN C 3 5 ? 1.516 -29.205 -44.702 1.00 49.78 ? 5 GLN C C 1 ATOM 3146 O O . GLN C 3 5 ? 2.643 -28.737 -44.866 1.00 51.39 ? 5 GLN C O 1 ATOM 3147 C CB . GLN C 3 5 ? 1.506 -31.697 -44.572 1.00 45.70 ? 5 GLN C CB 1 ATOM 3148 C CG . GLN C 3 5 ? 0.886 -33.016 -45.009 1.00 43.42 ? 5 GLN C CG 1 ATOM 3149 C CD . GLN C 3 5 ? 1.292 -34.188 -44.131 1.00 41.04 ? 5 GLN C CD 1 ATOM 3150 O OE1 . GLN C 3 5 ? 1.924 -35.130 -44.597 1.00 40.45 ? 5 GLN C OE1 1 ATOM 3151 N NE2 . GLN C 3 5 ? 0.926 -34.135 -42.856 1.00 40.81 ? 5 GLN C NE2 1 ATOM 3152 N N . SER C 3 6 ? 0.604 -28.643 -43.915 1.00 50.18 ? 6 SER C N 1 ATOM 3153 C CA . SER C 3 6 ? 0.887 -27.466 -43.105 1.00 52.17 ? 6 SER C CA 1 ATOM 3154 C C . SER C 3 6 ? 0.212 -27.607 -41.740 1.00 51.53 ? 6 SER C C 1 ATOM 3155 O O . SER C 3 6 ? -0.886 -28.164 -41.652 1.00 50.59 ? 6 SER C O 1 ATOM 3156 C CB . SER C 3 6 ? 0.425 -26.189 -43.813 1.00 55.06 ? 6 SER C CB 1 ATOM 3157 O OG . SER C 3 6 ? -0.956 -26.239 -44.119 1.00 55.28 ? 6 SER C OG 1 ATOM 3158 N N . PRO C 3 7 ? 0.867 -27.118 -40.667 1.00 52.33 ? 7 PRO C N 1 ATOM 3159 C CA . PRO C 3 7 ? 2.168 -26.448 -40.675 1.00 54.00 ? 7 PRO C CA 1 ATOM 3160 C C . PRO C 3 7 ? 3.318 -27.449 -40.757 1.00 52.68 ? 7 PRO C C 1 ATOM 3161 O O . PRO C 3 7 ? 3.081 -28.658 -40.757 1.00 50.37 ? 7 PRO C O 1 ATOM 3162 C CB . PRO C 3 7 ? 2.184 -25.715 -39.333 1.00 55.59 ? 7 PRO C CB 1 ATOM 3163 C CG . PRO C 3 7 ? 1.334 -26.547 -38.440 1.00 53.74 ? 7 PRO C CG 1 ATOM 3164 C CD . PRO C 3 7 ? 0.324 -27.251 -39.302 1.00 52.06 ? 7 PRO C CD 1 ATOM 3165 N N . GLN C 3 8 ? 4.548 -26.951 -40.843 1.00 54.61 ? 8 GLN C N 1 ATOM 3166 C CA . GLN C 3 8 ? 5.718 -27.822 -40.851 1.00 54.20 ? 8 GLN C CA 1 ATOM 3167 C C . GLN C 3 8 ? 5.771 -28.567 -39.516 1.00 52.98 ? 8 GLN C C 1 ATOM 3168 O O . GLN C 3 8 ? 5.898 -29.794 -39.480 1.00 51.19 ? 8 GLN C O 1 ATOM 3169 C CB . GLN C 3 8 ? 6.991 -27.008 -41.073 1.00 57.31 ? 8 GLN C CB 1 ATOM 3170 C CG . GLN C 3 8 ? 8.071 -27.729 -41.856 1.00 58.22 ? 8 GLN C CG 1 ATOM 3171 C CD . GLN C 3 8 ? 7.961 -27.504 -43.358 1.00 60.07 ? 8 GLN C CD 1 ATOM 3172 O OE1 . GLN C 3 8 ? 7.037 -27.997 -44.012 1.00 58.20 ? 8 GLN C OE1 1 ATOM 3173 N NE2 . GLN C 3 8 ? 8.916 -26.763 -43.913 1.00 63.53 ? 8 GLN C NE2 1 ATOM 3174 N N . SER C 3 9 ? 5.651 -27.811 -38.426 1.00 54.19 ? 9 SER C N 1 ATOM 3175 C CA . SER C 3 9 ? 5.529 -28.382 -37.090 1.00 53.54 ? 9 SER C CA 1 ATOM 3176 C C . SER C 3 9 ? 4.557 -27.572 -36.234 1.00 54.49 ? 9 SER C C 1 ATOM 3177 O O . SER C 3 9 ? 4.341 -26.380 -36.477 1.00 56.31 ? 9 SER C O 1 ATOM 3178 C CB . SER C 3 9 ? 6.897 -28.506 -36.409 1.00 55.04 ? 9 SER C CB 1 ATOM 3179 O OG . SER C 3 9 ? 7.461 -27.239 -36.141 1.00 57.66 ? 9 SER C OG 1 ATOM 3180 N N . LEU C 3 10 ? 3.972 -28.229 -35.235 1.00 53.68 ? 10 LEU C N 1 ATOM 3181 C CA . LEU C 3 10 ? 2.958 -27.609 -34.387 1.00 54.56 ? 10 LEU C CA 1 ATOM 3182 C C . LEU C 3 10 ? 3.197 -27.904 -32.908 1.00 55.48 ? 10 LEU C C 1 ATOM 3183 O O . LEU C 3 10 ? 3.293 -29.064 -32.502 1.00 54.46 ? 10 LEU C O 1 ATOM 3184 C CB . LEU C 3 10 ? 1.560 -28.077 -34.810 1.00 53.04 ? 10 LEU C CB 1 ATOM 3185 C CG . LEU C 3 10 ? 0.322 -27.559 -34.069 1.00 54.26 ? 10 LEU C CG 1 ATOM 3186 C CD1 . LEU C 3 10 ? 0.130 -26.050 -34.244 1.00 56.02 ? 10 LEU C CD1 1 ATOM 3187 C CD2 . LEU C 3 10 ? -0.908 -28.315 -34.547 1.00 52.71 ? 10 LEU C CD2 1 ATOM 3188 N N . VAL C 3 11 ? 3.294 -26.840 -32.117 1.00 57.85 ? 11 VAL C N 1 ATOM 3189 C CA . VAL C 3 11 ? 3.409 -26.948 -30.668 1.00 59.33 ? 11 VAL C CA 1 ATOM 3190 C C . VAL C 3 11 ? 2.046 -26.643 -30.045 1.00 60.13 ? 11 VAL C C 1 ATOM 3191 O O . VAL C 3 11 ? 1.484 -25.568 -30.271 1.00 61.66 ? 11 VAL C O 1 ATOM 3192 C CB . VAL C 3 11 ? 4.489 -25.976 -30.101 1.00 62.12 ? 11 VAL C CB 1 ATOM 3193 C CG1 . VAL C 3 11 ? 4.699 -26.197 -28.606 1.00 63.66 ? 11 VAL C CG1 1 ATOM 3194 C CG2 . VAL C 3 11 ? 5.812 -26.134 -30.844 1.00 62.23 ? 11 VAL C CG2 1 ATOM 3195 N N . VAL C 3 12 ? 1.513 -27.597 -29.283 1.00 59.66 ? 12 VAL C N 1 ATOM 3196 C CA . VAL C 3 12 ? 0.244 -27.404 -28.564 1.00 60.94 ? 12 VAL C CA 1 ATOM 3197 C C . VAL C 3 12 ? 0.340 -27.777 -27.086 1.00 62.70 ? 12 VAL C C 1 ATOM 3198 O O . VAL C 3 12 ? 1.080 -28.694 -26.709 1.00 62.16 ? 12 VAL C O 1 ATOM 3199 C CB . VAL C 3 12 ? -0.951 -28.175 -29.208 1.00 59.43 ? 12 VAL C CB 1 ATOM 3200 C CG1 . VAL C 3 12 ? -1.387 -27.512 -30.513 1.00 58.98 ? 12 VAL C CG1 1 ATOM 3201 C CG2 . VAL C 3 12 ? -0.624 -29.661 -29.410 1.00 57.33 ? 12 VAL C CG2 1 ATOM 3202 N N . ARG C 3 13 ? -0.418 -27.056 -26.261 1.00 65.04 ? 13 ARG C N 1 ATOM 3203 C CA . ARG C 3 13 ? -0.527 -27.355 -24.839 1.00 67.20 ? 13 ARG C CA 1 ATOM 3204 C C . ARG C 3 13 ? -1.374 -28.607 -24.637 1.00 66.61 ? 13 ARG C C 1 ATOM 3205 O O . ARG C 3 13 ? -2.461 -28.721 -25.204 1.00 66.04 ? 13 ARG C O 1 ATOM 3206 C CB . ARG C 3 13 ? -1.145 -26.176 -24.083 1.00 70.49 ? 13 ARG C CB 1 ATOM 3207 C CG . ARG C 3 13 ? -0.255 -24.944 -23.980 1.00 72.23 ? 13 ARG C CG 1 ATOM 3208 C CD . ARG C 3 13 ? -0.965 -23.807 -23.252 0.90 75.47 ? 13 ARG C CD 1 ATOM 3209 N N . GLN C 3 14 ? -0.860 -29.539 -23.837 1.00 67.21 ? 14 GLN C N 1 ATOM 3210 C CA . GLN C 3 14 ? -1.576 -30.756 -23.442 1.00 67.73 ? 14 GLN C CA 1 ATOM 3211 C C . GLN C 3 14 ? -3.030 -30.466 -23.061 1.00 69.81 ? 14 GLN C C 1 ATOM 3212 O O . GLN C 3 14 ? -3.301 -29.574 -22.256 1.00 72.34 ? 14 GLN C O 1 ATOM 3213 C CB . GLN C 3 14 ? -0.850 -31.425 -22.267 1.00 69.93 ? 14 GLN C CB 1 ATOM 3214 C CG . GLN C 3 14 ? -1.584 -32.609 -21.638 1.00 71.97 ? 14 GLN C CG 1 ATOM 3215 C CD . GLN C 3 14 ? -1.144 -32.889 -20.211 0.90 75.87 ? 14 GLN C CD 1 ATOM 3216 O OE1 . GLN C 3 14 ? -1.097 -31.989 -19.368 0.90 78.06 ? 14 GLN C OE1 1 ATOM 3217 N NE2 . GLN C 3 14 ? -0.830 -34.148 -19.929 0.90 77.09 ? 14 GLN C NE2 1 ATOM 3218 N N . GLY C 3 15 ? -3.955 -31.219 -23.651 1.00 69.00 ? 15 GLY C N 1 ATOM 3219 C CA . GLY C 3 15 ? -5.376 -31.093 -23.330 1.00 71.56 ? 15 GLY C CA 1 ATOM 3220 C C . GLY C 3 15 ? -6.171 -30.205 -24.269 1.00 70.85 ? 15 GLY C C 1 ATOM 3221 O O . GLY C 3 15 ? -7.398 -30.268 -24.294 1.00 72.64 ? 15 GLY C O 1 ATOM 3222 N N . GLU C 3 16 ? -5.473 -29.367 -25.031 1.00 68.87 ? 16 GLU C N 1 ATOM 3223 C CA . GLU C 3 16 ? -6.104 -28.533 -26.052 1.00 68.40 ? 16 GLU C CA 1 ATOM 3224 C C . GLU C 3 16 ? -6.239 -29.307 -27.364 1.00 65.33 ? 16 GLU C C 1 ATOM 3225 O O . GLU C 3 16 ? -5.727 -30.423 -27.485 1.00 63.47 ? 16 GLU C O 1 ATOM 3226 C CB . GLU C 3 16 ? -5.309 -27.240 -26.258 1.00 68.36 ? 16 GLU C CB 1 ATOM 3227 C CG . GLU C 3 16 ? -5.457 -26.232 -25.119 1.00 72.37 ? 16 GLU C CG 1 ATOM 3228 C CD . GLU C 3 16 ? -4.475 -25.072 -25.206 1.00 73.07 ? 16 GLU C CD 1 ATOM 3229 O OE1 . GLU C 3 16 ? -3.717 -24.989 -26.197 1.00 70.80 ? 16 GLU C OE1 1 ATOM 3230 O OE2 . GLU C 3 16 ? -4.461 -24.239 -24.272 1.00 76.26 ? 16 GLU C OE2 1 ATOM 3231 N N . ASN C 3 17 ? -6.940 -28.715 -28.331 1.00 65.24 ? 17 ASN C N 1 ATOM 3232 C CA . ASN C 3 17 ? -7.141 -29.324 -29.649 1.00 62.78 ? 17 ASN C CA 1 ATOM 3233 C C . ASN C 3 17 ? -6.080 -28.891 -30.651 1.00 60.32 ? 17 ASN C C 1 ATOM 3234 O O . ASN C 3 17 ? -5.662 -27.734 -30.659 1.00 61.33 ? 17 ASN C O 1 ATOM 3235 C CB . ASN C 3 17 ? -8.525 -28.976 -30.208 1.00 64.44 ? 17 ASN C CB 1 ATOM 3236 C CG . ASN C 3 17 ? -9.658 -29.432 -29.311 1.00 67.63 ? 17 ASN C CG 1 ATOM 3237 O OD1 . ASN C 3 17 ? -9.479 -30.283 -28.441 1.00 68.46 ? 17 ASN C OD1 1 ATOM 3238 N ND2 . ASN C 3 17 ? -10.839 -28.863 -29.521 1.00 70.33 ? 17 ASN C ND2 1 ATOM 3239 N N . SER C 3 18 ? -5.652 -29.824 -31.496 1.00 57.67 ? 18 SER C N 1 ATOM 3240 C CA . SER C 3 18 ? -4.701 -29.513 -32.558 1.00 55.73 ? 18 SER C CA 1 ATOM 3241 C C . SER C 3 18 ? -5.265 -29.839 -33.941 1.00 54.34 ? 18 SER C C 1 ATOM 3242 O O . SER C 3 18 ? -5.902 -30.876 -34.137 1.00 53.82 ? 18 SER C O 1 ATOM 3243 C CB . SER C 3 18 ? -3.354 -30.207 -32.320 1.00 54.18 ? 18 SER C CB 1 ATOM 3244 O OG . SER C 3 18 ? -3.525 -31.547 -31.897 1.00 54.35 ? 18 SER C OG 1 ATOM 3245 N N . VAL C 3 19 ? -5.022 -28.936 -34.889 1.00 54.22 ? 19 VAL C N 1 ATOM 3246 C CA . VAL C 3 19 ? -5.549 -29.036 -36.248 1.00 53.40 ? 19 VAL C CA 1 ATOM 3247 C C . VAL C 3 19 ? -4.400 -29.163 -37.254 1.00 51.50 ? 19 VAL C C 1 ATOM 3248 O O . VAL C 3 19 ? -3.460 -28.364 -37.237 1.00 51.92 ? 19 VAL C O 1 ATOM 3249 C CB . VAL C 3 19 ? -6.428 -27.799 -36.582 1.00 55.94 ? 19 VAL C CB 1 ATOM 3250 C CG1 . VAL C 3 19 ? -6.831 -27.778 -38.049 1.00 55.70 ? 19 VAL C CG1 1 ATOM 3251 C CG2 . VAL C 3 19 ? -7.662 -27.759 -35.694 1.00 58.15 ? 19 VAL C CG2 1 ATOM 3252 N N . LEU C 3 20 ? -4.481 -30.175 -38.119 1.00 49.88 ? 20 LEU C N 1 ATOM 3253 C CA . LEU C 3 20 ? -3.459 -30.429 -39.146 1.00 48.41 ? 20 LEU C CA 1 ATOM 3254 C C . LEU C 3 20 ? -4.063 -30.438 -40.551 1.00 48.30 ? 20 LEU C C 1 ATOM 3255 O O . LEU C 3 20 ? -5.117 -31.034 -40.778 1.00 48.41 ? 20 LEU C O 1 ATOM 3256 C CB . LEU C 3 20 ? -2.742 -31.757 -38.884 1.00 46.68 ? 20 LEU C CB 1 ATOM 3257 C CG . LEU C 3 20 ? -2.133 -32.004 -37.500 1.00 47.51 ? 20 LEU C CG 1 ATOM 3258 C CD1 . LEU C 3 20 ? -1.841 -33.481 -37.301 1.00 46.97 ? 20 LEU C CD1 1 ATOM 3259 C CD2 . LEU C 3 20 ? -0.875 -31.186 -37.294 1.00 48.16 ? 20 LEU C CD2 1 ATOM 3260 N N . GLN C 3 21 ? -3.378 -29.789 -41.489 1.00 48.57 ? 21 GLN C N 1 ATOM 3261 C CA . GLN C 3 21 ? -3.899 -29.603 -42.845 1.00 49.17 ? 21 GLN C CA 1 ATOM 3262 C C . GLN C 3 21 ? -3.214 -30.479 -43.894 1.00 47.45 ? 21 GLN C C 1 ATOM 3263 O O . GLN C 3 21 ? -2.056 -30.874 -43.736 1.00 46.41 ? 21 GLN C O 1 ATOM 3264 C CB . GLN C 3 21 ? -3.786 -28.132 -43.265 1.00 51.76 ? 21 GLN C CB 1 ATOM 3265 C CG . GLN C 3 21 ? -4.351 -27.130 -42.264 1.00 54.40 ? 21 GLN C CG 1 ATOM 3266 C CD . GLN C 3 21 ? -5.865 -27.134 -42.205 1.00 56.46 ? 21 GLN C CD 1 ATOM 3267 O OE1 . GLN C 3 21 ? -6.534 -27.796 -43.003 1.00 56.25 ? 21 GLN C OE1 1 ATOM 3268 N NE2 . GLN C 3 21 ? -6.417 -26.388 -41.255 1.00 58.73 ? 21 GLN C NE2 1 ATOM 3269 N N . CYS C 3 22 ? -3.949 -30.770 -44.965 1.00 47.50 ? 22 CYS C N 1 ATOM 3270 C CA . CYS C 3 22 ? -3.407 -31.456 -46.133 1.00 46.53 ? 22 CYS C CA 1 ATOM 3271 C C . CYS C 3 22 ? -3.976 -30.842 -47.410 1.00 48.05 ? 22 CYS C C 1 ATOM 3272 O O . CYS C 3 22 ? -5.183 -30.610 -47.510 1.00 49.29 ? 22 CYS C O 1 ATOM 3273 C CB . CYS C 3 22 ? -3.723 -32.950 -46.080 1.00 44.80 ? 22 CYS C CB 1 ATOM 3274 S SG . CYS C 3 22 ? -2.866 -33.931 -47.338 1.00 44.92 ? 22 CYS C SG 1 ATOM 3275 N N . ASN C 3 23 ? -3.099 -30.561 -48.371 1.00 48.34 ? 23 ASN C N 1 ATOM 3276 C CA . ASN C 3 23 ? -3.504 -30.073 -49.685 1.00 50.13 ? 23 ASN C CA 1 ATOM 3277 C C . ASN C 3 23 ? -2.763 -30.842 -50.761 1.00 49.41 ? 23 ASN C C 1 ATOM 3278 O O . ASN C 3 23 ? -1.536 -30.941 -50.722 1.00 49.20 ? 23 ASN C O 1 ATOM 3279 C CB . ASN C 3 23 ? -3.220 -28.578 -49.824 1.00 53.11 ? 23 ASN C CB 1 ATOM 3280 C CG . ASN C 3 23 ? -4.057 -27.734 -48.884 1.00 54.56 ? 23 ASN C CG 1 ATOM 3281 O OD1 . ASN C 3 23 ? -5.211 -27.419 -49.173 1.00 56.40 ? 23 ASN C OD1 1 ATOM 3282 N ND2 . ASN C 3 23 ? -3.473 -27.355 -47.753 1.00 54.11 ? 23 ASN C ND2 1 ATOM 3283 N N . TYR C 3 24 ? -3.508 -31.393 -51.714 1.00 49.42 ? 24 TYR C N 1 ATOM 3284 C CA . TYR C 3 24 ? -2.919 -32.239 -52.746 1.00 48.66 ? 24 TYR C CA 1 ATOM 3285 C C . TYR C 3 24 ? -3.379 -31.866 -54.155 1.00 51.04 ? 24 TYR C C 1 ATOM 3286 O O . TYR C 3 24 ? -4.385 -31.177 -54.322 1.00 52.88 ? 24 TYR C O 1 ATOM 3287 C CB . TYR C 3 24 ? -3.201 -33.718 -52.449 1.00 46.27 ? 24 TYR C CB 1 ATOM 3288 C CG . TYR C 3 24 ? -4.664 -34.105 -52.461 1.00 46.24 ? 24 TYR C CG 1 ATOM 3289 C CD1 . TYR C 3 24 ? -5.285 -34.519 -53.642 1.00 47.10 ? 24 TYR C CD1 1 ATOM 3290 C CD2 . TYR C 3 24 ? -5.425 -34.074 -51.293 1.00 45.43 ? 24 TYR C CD2 1 ATOM 3291 C CE1 . TYR C 3 24 ? -6.624 -34.880 -53.662 1.00 47.31 ? 24 TYR C CE1 1 ATOM 3292 C CE2 . TYR C 3 24 ? -6.770 -34.434 -51.303 1.00 46.12 ? 24 TYR C CE2 1 ATOM 3293 C CZ . TYR C 3 24 ? -7.361 -34.837 -52.493 1.00 47.25 ? 24 TYR C CZ 1 ATOM 3294 O OH . TYR C 3 24 ? -8.688 -35.196 -52.514 1.00 48.33 ? 24 TYR C OH 1 ATOM 3295 N N . SER C 3 25 ? -2.630 -32.324 -55.156 1.00 51.36 ? 25 SER C N 1 ATOM 3296 C CA . SER C 3 25 ? -2.980 -32.126 -56.562 1.00 53.83 ? 25 SER C CA 1 ATOM 3297 C C . SER C 3 25 ? -3.016 -33.451 -57.341 1.00 53.06 ? 25 SER C C 1 ATOM 3298 O O . SER C 3 25 ? -3.117 -33.459 -58.574 1.00 55.11 ? 25 SER C O 1 ATOM 3299 C CB . SER C 3 25 ? -2.016 -31.135 -57.219 1.00 56.58 ? 25 SER C CB 1 ATOM 3300 O OG . SER C 3 25 ? -0.674 -31.567 -57.095 1.00 55.30 ? 25 SER C OG 1 ATOM 3301 N N . VAL C 3 26 ? -2.943 -34.561 -56.606 1.00 50.41 ? 26 VAL C N 1 ATOM 3302 C CA . VAL C 3 26 ? -2.980 -35.914 -57.169 1.00 49.76 ? 26 VAL C CA 1 ATOM 3303 C C . VAL C 3 26 ? -4.253 -36.166 -57.987 1.00 51.26 ? 26 VAL C C 1 ATOM 3304 O O . VAL C 3 26 ? -5.359 -35.868 -57.540 1.00 51.61 ? 26 VAL C O 1 ATOM 3305 C CB . VAL C 3 26 ? -2.845 -36.981 -56.044 1.00 47.21 ? 26 VAL C CB 1 ATOM 3306 C CG1 . VAL C 3 26 ? -2.959 -38.406 -56.598 1.00 46.55 ? 26 VAL C CG1 1 ATOM 3307 C CG2 . VAL C 3 26 ? -1.534 -36.800 -55.292 1.00 46.10 ? 26 VAL C CG2 1 ATOM 3308 N N . THR C 3 27 ? -4.079 -36.711 -59.189 1.00 52.73 ? 27 THR C N 1 ATOM 3309 C CA . THR C 3 27 ? -5.187 -37.026 -60.086 1.00 54.58 ? 27 THR C CA 1 ATOM 3310 C C . THR C 3 27 ? -4.987 -38.422 -60.680 1.00 54.32 ? 27 THR C C 1 ATOM 3311 O O . THR C 3 27 ? -3.974 -38.675 -61.335 1.00 55.04 ? 27 THR C O 1 ATOM 3312 C CB . THR C 3 27 ? -5.297 -35.987 -61.228 1.00 57.96 ? 27 THR C CB 1 ATOM 3313 O OG1 . THR C 3 27 ? -5.267 -34.664 -60.680 1.00 59.15 ? 27 THR C OG1 1 ATOM 3314 C CG2 . THR C 3 27 ? -6.585 -36.173 -62.024 1.00 59.98 ? 27 THR C CG2 1 ATOM 3315 N N . PRO C 3 28 ? -5.948 -39.337 -60.454 1.00 53.91 ? 28 PRO C N 1 ATOM 3316 C CA . PRO C 3 28 ? -7.175 -39.121 -59.689 1.00 53.86 ? 28 PRO C CA 1 ATOM 3317 C C . PRO C 3 28 ? -6.966 -39.338 -58.192 1.00 51.53 ? 28 PRO C C 1 ATOM 3318 O O . PRO C 3 28 ? -5.964 -39.927 -57.785 1.00 50.09 ? 28 PRO C O 1 ATOM 3319 C CB . PRO C 3 28 ? -8.133 -40.174 -60.255 1.00 55.07 ? 28 PRO C CB 1 ATOM 3320 C CG . PRO C 3 28 ? -7.271 -41.164 -61.018 1.00 54.87 ? 28 PRO C CG 1 ATOM 3321 C CD . PRO C 3 28 ? -5.846 -40.724 -60.938 1.00 53.87 ? 28 PRO C CD 1 ATOM 3322 N N . ASP C 3 29 ? -7.899 -38.843 -57.384 1.00 51.66 ? 29 ASP C N 1 ATOM 3323 C CA . ASP C 3 29 ? -7.827 -38.997 -55.934 1.00 49.70 ? 29 ASP C CA 1 ATOM 3324 C C . ASP C 3 29 ? -8.874 -39.994 -55.441 1.00 50.00 ? 29 ASP C C 1 ATOM 3325 O O . ASP C 3 29 ? -10.037 -39.642 -55.217 1.00 51.40 ? 29 ASP C O 1 ATOM 3326 C CB . ASP C 3 29 ? -7.949 -37.637 -55.224 1.00 49.89 ? 29 ASP C CB 1 ATOM 3327 C CG . ASP C 3 29 ? -9.131 -36.796 -55.723 1.00 52.87 ? 29 ASP C CG 1 ATOM 3328 O OD1 . ASP C 3 29 ? -9.726 -37.127 -56.771 1.00 54.98 ? 29 ASP C OD1 1 ATOM 3329 O OD2 . ASP C 3 29 ? -9.467 -35.791 -55.057 1.00 53.57 ? 29 ASP C OD2 1 ATOM 3330 N N . ASN C 3 30 ? -8.454 -41.250 -55.300 1.00 49.05 ? 30 ASN C N 1 ATOM 3331 C CA . ASN C 3 30 ? -9.351 -42.320 -54.874 1.00 49.95 ? 30 ASN C CA 1 ATOM 3332 C C . ASN C 3 30 ? -9.691 -42.216 -53.394 1.00 49.47 ? 30 ASN C C 1 ATOM 3333 O O . ASN C 3 30 ? -10.863 -42.153 -53.018 1.00 51.07 ? 30 ASN C O 1 ATOM 3334 C CB . ASN C 3 30 ? -8.750 -43.695 -55.182 1.00 49.73 ? 30 ASN C CB 1 ATOM 3335 C CG . ASN C 3 30 ? -9.625 -44.840 -54.692 1.00 51.38 ? 30 ASN C CG 1 ATOM 3336 O OD1 . ASN C 3 30 ? -9.369 -45.424 -53.639 1.00 50.90 ? 30 ASN C OD1 1 ATOM 3337 N ND2 . ASN C 3 30 ? -10.670 -45.157 -55.451 1.00 53.56 ? 30 ASN C ND2 1 ATOM 3338 N N . HIS C 3 31 ? -8.651 -42.197 -52.566 1.00 47.59 ? 31 HIS C N 1 ATOM 3339 C CA . HIS C 3 31 ? -8.803 -42.132 -51.122 1.00 47.18 ? 31 HIS C CA 1 ATOM 3340 C C . HIS C 3 31 ? -7.674 -41.326 -50.478 1.00 45.25 ? 31 HIS C C 1 ATOM 3341 O O . HIS C 3 31 ? -6.613 -41.130 -51.081 1.00 44.12 ? 31 HIS C O 1 ATOM 3342 C CB . HIS C 3 31 ? -8.868 -43.545 -50.527 1.00 47.88 ? 31 HIS C CB 1 ATOM 3343 C CG . HIS C 3 31 ? -7.607 -44.337 -50.700 1.00 47.28 ? 31 HIS C CG 1 ATOM 3344 N ND1 . HIS C 3 31 ? -7.418 -45.219 -51.743 1.00 48.40 ? 31 HIS C ND1 1 ATOM 3345 C CD2 . HIS C 3 31 ? -6.473 -44.381 -49.960 1.00 46.21 ? 31 HIS C CD2 1 ATOM 3346 C CE1 . HIS C 3 31 ? -6.222 -45.771 -51.639 1.00 47.65 ? 31 HIS C CE1 1 ATOM 3347 N NE2 . HIS C 3 31 ? -5.628 -45.280 -50.566 1.00 46.59 ? 31 HIS C NE2 1 ATOM 3348 N N . LEU C 3 32 ? -7.920 -40.857 -49.256 1.00 45.09 ? 32 LEU C N 1 ATOM 3349 C CA . LEU C 3 32 ? -6.911 -40.163 -48.465 1.00 43.61 ? 32 LEU C CA 1 ATOM 3350 C C . LEU C 3 32 ? -6.772 -40.839 -47.105 1.00 43.40 ? 32 LEU C C 1 ATOM 3351 O O . LEU C 3 32 ? -7.771 -41.138 -46.442 1.00 44.74 ? 32 LEU C O 1 ATOM 3352 C CB . LEU C 3 32 ? -7.267 -38.679 -48.313 1.00 44.04 ? 32 LEU C CB 1 ATOM 3353 C CG . LEU C 3 32 ? -6.193 -37.753 -47.723 1.00 43.51 ? 32 LEU C CG 1 ATOM 3354 C CD1 . LEU C 3 32 ? -6.175 -36.420 -48.450 1.00 44.43 ? 32 LEU C CD1 1 ATOM 3355 C CD2 . LEU C 3 32 ? -6.368 -37.551 -46.215 1.00 43.31 ? 32 LEU C CD2 1 ATOM 3356 N N . ARG C 3 33 ? -5.528 -41.073 -46.699 1.00 42.11 ? 33 ARG C N 1 ATOM 3357 C CA . ARG C 3 33 ? -5.232 -41.784 -45.459 1.00 42.33 ? 33 ARG C CA 1 ATOM 3358 C C . ARG C 3 33 ? -4.252 -41.003 -44.583 1.00 41.36 ? 33 ARG C C 1 ATOM 3359 O O . ARG C 3 33 ? -3.248 -40.484 -45.079 1.00 40.38 ? 33 ARG C O 1 ATOM 3360 C CB . ARG C 3 33 ? -4.667 -43.164 -45.785 1.00 42.61 ? 33 ARG C CB 1 ATOM 3361 C CG . ARG C 3 33 ? -4.670 -44.136 -44.632 1.00 44.37 ? 33 ARG C CG 1 ATOM 3362 C CD . ARG C 3 33 ? -4.100 -45.479 -45.052 1.00 46.32 ? 33 ARG C CD 1 ATOM 3363 N NE . ARG C 3 33 ? -5.039 -46.283 -45.832 1.00 48.47 ? 33 ARG C NE 1 ATOM 3364 C CZ . ARG C 3 33 ? -5.965 -47.079 -45.301 1.00 51.12 ? 33 ARG C CZ 1 ATOM 3365 N NH1 . ARG C 3 33 ? -6.093 -47.173 -43.981 1.00 51.69 ? 33 ARG C NH1 1 ATOM 3366 N NH2 . ARG C 3 33 ? -6.772 -47.779 -46.091 1.00 52.60 ? 33 ARG C NH2 1 ATOM 3367 N N . TRP C 3 34 ? -4.556 -40.917 -43.287 1.00 41.93 ? 34 TRP C N 1 ATOM 3368 C CA . TRP C 3 34 ? -3.661 -40.287 -42.310 1.00 41.55 ? 34 TRP C CA 1 ATOM 3369 C C . TRP C 3 34 ? -2.896 -41.335 -41.509 1.00 42.23 ? 34 TRP C C 1 ATOM 3370 O O . TRP C 3 34 ? -3.489 -42.281 -40.985 1.00 43.67 ? 34 TRP C O 1 ATOM 3371 C CB . TRP C 3 34 ? -4.439 -39.390 -41.343 1.00 42.24 ? 34 TRP C CB 1 ATOM 3372 C CG . TRP C 3 34 ? -4.851 -38.068 -41.909 1.00 41.76 ? 34 TRP C CG 1 ATOM 3373 C CD1 . TRP C 3 34 ? -6.044 -37.768 -42.500 1.00 42.73 ? 34 TRP C CD1 1 ATOM 3374 C CD2 . TRP C 3 34 ? -4.084 -36.856 -41.917 1.00 40.93 ? 34 TRP C CD2 1 ATOM 3375 N NE1 . TRP C 3 34 ? -6.068 -36.448 -42.882 1.00 42.67 ? 34 TRP C NE1 1 ATOM 3376 C CE2 . TRP C 3 34 ? -4.878 -35.864 -42.537 1.00 41.40 ? 34 TRP C CE2 1 ATOM 3377 C CE3 . TRP C 3 34 ? -2.806 -36.511 -41.461 1.00 40.16 ? 34 TRP C CE3 1 ATOM 3378 C CZ2 . TRP C 3 34 ? -4.433 -34.551 -42.720 1.00 41.10 ? 34 TRP C CZ2 1 ATOM 3379 C CZ3 . TRP C 3 34 ? -2.364 -35.205 -41.645 1.00 40.17 ? 34 TRP C CZ3 1 ATOM 3380 C CH2 . TRP C 3 34 ? -3.178 -34.242 -42.271 1.00 40.54 ? 34 TRP C CH2 1 ATOM 3381 N N . PHE C 3 35 ? -1.581 -41.156 -41.417 1.00 41.81 ? 35 PHE C N 1 ATOM 3382 C CA . PHE C 3 35 ? -0.726 -42.030 -40.615 1.00 42.94 ? 35 PHE C CA 1 ATOM 3383 C C . PHE C 3 35 ? -0.131 -41.286 -39.422 1.00 43.40 ? 35 PHE C C 1 ATOM 3384 O O . PHE C 3 35 ? 0.016 -40.058 -39.447 1.00 42.51 ? 35 PHE C O 1 ATOM 3385 C CB . PHE C 3 35 ? 0.414 -42.595 -41.464 1.00 42.77 ? 35 PHE C CB 1 ATOM 3386 C CG . PHE C 3 35 ? -0.000 -43.693 -42.400 1.00 43.41 ? 35 PHE C CG 1 ATOM 3387 C CD1 . PHE C 3 35 ? 0.066 -45.025 -42.002 1.00 45.35 ? 35 PHE C CD1 1 ATOM 3388 C CD2 . PHE C 3 35 ? -0.428 -43.400 -43.693 1.00 42.71 ? 35 PHE C CD2 1 ATOM 3389 C CE1 . PHE C 3 35 ? -0.305 -46.053 -42.871 1.00 46.16 ? 35 PHE C CE1 1 ATOM 3390 C CE2 . PHE C 3 35 ? -0.799 -44.417 -44.573 1.00 43.49 ? 35 PHE C CE2 1 ATOM 3391 C CZ . PHE C 3 35 ? -0.738 -45.749 -44.159 1.00 45.23 ? 35 PHE C CZ 1 ATOM 3392 N N . LYS C 3 36 ? 0.210 -42.043 -38.384 1.00 45.10 ? 36 LYS C N 1 ATOM 3393 C CA . LYS C 3 36 ? 0.952 -41.521 -37.243 1.00 46.07 ? 36 LYS C CA 1 ATOM 3394 C C . LYS C 3 36 ? 2.290 -42.239 -37.168 1.00 47.20 ? 36 LYS C C 1 ATOM 3395 O O . LYS C 3 36 ? 2.335 -43.470 -37.178 1.00 48.82 ? 36 LYS C O 1 ATOM 3396 C CB . LYS C 3 36 ? 0.165 -41.734 -35.944 1.00 47.91 ? 36 LYS C CB 1 ATOM 3397 C CG . LYS C 3 36 ? 0.870 -41.241 -34.687 1.00 49.02 ? 36 LYS C CG 1 ATOM 3398 C CD . LYS C 3 36 ? 0.183 -41.743 -33.430 1.00 51.42 ? 36 LYS C CD 1 ATOM 3399 C CE . LYS C 3 36 ? 0.919 -41.278 -32.180 1.00 53.16 ? 36 LYS C CE 1 ATOM 3400 N NZ . LYS C 3 36 ? 0.324 -41.836 -30.934 1.00 55.94 ? 36 LYS C NZ 1 ATOM 3401 N N . GLN C 3 37 ? 3.374 -41.471 -37.099 1.00 47.15 ? 37 GLN C N 1 ATOM 3402 C CA . GLN C 3 37 ? 4.716 -42.041 -36.993 1.00 48.73 ? 37 GLN C CA 1 ATOM 3403 C C . GLN C 3 37 ? 5.421 -41.602 -35.714 1.00 50.65 ? 37 GLN C C 1 ATOM 3404 O O . GLN C 3 37 ? 5.852 -40.451 -35.588 1.00 50.14 ? 37 GLN C O 1 ATOM 3405 C CB . GLN C 3 37 ? 5.566 -41.689 -38.218 1.00 47.69 ? 37 GLN C CB 1 ATOM 3406 C CG . GLN C 3 37 ? 6.867 -42.489 -38.304 1.00 49.64 ? 37 GLN C CG 1 ATOM 3407 C CD . GLN C 3 37 ? 7.793 -42.036 -39.424 1.00 48.97 ? 37 GLN C CD 1 ATOM 3408 O OE1 . GLN C 3 37 ? 7.666 -40.934 -39.957 1.00 47.69 ? 37 GLN C OE1 1 ATOM 3409 N NE2 . GLN C 3 37 ? 8.740 -42.890 -39.777 1.00 50.31 ? 37 GLN C NE2 1 ATOM 3410 N N . ASP C 3 38 ? 5.528 -42.530 -34.766 1.00 53.35 ? 38 ASP C N 1 ATOM 3411 C CA . ASP C 3 38 ? 6.311 -42.312 -33.556 1.00 55.95 ? 38 ASP C CA 1 ATOM 3412 C C . ASP C 3 38 ? 7.793 -42.316 -33.909 1.00 57.31 ? 38 ASP C C 1 ATOM 3413 O O . ASP C 3 38 ? 8.211 -42.999 -34.853 1.00 57.52 ? 38 ASP C O 1 ATOM 3414 C CB . ASP C 3 38 ? 6.006 -43.390 -32.513 1.00 58.81 ? 38 ASP C CB 1 ATOM 3415 C CG . ASP C 3 38 ? 4.630 -43.226 -31.883 0.70 58.98 ? 38 ASP C CG 1 ATOM 3416 O OD1 . ASP C 3 38 ? 4.271 -42.089 -31.505 0.70 58.32 ? 38 ASP C OD1 1 ATOM 3417 O OD2 . ASP C 3 38 ? 3.908 -44.237 -31.754 0.70 60.80 ? 38 ASP C OD2 1 ATOM 3418 N N . THR C 3 39 ? 8.581 -41.551 -33.158 1.00 58.76 ? 39 THR C N 1 ATOM 3419 C CA . THR C 3 39 ? 10.014 -41.424 -33.424 1.00 60.66 ? 39 THR C CA 1 ATOM 3420 C C . THR C 3 39 ? 10.735 -42.766 -33.298 1.00 63.70 ? 39 THR C C 1 ATOM 3421 O O . THR C 3 39 ? 10.680 -43.420 -32.255 1.00 66.12 ? 39 THR C O 1 ATOM 3422 C CB . THR C 3 39 ? 10.681 -40.369 -32.513 1.00 62.11 ? 39 THR C CB 1 ATOM 3423 O OG1 . THR C 3 39 ? 10.358 -40.640 -31.144 0.90 64.05 ? 39 THR C OG1 1 ATOM 3424 C CG2 . THR C 3 39 ? 10.204 -38.966 -32.880 0.90 59.96 ? 39 THR C CG2 1 ATOM 3425 N N . GLY C 3 40 ? 11.393 -43.170 -34.382 1.00 64.02 ? 40 GLY C N 1 ATOM 3426 C CA . GLY C 3 40 ? 12.096 -44.450 -34.440 1.00 67.30 ? 40 GLY C CA 1 ATOM 3427 C C . GLY C 3 40 ? 11.172 -45.636 -34.650 1.00 67.29 ? 40 GLY C C 1 ATOM 3428 O O . GLY C 3 40 ? 11.492 -46.758 -34.248 1.00 70.68 ? 40 GLY C O 1 ATOM 3429 N N . LYS C 3 41 ? 10.026 -45.389 -35.284 1.00 63.96 ? 41 LYS C N 1 ATOM 3430 C CA . LYS C 3 41 ? 9.041 -46.435 -35.551 1.00 63.83 ? 41 LYS C CA 1 ATOM 3431 C C . LYS C 3 41 ? 8.471 -46.324 -36.968 1.00 60.90 ? 41 LYS C C 1 ATOM 3432 O O . LYS C 3 41 ? 8.900 -45.474 -37.754 1.00 59.18 ? 41 LYS C O 1 ATOM 3433 C CB . LYS C 3 41 ? 7.921 -46.394 -34.504 1.00 63.80 ? 41 LYS C CB 1 ATOM 3434 N N . GLY C 3 42 ? 7.512 -47.189 -37.289 1.00 60.74 ? 42 GLY C N 1 ATOM 3435 C CA . GLY C 3 42 ? 6.898 -47.208 -38.612 1.00 58.43 ? 42 GLY C CA 1 ATOM 3436 C C . GLY C 3 42 ? 5.627 -46.386 -38.697 1.00 55.54 ? 42 GLY C C 1 ATOM 3437 O O . GLY C 3 42 ? 5.221 -45.746 -37.725 1.00 55.30 ? 42 GLY C O 1 ATOM 3438 N N . LEU C 3 43 ? 5.006 -46.403 -39.872 1.00 53.80 ? 43 LEU C N 1 ATOM 3439 C CA . LEU C 3 43 ? 3.749 -45.702 -40.100 1.00 51.59 ? 43 LEU C CA 1 ATOM 3440 C C . LEU C 3 43 ? 2.570 -46.576 -39.682 1.00 52.77 ? 43 LEU C C 1 ATOM 3441 O O . LEU C 3 43 ? 2.473 -47.736 -40.086 1.00 54.41 ? 43 LEU C O 1 ATOM 3442 C CB . LEU C 3 43 ? 3.614 -45.305 -41.574 1.00 49.76 ? 43 LEU C CB 1 ATOM 3443 C CG . LEU C 3 43 ? 4.301 -44.043 -42.103 1.00 48.35 ? 43 LEU C CG 1 ATOM 3444 C CD1 . LEU C 3 43 ? 5.822 -44.140 -42.032 1.00 50.17 ? 43 LEU C CD1 1 ATOM 3445 C CD2 . LEU C 3 43 ? 3.851 -43.777 -43.533 1.00 46.66 ? 43 LEU C CD2 1 ATOM 3446 N N . VAL C 3 44 ? 1.688 -46.012 -38.862 1.00 52.39 ? 44 VAL C N 1 ATOM 3447 C CA . VAL C 3 44 ? 0.496 -46.710 -38.388 1.00 53.90 ? 44 VAL C CA 1 ATOM 3448 C C . VAL C 3 44 ? -0.741 -45.928 -38.821 1.00 52.06 ? 44 VAL C C 1 ATOM 3449 O O . VAL C 3 44 ? -0.875 -44.744 -38.499 1.00 50.68 ? 44 VAL C O 1 ATOM 3450 C CB . VAL C 3 44 ? 0.500 -46.877 -36.848 1.00 56.34 ? 44 VAL C CB 1 ATOM 3451 C CG1 . VAL C 3 44 ? -0.697 -47.704 -36.393 1.00 58.81 ? 44 VAL C CG1 1 ATOM 3452 C CG2 . VAL C 3 44 ? 1.801 -47.522 -36.374 1.00 58.48 ? 44 VAL C CG2 1 ATOM 3453 N N . SER C 3 45 ? -1.634 -46.592 -39.553 1.00 52.41 ? 45 SER C N 1 ATOM 3454 C CA . SER C 3 45 ? -2.835 -45.951 -40.086 1.00 51.22 ? 45 SER C CA 1 ATOM 3455 C C . SER C 3 45 ? -3.795 -45.495 -38.993 1.00 52.33 ? 45 SER C C 1 ATOM 3456 O O . SER C 3 45 ? -4.033 -46.217 -38.018 1.00 54.89 ? 45 SER C O 1 ATOM 3457 C CB . SER C 3 45 ? -3.560 -46.878 -41.063 1.00 52.17 ? 45 SER C CB 1 ATOM 3458 O OG . SER C 3 45 ? -4.635 -46.198 -41.696 1.00 51.36 ? 45 SER C OG 1 ATOM 3459 N N . LEU C 3 46 ? -4.339 -44.293 -39.170 1.00 50.79 ? 46 LEU C N 1 ATOM 3460 C CA . LEU C 3 46 ? -5.304 -43.724 -38.228 1.00 52.13 ? 46 LEU C CA 1 ATOM 3461 C C . LEU C 3 46 ? -6.736 -43.783 -38.759 1.00 53.39 ? 46 LEU C C 1 ATOM 3462 O O . LEU C 3 46 ? -7.659 -44.143 -38.022 1.00 55.95 ? 46 LEU C O 1 ATOM 3463 C CB . LEU C 3 46 ? -4.935 -42.281 -37.866 1.00 50.35 ? 46 LEU C CB 1 ATOM 3464 C CG . LEU C 3 46 ? -3.604 -42.021 -37.155 1.00 49.61 ? 46 LEU C CG 1 ATOM 3465 C CD1 . LEU C 3 46 ? -3.393 -40.531 -36.964 1.00 47.93 ? 46 LEU C CD1 1 ATOM 3466 C CD2 . LEU C 3 46 ? -3.523 -42.747 -35.818 1.00 52.28 ? 46 LEU C CD2 1 ATOM 3467 N N . THR C 3 47 ? -6.909 -43.432 -40.036 1.00 52.06 ? 47 THR C N 1 ATOM 3468 C CA . THR C 3 47 ? -8.228 -43.388 -40.675 1.00 53.42 ? 47 THR C CA 1 ATOM 3469 C C . THR C 3 47 ? -8.170 -43.280 -42.205 1.00 51.92 ? 47 THR C C 1 ATOM 3470 O O . THR C 3 47 ? -7.176 -42.812 -42.765 1.00 49.76 ? 47 THR C O 1 ATOM 3471 C CB . THR C 3 47 ? -9.104 -42.241 -40.102 1.00 54.37 ? 47 THR C CB 1 ATOM 3472 O OG1 . THR C 3 47 ? -10.440 -42.363 -40.608 1.00 56.67 ? 47 THR C OG1 1 ATOM 3473 C CG2 . THR C 3 47 ? -8.523 -40.862 -40.451 1.00 51.87 ? 47 THR C CG2 1 ATOM 3474 N N . VAL C 3 48 ? -9.245 -43.717 -42.863 1.00 53.64 ? 48 VAL C N 1 ATOM 3475 C CA . VAL C 3 48 ? -9.369 -43.659 -44.323 1.00 52.97 ? 48 VAL C CA 1 ATOM 3476 C C . VAL C 3 48 ? -10.547 -42.784 -44.726 1.00 54.14 ? 48 VAL C C 1 ATOM 3477 O O . VAL C 3 48 ? -11.641 -42.908 -44.170 1.00 56.80 ? 48 VAL C O 1 ATOM 3478 C CB . VAL C 3 48 ? -9.630 -45.050 -44.959 1.00 54.50 ? 48 VAL C CB 1 ATOM 3479 C CG1 . VAL C 3 48 ? -8.972 -45.133 -46.334 1.00 52.90 ? 48 VAL C CG1 1 ATOM 3480 C CG2 . VAL C 3 48 ? -9.162 -46.182 -44.059 1.00 55.87 ? 48 VAL C CG2 1 ATOM 3481 N N . LEU C 3 49 ? -10.326 -41.917 -45.710 1.00 52.82 ? 49 LEU C N 1 ATOM 3482 C CA . LEU C 3 49 ? -11.392 -41.084 -46.261 1.00 54.28 ? 49 LEU C CA 1 ATOM 3483 C C . LEU C 3 49 ? -11.576 -41.394 -47.747 1.00 54.54 ? 49 LEU C C 1 ATOM 3484 O O . LEU C 3 49 ? -10.650 -41.225 -48.539 1.00 52.79 ? 49 LEU C O 1 ATOM 3485 C CB . LEU C 3 49 ? -11.079 -39.604 -46.035 1.00 53.33 ? 49 LEU C CB 1 ATOM 3486 C CG . LEU C 3 49 ? -11.063 -39.097 -44.589 1.00 53.67 ? 49 LEU C CG 1 ATOM 3487 C CD1 . LEU C 3 49 ? -10.031 -37.992 -44.412 1.00 52.02 ? 49 LEU C CD1 1 ATOM 3488 C CD2 . LEU C 3 49 ? -12.440 -38.622 -44.162 1.00 56.56 ? 49 LEU C CD2 1 ATOM 3489 N N . VAL C 3 50 ? -12.773 -41.849 -48.113 1.00 57.22 ? 50 VAL C N 1 ATOM 3490 C CA . VAL C 3 50 ? -13.038 -42.382 -49.456 1.00 58.07 ? 50 VAL C CA 1 ATOM 3491 C C . VAL C 3 50 ? -13.925 -41.469 -50.321 1.00 59.88 ? 50 VAL C C 1 ATOM 3492 O O . VAL C 3 50 ? -13.636 -41.257 -51.499 1.00 59.41 ? 50 VAL C O 1 ATOM 3493 C CB . VAL C 3 50 ? -13.668 -43.811 -49.387 1.00 60.31 ? 50 VAL C CB 1 ATOM 3494 C CG1 . VAL C 3 50 ? -13.816 -44.417 -50.782 1.00 61.35 ? 50 VAL C CG1 1 ATOM 3495 C CG2 . VAL C 3 50 ? -12.838 -44.736 -48.502 1.00 59.28 ? 50 VAL C CG2 1 ATOM 3496 N N . ASP C 3 51 ? -14.995 -40.934 -49.734 1.00 62.39 ? 51 ASP C N 1 ATOM 3497 C CA . ASP C 3 51 ? -16.013 -40.197 -50.492 1.00 65.20 ? 51 ASP C CA 1 ATOM 3498 C C . ASP C 3 51 ? -15.629 -38.763 -50.864 1.00 64.48 ? 51 ASP C C 1 ATOM 3499 O O . ASP C 3 51 ? -14.687 -38.193 -50.306 1.00 62.14 ? 51 ASP C O 1 ATOM 3500 C CB . ASP C 3 51 ? -17.348 -40.211 -49.740 1.00 68.93 ? 51 ASP C CB 1 ATOM 3501 C CG . ASP C 3 51 ? -17.925 -41.610 -49.594 1.00 71.38 ? 51 ASP C CG 1 ATOM 3502 O OD1 . ASP C 3 51 ? -17.843 -42.405 -50.557 1.00 71.76 ? 51 ASP C OD1 1 ATOM 3503 O OD2 . ASP C 3 51 ? -18.469 -41.914 -48.511 1.00 73.93 ? 51 ASP C OD2 1 ATOM 3504 N N . GLN C 3 52 ? -16.380 -38.200 -51.813 1.00 67.03 ? 52 GLN C N 1 ATOM 3505 C CA . GLN C 3 52 ? -16.195 -36.834 -52.314 1.00 67.56 ? 52 GLN C CA 1 ATOM 3506 C C . GLN C 3 52 ? -16.223 -35.806 -51.184 1.00 67.73 ? 52 GLN C C 1 ATOM 3507 O O . GLN C 3 52 ? -15.372 -34.921 -51.118 1.00 66.36 ? 52 GLN C O 1 ATOM 3508 C CB . GLN C 3 52 ? -17.279 -36.512 -53.352 1.00 71.47 ? 52 GLN C CB 1 ATOM 3509 C CG . GLN C 3 52 ? -16.941 -35.375 -54.315 1.00 72.87 ? 52 GLN C CG 1 ATOM 3510 C CD . GLN C 3 52 ? -15.943 -35.774 -55.401 1.00 71.69 ? 52 GLN C CD 1 ATOM 3511 O OE1 . GLN C 3 52 ? -15.729 -36.959 -55.672 1.00 70.42 ? 52 GLN C OE1 1 ATOM 3512 N NE2 . GLN C 3 52 ? -15.332 -34.776 -56.032 1.00 72.20 ? 52 GLN C NE2 1 ATOM 3513 N N . LYS C 3 53 ? -17.221 -35.924 -50.312 1.00 69.97 ? 53 LYS C N 1 ATOM 3514 C CA . LYS C 3 53 ? -17.282 -35.167 -49.067 1.00 70.30 ? 53 LYS C CA 1 ATOM 3515 C C . LYS C 3 53 ? -17.385 -36.209 -47.962 1.00 69.64 ? 53 LYS C C 1 ATOM 3516 O O . LYS C 3 53 ? -18.440 -36.817 -47.768 1.00 72.63 ? 53 LYS C O 1 ATOM 3517 C CB . LYS C 3 53 ? -18.500 -34.234 -49.035 1.00 74.76 ? 53 LYS C CB 1 ATOM 3518 C CG . LYS C 3 53 ? -18.619 -33.257 -50.203 1.00 76.82 ? 53 LYS C CG 1 ATOM 3519 C CD . LYS C 3 53 ? -17.745 -32.022 -50.026 1.00 75.96 ? 53 LYS C CD 1 ATOM 3520 C CE . LYS C 3 53 ? -18.053 -30.976 -51.092 1.00 79.15 ? 53 LYS C CE 1 ATOM 3521 N N . ASP C 3 54 ? -16.286 -36.425 -47.249 1.00 66.27 ? 54 ASP C N 1 ATOM 3522 C CA . ASP C 3 54 ? -16.234 -37.485 -46.253 1.00 65.76 ? 54 ASP C CA 1 ATOM 3523 C C . ASP C 3 54 ? -15.861 -36.948 -44.880 1.00 65.18 ? 54 ASP C C 1 ATOM 3524 O O . ASP C 3 54 ? -15.120 -35.975 -44.767 1.00 63.56 ? 54 ASP C O 1 ATOM 3525 C CB . ASP C 3 54 ? -15.240 -38.568 -46.686 1.00 62.88 ? 54 ASP C CB 1 ATOM 3526 C CG . ASP C 3 54 ? -15.667 -39.970 -46.262 1.00 64.35 ? 54 ASP C CG 1 ATOM 3527 O OD1 . ASP C 3 54 ? -16.587 -40.106 -45.422 1.00 67.10 ? 54 ASP C OD1 1 ATOM 3528 O OD2 . ASP C 3 54 ? -15.073 -40.945 -46.778 1.00 62.78 ? 54 ASP C OD2 1 ATOM 3529 N N . LYS C 3 55 ? -16.402 -37.581 -43.845 1.00 67.02 ? 55 LYS C N 1 ATOM 3530 C CA . LYS C 3 55 ? -16.019 -37.292 -42.465 1.00 66.85 ? 55 LYS C CA 1 ATOM 3531 C C . LYS C 3 55 ? -15.788 -38.594 -41.707 1.00 66.83 ? 55 LYS C C 1 ATOM 3532 O O . LYS C 3 55 ? -16.527 -39.565 -41.875 1.00 69.03 ? 55 LYS C O 1 ATOM 3533 C CB . LYS C 3 55 ? -17.051 -36.396 -41.755 1.00 70.37 ? 55 LYS C CB 1 ATOM 3534 C CG . LYS C 3 55 ? -18.412 -37.029 -41.496 1.00 74.86 ? 55 LYS C CG 1 ATOM 3535 N N . THR C 3 56 ? -14.747 -38.608 -40.883 1.00 64.85 ? 56 THR C N 1 ATOM 3536 C CA . THR C 3 56 ? -14.358 -39.814 -40.164 1.00 65.07 ? 56 THR C CA 1 ATOM 3537 C C . THR C 3 56 ? -14.034 -39.501 -38.706 1.00 65.64 ? 56 THR C C 1 ATOM 3538 O O . THR C 3 56 ? -13.681 -38.368 -38.372 1.00 64.74 ? 56 THR C O 1 ATOM 3539 C CB . THR C 3 56 ? -13.168 -40.514 -40.859 1.00 61.85 ? 56 THR C CB 1 ATOM 3540 O OG1 . THR C 3 56 ? -12.982 -41.824 -40.310 1.00 63.17 ? 56 THR C OG1 1 ATOM 3541 C CG2 . THR C 3 56 ? -11.897 -39.709 -40.688 1.00 58.89 ? 56 THR C CG2 1 ATOM 3542 N N . SER C 3 57 ? -14.163 -40.507 -37.845 1.00 67.65 ? 57 SER C N 1 ATOM 3543 C CA . SER C 3 57 ? -13.973 -40.324 -36.411 1.00 69.14 ? 57 SER C CA 1 ATOM 3544 C C . SER C 3 57 ? -13.467 -41.604 -35.756 1.00 70.05 ? 57 SER C C 1 ATOM 3545 O O . SER C 3 57 ? -13.976 -42.693 -36.030 1.00 72.13 ? 57 SER C O 1 ATOM 3546 C CB . SER C 3 57 ? -15.284 -39.875 -35.759 1.00 73.32 ? 57 SER C CB 1 ATOM 3547 O OG . SER C 3 57 ? -15.061 -39.344 -34.468 1.00 74.69 ? 57 SER C OG 1 ATOM 3548 N N . ASN C 3 58 ? -12.461 -41.463 -34.896 1.00 69.00 ? 58 ASN C N 1 ATOM 3549 C CA . ASN C 3 58 ? -11.871 -42.593 -34.183 1.00 70.34 ? 58 ASN C CA 1 ATOM 3550 C C . ASN C 3 58 ? -11.247 -42.155 -32.859 1.00 70.94 ? 58 ASN C C 1 ATOM 3551 O O . ASN C 3 58 ? -10.065 -41.796 -32.800 1.00 68.33 ? 58 ASN C O 1 ATOM 3552 C CB . ASN C 3 58 ? -10.836 -43.309 -35.063 1.00 67.58 ? 58 ASN C CB 1 ATOM 3553 C CG . ASN C 3 58 ? -10.482 -44.699 -34.547 1.00 70.09 ? 58 ASN C CG 1 ATOM 3554 O OD1 . ASN C 3 58 ? -11.171 -45.257 -33.687 1.00 74.13 ? 58 ASN C OD1 1 ATOM 3555 N ND2 . ASN C 3 58 ? -9.405 -45.266 -35.080 1.00 68.04 ? 58 ASN C ND2 1 ATOM 3556 N N . GLY C 3 59 ? -12.051 -42.191 -31.800 1.00 74.93 ? 59 GLY C N 1 ATOM 3557 C CA . GLY C 3 59 ? -11.630 -41.722 -30.484 1.00 76.12 ? 59 GLY C CA 1 ATOM 3558 C C . GLY C 3 59 ? -11.432 -40.219 -30.481 1.00 73.96 ? 59 GLY C C 1 ATOM 3559 O O . GLY C 3 59 ? -12.367 -39.462 -30.748 1.00 74.88 ? 59 GLY C O 1 ATOM 3560 N N . ARG C 3 60 ? -10.207 -39.793 -30.189 1.00 71.52 ? 60 ARG C N 1 ATOM 3561 C CA . ARG C 3 60 ? -9.859 -38.374 -30.188 1.00 69.66 ? 60 ARG C CA 1 ATOM 3562 C C . ARG C 3 60 ? -9.651 -37.838 -31.606 1.00 66.11 ? 60 ARG C C 1 ATOM 3563 O O . ARG C 3 60 ? -9.814 -36.639 -31.846 1.00 65.57 ? 60 ARG C O 1 ATOM 3564 C CB . ARG C 3 60 ? -8.602 -38.124 -29.353 1.00 68.96 ? 60 ARG C CB 1 ATOM 3565 C CG . ARG C 3 60 ? -8.701 -38.552 -27.893 1.00 73.00 ? 60 ARG C CG 1 ATOM 3566 C CD . ARG C 3 60 ? -7.465 -38.124 -27.098 1.00 72.93 ? 60 ARG C CD 1 ATOM 3567 N NE . ARG C 3 60 ? -6.211 -38.554 -27.722 1.00 69.97 ? 60 ARG C NE 1 ATOM 3568 C CZ . ARG C 3 60 ? -5.651 -39.749 -27.545 1.00 71.14 ? 60 ARG C CZ 1 ATOM 3569 N NH1 . ARG C 3 60 ? -6.224 -40.654 -26.759 1.00 75.25 ? 60 ARG C NH1 1 ATOM 3570 N NH2 . ARG C 3 60 ? -4.513 -40.042 -28.157 1.00 68.62 ? 60 ARG C NH2 1 ATOM 3571 N N . TYR C 3 61 ? -9.288 -38.728 -32.531 1.00 64.08 ? 62 TYR C N 1 ATOM 3572 C CA . TYR C 3 61 ? -9.047 -38.361 -33.928 1.00 60.96 ? 62 TYR C CA 1 ATOM 3573 C C . TYR C 3 61 ? -10.351 -38.205 -34.699 1.00 62.02 ? 62 TYR C C 1 ATOM 3574 O O . TYR C 3 61 ? -11.253 -39.036 -34.582 1.00 64.64 ? 62 TYR C O 1 ATOM 3575 C CB . TYR C 3 61 ? -8.169 -39.407 -34.632 1.00 58.98 ? 62 TYR C CB 1 ATOM 3576 C CG . TYR C 3 61 ? -6.884 -39.750 -33.910 1.00 58.70 ? 62 TYR C CG 1 ATOM 3577 C CD1 . TYR C 3 61 ? -6.742 -40.967 -33.246 1.00 61.15 ? 62 TYR C CD1 1 ATOM 3578 C CD2 . TYR C 3 61 ? -5.812 -38.861 -33.889 1.00 57.01 ? 62 TYR C CD2 1 ATOM 3579 C CE1 . TYR C 3 61 ? -5.566 -41.290 -32.574 1.00 61.33 ? 62 TYR C CE1 1 ATOM 3580 C CE2 . TYR C 3 61 ? -4.633 -39.173 -33.221 1.00 57.41 ? 62 TYR C CE2 1 ATOM 3581 C CZ . TYR C 3 61 ? -4.516 -40.389 -32.566 1.00 59.47 ? 62 TYR C CZ 1 ATOM 3582 O OH . TYR C 3 61 ? -3.349 -40.703 -31.904 1.00 59.97 ? 62 TYR C OH 1 ATOM 3583 N N . SER C 3 62 ? -10.449 -37.132 -35.477 1.00 60.55 ? 63 SER C N 1 ATOM 3584 C CA . SER C 3 62 ? -11.534 -36.963 -36.442 1.00 61.31 ? 63 SER C CA 1 ATOM 3585 C C . SER C 3 62 ? -11.011 -36.209 -37.657 1.00 58.72 ? 63 SER C C 1 ATOM 3586 O O . SER C 3 62 ? -10.298 -35.214 -37.517 1.00 57.75 ? 63 SER C O 1 ATOM 3587 C CB . SER C 3 62 ? -12.728 -36.229 -35.829 1.00 64.74 ? 63 SER C CB 1 ATOM 3588 O OG . SER C 3 62 ? -12.449 -34.853 -35.641 1.00 64.65 ? 63 SER C OG 1 ATOM 3589 N N . ALA C 3 63 ? -11.358 -36.692 -38.846 1.00 57.94 ? 64 ALA C N 1 ATOM 3590 C CA . ALA C 3 63 ? -10.875 -36.090 -40.082 1.00 55.65 ? 64 ALA C CA 1 ATOM 3591 C C . ALA C 3 63 ? -12.003 -35.766 -41.056 1.00 57.19 ? 64 ALA C C 1 ATOM 3592 O O . ALA C 3 63 ? -13.100 -36.318 -40.956 1.00 59.52 ? 64 ALA C O 1 ATOM 3593 C CB . ALA C 3 63 ? -9.836 -36.987 -40.736 1.00 53.09 ? 64 ALA C CB 1 ATOM 3594 N N . THR C 3 64 ? -11.721 -34.857 -41.987 1.00 56.27 ? 65 THR C N 1 ATOM 3595 C CA . THR C 3 64 ? -12.652 -34.498 -43.055 1.00 57.88 ? 65 THR C CA 1 ATOM 3596 C C . THR C 3 64 ? -11.934 -34.502 -44.396 1.00 55.77 ? 65 THR C C 1 ATOM 3597 O O . THR C 3 64 ? -10.729 -34.263 -44.456 1.00 53.72 ? 65 THR C O 1 ATOM 3598 C CB . THR C 3 64 ? -13.268 -33.094 -42.849 1.00 60.49 ? 65 THR C CB 1 ATOM 3599 O OG1 . THR C 3 64 ? -12.224 -32.139 -42.614 1.00 59.51 ? 65 THR C OG1 1 ATOM 3600 C CG2 . THR C 3 64 ? -14.245 -33.088 -41.678 1.00 63.31 ? 65 THR C CG2 1 ATOM 3601 N N . LEU C 3 65 ? -12.677 -34.774 -45.465 1.00 56.71 ? 66 LEU C N 1 ATOM 3602 C CA . LEU C 3 65 ? -12.131 -34.723 -46.817 1.00 55.42 ? 66 LEU C CA 1 ATOM 3603 C C . LEU C 3 65 ? -13.058 -33.975 -47.775 1.00 58.17 ? 66 LEU C C 1 ATOM 3604 O O . LEU C 3 65 ? -14.270 -34.206 -47.797 1.00 60.66 ? 66 LEU C O 1 ATOM 3605 C CB . LEU C 3 65 ? -11.834 -36.133 -47.342 1.00 53.78 ? 66 LEU C CB 1 ATOM 3606 C CG . LEU C 3 65 ? -11.388 -36.282 -48.804 1.00 53.00 ? 66 LEU C CG 1 ATOM 3607 C CD1 . LEU C 3 65 ? -10.034 -35.626 -49.055 1.00 51.12 ? 66 LEU C CD1 1 ATOM 3608 C CD2 . LEU C 3 65 ? -11.366 -37.745 -49.229 1.00 52.05 ? 66 LEU C CD2 1 ATOM 3609 N N . ASP C 3 66 ? -12.465 -33.078 -48.557 1.00 58.07 ? 67 ASP C N 1 ATOM 3610 C CA . ASP C 3 66 ? -13.164 -32.362 -49.614 1.00 60.84 ? 67 ASP C CA 1 ATOM 3611 C C . ASP C 3 66 ? -12.380 -32.556 -50.907 1.00 59.54 ? 67 ASP C C 1 ATOM 3612 O O . ASP C 3 66 ? -11.295 -31.999 -51.068 1.00 58.56 ? 67 ASP C O 1 ATOM 3613 C CB . ASP C 3 66 ? -13.278 -30.874 -49.266 1.00 63.16 ? 67 ASP C CB 1 ATOM 3614 C CG . ASP C 3 66 ? -14.285 -30.134 -50.140 1.00 67.90 ? 67 ASP C CG 1 ATOM 3615 O OD1 . ASP C 3 66 ? -15.035 -29.296 -49.593 1.00 71.43 ? 67 ASP C OD1 1 ATOM 3616 O OD2 . ASP C 3 66 ? -14.334 -30.379 -51.367 1.00 69.12 ? 67 ASP C OD2 1 ATOM 3617 N N . LYS C 3 67 ? -12.927 -33.359 -51.817 1.00 59.99 ? 68 LYS C N 1 ATOM 3618 C CA . LYS C 3 67 ? -12.239 -33.698 -53.065 1.00 58.95 ? 68 LYS C CA 1 ATOM 3619 C C . LYS C 3 67 ? -12.302 -32.594 -54.115 1.00 61.60 ? 68 LYS C C 1 ATOM 3620 O O . LYS C 3 67 ? -11.424 -32.501 -54.971 1.00 61.05 ? 68 LYS C O 1 ATOM 3621 C CB . LYS C 3 67 ? -12.763 -35.015 -53.639 1.00 58.81 ? 68 LYS C CB 1 ATOM 3622 C CG . LYS C 3 67 ? -12.233 -36.235 -52.915 1.00 55.77 ? 68 LYS C CG 1 ATOM 3623 C CD . LYS C 3 67 ? -12.522 -37.503 -53.683 1.00 55.59 ? 68 LYS C CD 1 ATOM 3624 C CE . LYS C 3 67 ? -12.105 -38.720 -52.890 1.00 53.20 ? 68 LYS C CE 1 ATOM 3625 N NZ . LYS C 3 67 ? -12.477 -39.969 -53.597 1.00 54.10 ? 68 LYS C NZ 1 ATOM 3626 N N . ASP C 3 68 ? -13.339 -31.764 -54.044 1.00 64.93 ? 69 ASP C N 1 ATOM 3627 C CA . ASP C 3 68 ? -13.484 -30.621 -54.946 1.00 68.37 ? 69 ASP C CA 1 ATOM 3628 C C . ASP C 3 68 ? -12.464 -29.530 -54.621 1.00 68.12 ? 69 ASP C C 1 ATOM 3629 O O . ASP C 3 68 ? -12.076 -28.752 -55.493 1.00 70.41 ? 69 ASP C O 1 ATOM 3630 C CB . ASP C 3 68 ? -14.908 -30.057 -54.886 1.00 72.59 ? 69 ASP C CB 1 ATOM 3631 C CG . ASP C 3 68 ? -15.968 -31.087 -55.256 0.70 73.58 ? 69 ASP C CG 1 ATOM 3632 O OD1 . ASP C 3 68 ? -15.693 -31.970 -56.098 0.70 72.12 ? 69 ASP C OD1 1 ATOM 3633 O OD2 . ASP C 3 68 ? -17.083 -31.009 -54.702 0.70 76.11 ? 69 ASP C OD2 1 ATOM 3634 N N . ALA C 3 69 ? -12.041 -29.480 -53.361 1.00 65.81 ? 70 ALA C N 1 ATOM 3635 C CA . ALA C 3 69 ? -11.002 -28.557 -52.921 1.00 65.37 ? 70 ALA C CA 1 ATOM 3636 C C . ALA C 3 69 ? -9.655 -29.269 -52.839 1.00 61.52 ? 70 ALA C C 1 ATOM 3637 O O . ALA C 3 69 ? -8.610 -28.625 -52.713 1.00 61.26 ? 70 ALA C O 1 ATOM 3638 C CB . ALA C 3 69 ? -11.371 -27.949 -51.571 1.00 65.90 ? 70 ALA C CB 1 ATOM 3639 N N . LYS C 3 70 ? -9.698 -30.600 -52.927 1.00 59.01 ? 71 LYS C N 1 ATOM 3640 C CA . LYS C 3 70 ? -8.524 -31.462 -52.751 1.00 55.64 ? 71 LYS C CA 1 ATOM 3641 C C . LYS C 3 70 ? -7.820 -31.153 -51.425 1.00 54.06 ? 71 LYS C C 1 ATOM 3642 O O . LYS C 3 70 ? -6.601 -30.985 -51.366 1.00 53.02 ? 71 LYS C O 1 ATOM 3643 C CB . LYS C 3 70 ? -7.577 -31.361 -53.953 1.00 56.01 ? 71 LYS C CB 1 ATOM 3644 C CG . LYS C 3 70 ? -8.154 -31.941 -55.237 1.00 57.28 ? 71 LYS C CG 1 ATOM 3645 C CD . LYS C 3 70 ? -7.131 -31.983 -56.358 1.00 58.12 ? 71 LYS C CD 1 ATOM 3646 C CE . LYS C 3 70 ? -7.641 -32.803 -57.537 1.00 59.40 ? 71 LYS C CE 1 ATOM 3647 N NZ . LYS C 3 70 ? -6.695 -32.783 -58.690 1.00 60.59 ? 71 LYS C NZ 1 ATOM 3648 N N . HIS C 3 71 ? -8.621 -31.091 -50.365 1.00 54.30 ? 72 HIS C N 1 ATOM 3649 C CA . HIS C 3 71 ? -8.169 -30.639 -49.058 1.00 53.69 ? 72 HIS C CA 1 ATOM 3650 C C . HIS C 3 71 ? -8.659 -31.574 -47.954 1.00 52.23 ? 72 HIS C C 1 ATOM 3651 O O . HIS C 3 71 ? -9.779 -32.087 -48.012 1.00 53.10 ? 72 HIS C O 1 ATOM 3652 C CB . HIS C 3 71 ? -8.654 -29.205 -48.813 1.00 56.85 ? 72 HIS C CB 1 ATOM 3653 C CG . HIS C 3 71 ? -8.310 -28.665 -47.459 1.00 57.21 ? 72 HIS C CG 1 ATOM 3654 N ND1 . HIS C 3 71 ? -9.227 -28.595 -46.432 1.00 58.76 ? 72 HIS C ND1 1 ATOM 3655 C CD2 . HIS C 3 71 ? -7.152 -28.167 -46.963 1.00 56.84 ? 72 HIS C CD2 1 ATOM 3656 C CE1 . HIS C 3 71 ? -8.649 -28.077 -45.363 1.00 58.37 ? 72 HIS C CE1 1 ATOM 3657 N NE2 . HIS C 3 71 ? -7.389 -27.811 -45.658 1.00 57.33 ? 72 HIS C NE2 1 ATOM 3658 N N . SER C 3 72 ? -7.803 -31.790 -46.957 1.00 50.38 ? 73 SER C N 1 ATOM 3659 C CA . SER C 3 72 ? -8.134 -32.612 -45.797 1.00 49.46 ? 73 SER C CA 1 ATOM 3660 C C . SER C 3 72 ? -7.667 -31.956 -44.497 1.00 49.58 ? 73 SER C C 1 ATOM 3661 O O . SER C 3 72 ? -6.726 -31.160 -44.497 1.00 49.51 ? 73 SER C O 1 ATOM 3662 C CB . SER C 3 72 ? -7.518 -34.004 -45.936 1.00 47.20 ? 73 SER C CB 1 ATOM 3663 O OG . SER C 3 72 ? -7.835 -34.822 -44.826 1.00 46.63 ? 73 SER C OG 1 ATOM 3664 N N . THR C 3 73 ? -8.336 -32.300 -43.399 1.00 50.21 ? 74 THR C N 1 ATOM 3665 C CA . THR C 3 73 ? -8.014 -31.774 -42.072 1.00 50.66 ? 74 THR C CA 1 ATOM 3666 C C . THR C 3 73 ? -8.101 -32.898 -41.041 1.00 49.94 ? 74 THR C C 1 ATOM 3667 O O . THR C 3 73 ? -9.083 -33.637 -41.006 1.00 50.82 ? 74 THR C O 1 ATOM 3668 C CB . THR C 3 73 ? -8.974 -30.622 -41.661 1.00 53.67 ? 74 THR C CB 1 ATOM 3669 O OG1 . THR C 3 73 ? -8.978 -29.604 -42.668 1.00 55.28 ? 74 THR C OG1 1 ATOM 3670 C CG2 . THR C 3 73 ? -8.547 -29.999 -40.345 1.00 54.33 ? 74 THR C CG2 1 ATOM 3671 N N . LEU C 3 74 ? -7.068 -33.026 -40.212 1.00 48.82 ? 75 LEU C N 1 ATOM 3672 C CA . LEU C 3 74 ? -7.078 -33.985 -39.111 1.00 48.76 ? 75 LEU C CA 1 ATOM 3673 C C . LEU C 3 74 ? -7.166 -33.242 -37.787 1.00 50.30 ? 75 LEU C C 1 ATOM 3674 O O . LEU C 3 74 ? -6.339 -32.375 -37.494 1.00 50.18 ? 75 LEU C O 1 ATOM 3675 C CB . LEU C 3 74 ? -5.834 -34.884 -39.146 1.00 46.85 ? 75 LEU C CB 1 ATOM 3676 C CG . LEU C 3 74 ? -5.627 -35.899 -38.012 1.00 47.01 ? 75 LEU C CG 1 ATOM 3677 C CD1 . LEU C 3 74 ? -6.624 -37.047 -38.082 1.00 47.64 ? 75 LEU C CD1 1 ATOM 3678 C CD2 . LEU C 3 74 ? -4.208 -36.434 -38.033 1.00 45.72 ? 75 LEU C CD2 1 ATOM 3679 N N . HIS C 3 75 ? -8.180 -33.584 -36.999 1.00 52.14 ? 76 HIS C N 1 ATOM 3680 C CA . HIS C 3 75 ? -8.386 -32.989 -35.685 1.00 54.03 ? 76 HIS C CA 1 ATOM 3681 C C . HIS C 3 75 ? -7.967 -33.960 -34.592 1.00 54.10 ? 76 HIS C C 1 ATOM 3682 O O . HIS C 3 75 ? -8.340 -35.135 -34.617 1.00 54.32 ? 76 HIS C O 1 ATOM 3683 C CB . HIS C 3 75 ? -9.856 -32.607 -35.487 1.00 57.03 ? 76 HIS C CB 1 ATOM 3684 C CG . HIS C 3 75 ? -10.350 -31.563 -36.440 1.00 57.99 ? 76 HIS C CG 1 ATOM 3685 N ND1 . HIS C 3 75 ? -10.289 -30.214 -36.164 1.00 59.60 ? 76 HIS C ND1 1 ATOM 3686 C CD2 . HIS C 3 75 ? -10.931 -31.671 -37.659 1.00 58.15 ? 76 HIS C CD2 1 ATOM 3687 C CE1 . HIS C 3 75 ? -10.800 -29.535 -37.175 1.00 60.47 ? 76 HIS C CE1 1 ATOM 3688 N NE2 . HIS C 3 75 ? -11.198 -30.395 -38.095 1.00 59.78 ? 76 HIS C NE2 1 ATOM 3689 N N . ILE C 3 76 ? -7.175 -33.466 -33.644 1.00 54.34 ? 77 ILE C N 1 ATOM 3690 C CA . ILE C 3 76 ? -6.891 -34.202 -32.417 1.00 55.48 ? 77 ILE C CA 1 ATOM 3691 C C . ILE C 3 76 ? -7.515 -33.433 -31.260 1.00 58.45 ? 77 ILE C C 1 ATOM 3692 O O . ILE C 3 76 ? -7.077 -32.332 -30.927 1.00 58.69 ? 77 ILE C O 1 ATOM 3693 C CB . ILE C 3 76 ? -5.377 -34.407 -32.169 1.00 53.87 ? 77 ILE C CB 1 ATOM 3694 C CG1 . ILE C 3 76 ? -4.698 -35.013 -33.401 1.00 51.17 ? 77 ILE C CG1 1 ATOM 3695 C CG2 . ILE C 3 76 ? -5.160 -35.301 -30.946 1.00 55.66 ? 77 ILE C CG2 1 ATOM 3696 C CD1 . ILE C 3 76 ? -3.185 -35.079 -33.314 1.00 49.50 ? 77 ILE C CD1 1 ATOM 3697 N N . THR C 3 77 ? -8.551 -34.018 -30.668 1.00 61.18 ? 78 THR C N 1 ATOM 3698 C CA . THR C 3 77 ? -9.285 -33.386 -29.575 1.00 64.80 ? 78 THR C CA 1 ATOM 3699 C C . THR C 3 77 ? -8.712 -33.828 -28.231 1.00 66.43 ? 78 THR C C 1 ATOM 3700 O O . THR C 3 77 ? -8.506 -35.024 -28.004 1.00 66.65 ? 78 THR C O 1 ATOM 3701 C CB . THR C 3 77 ? -10.797 -33.699 -29.666 1.00 67.55 ? 78 THR C CB 1 ATOM 3702 O OG1 . THR C 3 77 ? -11.288 -33.300 -30.952 1.00 66.49 ? 78 THR C OG1 1 ATOM 3703 C CG2 . THR C 3 77 ? -11.578 -32.960 -28.593 1.00 71.51 ? 78 THR C CG2 1 ATOM 3704 N N . ALA C 3 78 ? -8.452 -32.852 -27.357 1.00 68.04 ? 79 ALA C N 1 ATOM 3705 C CA . ALA C 3 78 ? -7.851 -33.080 -26.038 1.00 69.98 ? 79 ALA C CA 1 ATOM 3706 C C . ALA C 3 78 ? -6.544 -33.865 -26.147 1.00 67.78 ? 79 ALA C C 1 ATOM 3707 O O . ALA C 3 78 ? -6.468 -35.030 -25.747 1.00 68.91 ? 79 ALA C O 1 ATOM 3708 C CB . ALA C 3 78 ? -8.842 -33.774 -25.093 1.00 73.87 ? 79 ALA C CB 1 ATOM 3709 N N . THR C 3 79 ? -5.523 -33.207 -26.692 1.00 65.33 ? 80 THR C N 1 ATOM 3710 C CA . THR C 3 79 ? -4.259 -33.856 -27.046 1.00 63.24 ? 80 THR C CA 1 ATOM 3711 C C . THR C 3 79 ? -3.485 -34.365 -25.829 1.00 65.12 ? 80 THR C C 1 ATOM 3712 O O . THR C 3 79 ? -3.423 -33.696 -24.796 1.00 67.40 ? 80 THR C O 1 ATOM 3713 C CB . THR C 3 79 ? -3.357 -32.914 -27.881 1.00 60.90 ? 80 THR C CB 1 ATOM 3714 O OG1 . THR C 3 79 ? -4.165 -32.087 -28.727 1.00 60.66 ? 80 THR C OG1 1 ATOM 3715 C CG2 . THR C 3 79 ? -2.415 -33.714 -28.756 1.00 58.71 ? 80 THR C CG2 1 ATOM 3716 N N . LEU C 3 80 ? -2.907 -35.558 -25.969 1.00 64.64 ? 81 LEU C N 1 ATOM 3717 C CA . LEU C 3 80 ? -2.096 -36.184 -24.919 1.00 66.80 ? 81 LEU C CA 1 ATOM 3718 C C . LEU C 3 80 ? -0.600 -36.090 -25.227 1.00 65.20 ? 81 LEU C C 1 ATOM 3719 O O . LEU C 3 80 ? -0.211 -35.746 -26.346 1.00 62.33 ? 81 LEU C O 1 ATOM 3720 C CB . LEU C 3 80 ? -2.491 -37.655 -24.734 1.00 68.43 ? 81 LEU C CB 1 ATOM 3721 C CG . LEU C 3 80 ? -3.941 -38.022 -24.406 1.00 71.10 ? 81 LEU C CG 1 ATOM 3722 C CD1 . LEU C 3 80 ? -4.081 -39.536 -24.325 1.00 72.93 ? 81 LEU C CD1 1 ATOM 3723 C CD2 . LEU C 3 80 ? -4.424 -37.364 -23.110 1.00 74.77 ? 81 LEU C CD2 1 ATOM 3724 N N . LEU C 3 81 ? 0.230 -36.402 -24.230 1.00 67.44 ? 82 LEU C N 1 ATOM 3725 C CA . LEU C 3 81 ? 1.686 -36.408 -24.393 1.00 66.81 ? 82 LEU C CA 1 ATOM 3726 C C . LEU C 3 81 ? 2.150 -37.433 -25.421 1.00 64.99 ? 82 LEU C C 1 ATOM 3727 O O . LEU C 3 81 ? 2.996 -37.131 -26.263 1.00 63.08 ? 82 LEU C O 1 ATOM 3728 C CB . LEU C 3 81 ? 2.388 -36.673 -23.060 1.00 70.37 ? 82 LEU C CB 1 ATOM 3729 C CG . LEU C 3 81 ? 2.527 -35.532 -22.054 1.00 72.37 ? 82 LEU C CG 1 ATOM 3730 C CD1 . LEU C 3 81 ? 2.973 -36.101 -20.723 1.00 76.81 ? 82 LEU C CD1 1 ATOM 3731 C CD2 . LEU C 3 81 ? 3.505 -34.467 -22.540 1.00 70.79 ? 82 LEU C CD2 1 ATOM 3732 N N . ASP C 3 82 ? 1.587 -38.638 -25.350 1.00 66.05 ? 83 ASP C N 1 ATOM 3733 C CA . ASP C 3 82 ? 1.950 -39.722 -26.266 1.00 64.82 ? 83 ASP C CA 1 ATOM 3734 C C . ASP C 3 82 ? 1.451 -39.480 -27.693 1.00 61.07 ? 83 ASP C C 1 ATOM 3735 O O . ASP C 3 82 ? 1.715 -40.284 -28.590 1.00 60.15 ? 83 ASP C O 1 ATOM 3736 C CB . ASP C 3 82 ? 1.472 -41.078 -25.727 1.00 67.88 ? 83 ASP C CB 1 ATOM 3737 C CG . ASP C 3 82 ? 2.164 -41.471 -24.420 1.00 72.39 ? 83 ASP C CG 1 ATOM 3738 O OD1 . ASP C 3 82 ? 2.180 -40.657 -23.465 1.00 74.01 ? 83 ASP C OD1 1 ATOM 3739 O OD2 . ASP C 3 82 ? 2.685 -42.604 -24.343 1.00 74.84 ? 83 ASP C OD2 1 ATOM 3740 N N . ASP C 3 83 ? 0.745 -38.369 -27.899 1.00 59.36 ? 84 ASP C N 1 ATOM 3741 C CA . ASP C 3 83 ? 0.362 -37.928 -29.243 1.00 56.16 ? 84 ASP C CA 1 ATOM 3742 C C . ASP C 3 83 ? 1.501 -37.197 -29.963 1.00 54.00 ? 84 ASP C C 1 ATOM 3743 O O . ASP C 3 83 ? 1.339 -36.757 -31.102 1.00 51.93 ? 84 ASP C O 1 ATOM 3744 C CB . ASP C 3 83 ? -0.891 -37.044 -29.199 1.00 56.20 ? 84 ASP C CB 1 ATOM 3745 C CG . ASP C 3 83 ? -2.167 -37.840 -28.971 1.00 58.21 ? 84 ASP C CG 1 ATOM 3746 O OD1 . ASP C 3 83 ? -2.218 -39.029 -29.361 1.00 58.73 ? 84 ASP C OD1 1 ATOM 3747 O OD2 . ASP C 3 83 ? -3.130 -37.268 -28.412 1.00 59.93 ? 84 ASP C OD2 1 ATOM 3748 N N . THR C 3 84 ? 2.645 -37.067 -29.294 1.00 54.86 ? 85 THR C N 1 ATOM 3749 C CA . THR C 3 84 ? 3.835 -36.463 -29.891 1.00 53.53 ? 85 THR C CA 1 ATOM 3750 C C . THR C 3 84 ? 4.429 -37.408 -30.935 1.00 52.20 ? 85 THR C C 1 ATOM 3751 O O . THR C 3 84 ? 4.974 -38.465 -30.597 1.00 53.64 ? 85 THR C O 1 ATOM 3752 C CB . THR C 3 84 ? 4.882 -36.088 -28.818 1.00 55.78 ? 85 THR C CB 1 ATOM 3753 O OG1 . THR C 3 84 ? 4.302 -35.153 -27.902 1.00 56.79 ? 85 THR C OG1 1 ATOM 3754 C CG2 . THR C 3 84 ? 6.117 -35.464 -29.448 1.00 55.16 ? 85 THR C CG2 1 ATOM 3755 N N . ALA C 3 85 ? 4.305 -37.007 -32.199 1.00 49.63 ? 86 ALA C N 1 ATOM 3756 C CA . ALA C 3 85 ? 4.678 -37.831 -33.344 1.00 48.32 ? 86 ALA C CA 1 ATOM 3757 C C . ALA C 3 85 ? 4.596 -37.022 -34.638 1.00 46.31 ? 86 ALA C C 1 ATOM 3758 O O . ALA C 3 85 ? 4.119 -35.887 -34.638 1.00 45.85 ? 86 ALA C O 1 ATOM 3759 C CB . ALA C 3 85 ? 3.764 -39.055 -33.431 1.00 48.32 ? 86 ALA C CB 1 ATOM 3760 N N . THR C 3 86 ? 5.067 -37.608 -35.736 1.00 45.41 ? 87 THR C N 1 ATOM 3761 C CA . THR C 3 86 ? 4.894 -37.014 -37.055 1.00 43.85 ? 87 THR C CA 1 ATOM 3762 C C . THR C 3 86 ? 3.604 -37.547 -37.672 1.00 42.46 ? 87 THR C C 1 ATOM 3763 O O . THR C 3 86 ? 3.352 -38.752 -37.664 1.00 42.66 ? 87 THR C O 1 ATOM 3764 C CB . THR C 3 86 ? 6.086 -37.319 -37.987 1.00 44.20 ? 87 THR C CB 1 ATOM 3765 O OG1 . THR C 3 86 ? 7.306 -36.925 -37.352 1.00 46.01 ? 87 THR C OG1 1 ATOM 3766 C CG2 . THR C 3 86 ? 5.951 -36.565 -39.305 1.00 43.21 ? 87 THR C CG2 1 ATOM 3767 N N . TYR C 3 87 ? 2.781 -36.642 -38.188 1.00 41.47 ? 88 TYR C N 1 ATOM 3768 C CA . TYR C 3 87 ? 1.540 -37.032 -38.837 1.00 40.58 ? 88 TYR C CA 1 ATOM 3769 C C . TYR C 3 87 ? 1.658 -36.826 -40.339 1.00 39.92 ? 88 TYR C C 1 ATOM 3770 O O . TYR C 3 87 ? 1.970 -35.726 -40.806 1.00 40.07 ? 88 TYR C O 1 ATOM 3771 C CB . TYR C 3 87 ? 0.350 -36.281 -38.232 1.00 40.80 ? 88 TYR C CB 1 ATOM 3772 C CG . TYR C 3 87 ? 0.086 -36.672 -36.791 1.00 41.64 ? 88 TYR C CG 1 ATOM 3773 C CD1 . TYR C 3 87 ? 0.752 -36.035 -35.740 1.00 42.26 ? 88 TYR C CD1 1 ATOM 3774 C CD2 . TYR C 3 87 ? -0.810 -37.694 -36.479 1.00 41.31 ? 88 TYR C CD2 1 ATOM 3775 C CE1 . TYR C 3 87 ? 0.526 -36.401 -34.418 1.00 43.13 ? 88 TYR C CE1 1 ATOM 3776 C CE2 . TYR C 3 87 ? -1.041 -38.067 -35.160 1.00 42.76 ? 88 TYR C CE2 1 ATOM 3777 C CZ . TYR C 3 87 ? -0.370 -37.416 -34.136 1.00 43.62 ? 88 TYR C CZ 1 ATOM 3778 O OH . TYR C 3 87 ? -0.595 -37.779 -32.829 1.00 45.31 ? 88 TYR C OH 1 ATOM 3779 N N . ILE C 3 88 ? 1.426 -37.906 -41.083 1.00 39.59 ? 89 ILE C N 1 ATOM 3780 C CA . ILE C 3 88 ? 1.667 -37.941 -42.520 1.00 39.22 ? 89 ILE C CA 1 ATOM 3781 C C . ILE C 3 88 ? 0.361 -38.135 -43.296 1.00 39.05 ? 89 ILE C C 1 ATOM 3782 O O . ILE C 3 88 ? -0.456 -38.997 -42.956 1.00 39.27 ? 89 ILE C O 1 ATOM 3783 C CB . ILE C 3 88 ? 2.713 -39.034 -42.878 1.00 39.63 ? 89 ILE C CB 1 ATOM 3784 C CG1 . ILE C 3 88 ? 4.059 -38.712 -42.215 1.00 40.19 ? 89 ILE C CG1 1 ATOM 3785 C CG2 . ILE C 3 88 ? 2.878 -39.179 -44.401 1.00 39.43 ? 89 ILE C CG2 1 ATOM 3786 C CD1 . ILE C 3 88 ? 5.002 -39.892 -42.093 1.00 40.89 ? 89 ILE C CD1 1 ATOM 3787 N N . CYS C 3 89 ? 0.180 -37.317 -44.330 1.00 39.25 ? 90 CYS C N 1 ATOM 3788 C CA . CYS C 3 89 ? -0.985 -37.371 -45.208 1.00 39.68 ? 90 CYS C CA 1 ATOM 3789 C C . CYS C 3 89 ? -0.651 -38.183 -46.460 1.00 39.54 ? 90 CYS C C 1 ATOM 3790 O O . CYS C 3 89 ? 0.352 -37.917 -47.126 1.00 40.06 ? 90 CYS C O 1 ATOM 3791 C CB . CYS C 3 89 ? -1.401 -35.948 -45.591 1.00 40.35 ? 90 CYS C CB 1 ATOM 3792 S SG . CYS C 3 89 ? -2.893 -35.831 -46.587 1.00 42.92 ? 90 CYS C SG 1 ATOM 3793 N N . VAL C 3 90 ? -1.484 -39.174 -46.775 1.00 39.51 ? 91 VAL C N 1 ATOM 3794 C CA . VAL C 3 90 ? -1.236 -40.066 -47.919 1.00 39.65 ? 91 VAL C CA 1 ATOM 3795 C C . VAL C 3 90 ? -2.456 -40.197 -48.841 1.00 40.17 ? 91 VAL C C 1 ATOM 3796 O O . VAL C 3 90 ? -3.550 -40.555 -48.395 1.00 40.74 ? 91 VAL C O 1 ATOM 3797 C CB . VAL C 3 90 ? -0.779 -41.480 -47.462 1.00 39.93 ? 91 VAL C CB 1 ATOM 3798 C CG1 . VAL C 3 90 ? -0.484 -42.376 -48.662 1.00 40.25 ? 91 VAL C CG1 1 ATOM 3799 C CG2 . VAL C 3 90 ? 0.444 -41.389 -46.562 1.00 40.15 ? 91 VAL C CG2 1 ATOM 3800 N N . VAL C 3 91 ? -2.252 -39.919 -50.128 1.00 40.37 ? 92 VAL C N 1 ATOM 3801 C CA . VAL C 3 91 ? -3.304 -40.038 -51.135 1.00 40.91 ? 92 VAL C CA 1 ATOM 3802 C C . VAL C 3 91 ? -2.999 -41.199 -52.084 1.00 41.36 ? 92 VAL C C 1 ATOM 3803 O O . VAL C 3 91 ? -1.886 -41.303 -52.608 1.00 41.69 ? 92 VAL C O 1 ATOM 3804 C CB . VAL C 3 91 ? -3.459 -38.723 -51.951 1.00 41.81 ? 92 VAL C CB 1 ATOM 3805 C CG1 . VAL C 3 91 ? -4.622 -38.820 -52.937 1.00 42.61 ? 92 VAL C CG1 1 ATOM 3806 C CG2 . VAL C 3 91 ? -3.641 -37.522 -51.025 1.00 41.50 ? 92 VAL C CG2 1 ATOM 3807 N N . GLY C 3 92 ? -3.988 -42.066 -52.297 1.00 41.79 ? 93 GLY C N 1 ATOM 3808 C CA . GLY C 3 92 ? -3.873 -43.174 -53.250 1.00 42.37 ? 93 GLY C CA 1 ATOM 3809 C C . GLY C 3 92 ? -4.694 -42.920 -54.500 1.00 43.38 ? 93 GLY C C 1 ATOM 3810 O O . GLY C 3 92 ? -5.842 -42.490 -54.412 1.00 43.99 ? 93 GLY C O 1 ATOM 3811 N N . ASP C 3 93 ? -4.112 -43.197 -55.666 1.00 44.04 ? 94 ASP C N 1 ATOM 3812 C CA . ASP C 3 93 ? -4.732 -42.830 -56.947 1.00 45.28 ? 94 ASP C CA 1 ATOM 3813 C C . ASP C 3 93 ? -5.580 -43.916 -57.626 1.00 46.71 ? 94 ASP C C 1 ATOM 3814 O O . ASP C 3 93 ? -6.129 -43.692 -58.707 1.00 48.16 ? 94 ASP C O 1 ATOM 3815 C CB . ASP C 3 93 ? -3.691 -42.249 -57.919 1.00 45.86 ? 94 ASP C CB 1 ATOM 3816 C CG . ASP C 3 93 ? -2.535 -43.199 -58.197 1.00 46.28 ? 94 ASP C CG 1 ATOM 3817 O OD1 . ASP C 3 93 ? -2.720 -44.435 -58.134 1.00 46.83 ? 94 ASP C OD1 1 ATOM 3818 O OD2 . ASP C 3 93 ? -1.431 -42.697 -58.498 1.00 46.56 ? 94 ASP C OD2 1 ATOM 3819 N N . ARG C 3 94 ? -5.680 -45.084 -56.994 1.00 46.66 ? 95 ARG C N 1 ATOM 3820 C CA . ARG C 3 94 ? -6.549 -46.162 -57.474 1.00 48.55 ? 95 ARG C CA 1 ATOM 3821 C C . ARG C 3 94 ? -7.261 -46.840 -56.310 1.00 48.85 ? 95 ARG C C 1 ATOM 3822 O O . ARG C 3 94 ? -6.788 -46.798 -55.179 1.00 47.85 ? 95 ARG C O 1 ATOM 3823 C CB . ARG C 3 94 ? -5.756 -47.218 -58.256 1.00 49.60 ? 95 ARG C CB 1 ATOM 3824 C CG . ARG C 3 94 ? -5.024 -46.731 -59.508 1.00 49.96 ? 95 ARG C CG 1 ATOM 3825 C CD . ARG C 3 94 ? -5.962 -46.426 -60.675 1.00 51.45 ? 95 ARG C CD 1 ATOM 3826 N NE . ARG C 3 94 ? -5.212 -46.185 -61.909 1.00 52.41 ? 95 ARG C NE 1 ATOM 3827 C CZ . ARG C 3 94 ? -4.642 -45.028 -62.241 1.00 52.11 ? 95 ARG C CZ 1 ATOM 3828 N NH1 . ARG C 3 94 ? -3.976 -44.925 -63.381 1.00 53.59 ? 95 ARG C NH1 1 ATOM 3829 N NH2 . ARG C 3 94 ? -4.724 -43.974 -61.437 1.00 50.87 ? 95 ARG C NH2 1 ATOM 3830 N N . GLY C 3 95 ? -8.402 -47.461 -56.594 1.00 50.95 ? 96 GLY C N 1 ATOM 3831 C CA . GLY C 3 95 ? -9.089 -48.295 -55.614 1.00 52.12 ? 96 GLY C CA 1 ATOM 3832 C C . GLY C 3 95 ? -8.796 -49.759 -55.878 1.00 53.98 ? 96 GLY C C 1 ATOM 3833 O O . GLY C 3 95 ? -9.672 -50.614 -55.724 1.00 56.55 ? 96 GLY C O 1 ATOM 3834 N N . SER C 3 96 ? -7.557 -50.041 -56.283 1.00 53.14 ? 97 SER C N 1 ATOM 3835 C CA . SER C 3 96 ? -7.130 -51.389 -56.658 1.00 55.08 ? 97 SER C CA 1 ATOM 3836 C C . SER C 3 96 ? -5.643 -51.599 -56.370 1.00 54.07 ? 97 SER C C 1 ATOM 3837 O O . SER C 3 96 ? -4.951 -50.679 -55.931 1.00 51.82 ? 97 SER C O 1 ATOM 3838 C CB . SER C 3 96 ? -7.412 -51.640 -58.140 1.00 56.67 ? 97 SER C CB 1 ATOM 3839 O OG . SER C 3 96 ? -6.610 -50.802 -58.953 1.00 54.93 ? 97 SER C OG 1 ATOM 3840 N N . ALA C 3 97 ? -5.161 -52.810 -56.639 1.00 56.25 ? 98 ALA C N 1 ATOM 3841 C CA . ALA C 3 97 ? -3.763 -53.176 -56.412 1.00 56.21 ? 98 ALA C CA 1 ATOM 3842 C C . ALA C 3 97 ? -2.785 -52.415 -57.309 1.00 54.97 ? 98 ALA C C 1 ATOM 3843 O O . ALA C 3 97 ? -1.591 -52.357 -57.015 1.00 54.69 ? 98 ALA C O 1 ATOM 3844 C CB . ALA C 3 97 ? -3.577 -54.683 -56.584 1.00 59.52 ? 98 ALA C CB 1 ATOM 3845 N N . LEU C 3 98 ? -3.296 -51.829 -58.390 1.00 54.84 ? 99 LEU C N 1 ATOM 3846 C CA . LEU C 3 98 ? -2.462 -51.131 -59.372 1.00 54.48 ? 99 LEU C CA 1 ATOM 3847 C C . LEU C 3 98 ? -2.211 -49.667 -58.992 1.00 52.09 ? 99 LEU C C 1 ATOM 3848 O O . LEU C 3 98 ? -1.765 -48.864 -59.817 1.00 52.00 ? 99 LEU C O 1 ATOM 3849 C CB . LEU C 3 98 ? -3.083 -51.230 -60.772 1.00 56.13 ? 99 LEU C CB 1 ATOM 3850 C CG . LEU C 3 98 ? -3.476 -52.615 -61.307 1.00 58.89 ? 99 LEU C CG 1 ATOM 3851 C CD1 . LEU C 3 98 ? -4.320 -52.478 -62.565 1.00 60.35 ? 99 LEU C CD1 1 ATOM 3852 C CD2 . LEU C 3 98 ? -2.266 -53.510 -61.565 1.00 60.26 ? 99 LEU C CD2 1 ATOM 3853 N N . GLY C 3 99 ? -2.483 -49.335 -57.733 1.00 50.59 ? 100 GLY C N 1 ATOM 3854 C CA . GLY C 3 99 ? -2.368 -47.967 -57.245 1.00 48.60 ? 100 GLY C CA 1 ATOM 3855 C C . GLY C 3 99 ? -0.980 -47.563 -56.790 1.00 47.86 ? 100 GLY C C 1 ATOM 3856 O O . GLY C 3 99 ? -0.133 -48.413 -56.491 1.00 48.76 ? 100 GLY C O 1 ATOM 3857 N N . ARG C 3 100 ? -0.760 -46.252 -56.752 1.00 46.63 ? 103 ARG C N 1 ATOM 3858 C CA . ARG C 3 100 ? 0.470 -45.667 -56.241 1.00 46.19 ? 103 ARG C CA 1 ATOM 3859 C C . ARG C 3 100 ? 0.098 -44.685 -55.138 1.00 44.34 ? 103 ARG C C 1 ATOM 3860 O O . ARG C 3 100 ? -0.770 -43.830 -55.329 1.00 44.04 ? 103 ARG C O 1 ATOM 3861 C CB . ARG C 3 100 ? 1.228 -44.946 -57.360 1.00 47.34 ? 103 ARG C CB 1 ATOM 3862 C CG . ARG C 3 100 ? 2.671 -44.543 -57.015 1.00 48.51 ? 103 ARG C CG 1 ATOM 3863 C CD . ARG C 3 100 ? 3.685 -45.658 -57.304 1.00 51.31 ? 103 ARG C CD 1 ATOM 3864 N NE . ARG C 3 100 ? 3.928 -45.859 -58.736 0.70 53.80 ? 103 ARG C NE 1 ATOM 3865 C CZ . ARG C 3 100 ? 3.416 -46.849 -59.466 0.70 55.23 ? 103 ARG C CZ 1 ATOM 3866 N NH1 . ARG C 3 100 ? 3.702 -46.932 -60.760 0.70 57.44 ? 103 ARG C NH1 1 ATOM 3867 N NH2 . ARG C 3 100 ? 2.621 -47.759 -58.914 0.70 54.28 ? 103 ARG C NH2 1 ATOM 3868 N N . LEU C 3 101 ? 0.743 -44.824 -53.983 1.00 43.54 ? 104 LEU C N 1 ATOM 3869 C CA . LEU C 3 101 ? 0.520 -43.916 -52.861 1.00 41.77 ? 104 LEU C CA 1 ATOM 3870 C C . LEU C 3 101 ? 1.405 -42.687 -52.975 1.00 41.48 ? 104 LEU C C 1 ATOM 3871 O O . LEU C 3 101 ? 2.579 -42.784 -53.330 1.00 42.41 ? 104 LEU C O 1 ATOM 3872 C CB . LEU C 3 101 ? 0.769 -44.620 -51.524 1.00 41.64 ? 104 LEU C CB 1 ATOM 3873 C CG . LEU C 3 101 ? -0.147 -45.787 -51.134 1.00 42.35 ? 104 LEU C CG 1 ATOM 3874 C CD1 . LEU C 3 101 ? 0.229 -46.297 -49.754 1.00 42.25 ? 104 LEU C CD1 1 ATOM 3875 C CD2 . LEU C 3 101 ? -1.625 -45.395 -51.183 1.00 41.63 ? 104 LEU C CD2 1 ATOM 3876 N N . HIS C 3 102 ? 0.826 -41.529 -52.678 1.00 40.64 ? 105 HIS C N 1 ATOM 3877 C CA . HIS C 3 102 ? 1.553 -40.265 -52.719 1.00 40.80 ? 105 HIS C CA 1 ATOM 3878 C C . HIS C 3 102 ? 1.673 -39.711 -51.309 1.00 39.69 ? 105 HIS C C 1 ATOM 3879 O O . HIS C 3 102 ? 0.669 -39.531 -50.621 1.00 38.92 ? 105 HIS C O 1 ATOM 3880 C CB . HIS C 3 102 ? 0.844 -39.276 -53.642 1.00 41.48 ? 105 HIS C CB 1 ATOM 3881 C CG . HIS C 3 102 ? 0.658 -39.787 -55.034 1.00 42.73 ? 105 HIS C CG 1 ATOM 3882 N ND1 . HIS C 3 102 ? 1.481 -39.419 -56.077 1.00 44.88 ? 105 HIS C ND1 1 ATOM 3883 C CD2 . HIS C 3 102 ? -0.245 -40.652 -55.553 1.00 42.90 ? 105 HIS C CD2 1 ATOM 3884 C CE1 . HIS C 3 102 ? 1.087 -40.029 -57.181 1.00 45.77 ? 105 HIS C CE1 1 ATOM 3885 N NE2 . HIS C 3 102 ? 0.043 -40.784 -56.890 1.00 44.84 ? 105 HIS C NE2 1 ATOM 3886 N N . PHE C 3 103 ? 2.908 -39.456 -50.884 1.00 40.03 ? 106 PHE C N 1 ATOM 3887 C CA . PHE C 3 103 ? 3.194 -39.089 -49.497 1.00 39.28 ? 106 PHE C CA 1 ATOM 3888 C C . PHE C 3 103 ? 3.518 -37.606 -49.317 1.00 39.90 ? 106 PHE C C 1 ATOM 3889 O O . PHE C 3 103 ? 4.199 -37.000 -50.152 1.00 41.25 ? 106 PHE C O 1 ATOM 3890 C CB . PHE C 3 103 ? 4.353 -39.929 -48.956 1.00 39.74 ? 106 PHE C CB 1 ATOM 3891 C CG . PHE C 3 103 ? 4.077 -41.405 -48.916 1.00 39.25 ? 106 PHE C CG 1 ATOM 3892 C CD1 . PHE C 3 103 ? 4.157 -42.178 -50.072 1.00 39.29 ? 106 PHE C CD1 1 ATOM 3893 C CD2 . PHE C 3 103 ? 3.768 -42.031 -47.714 1.00 38.69 ? 106 PHE C CD2 1 ATOM 3894 C CE1 . PHE C 3 103 ? 3.910 -43.549 -50.034 1.00 39.57 ? 106 PHE C CE1 1 ATOM 3895 C CE2 . PHE C 3 103 ? 3.519 -43.404 -47.664 1.00 39.35 ? 106 PHE C CE2 1 ATOM 3896 C CZ . PHE C 3 103 ? 3.593 -44.164 -48.829 1.00 39.70 ? 106 PHE C CZ 1 ATOM 3897 N N . GLY C 3 104 ? 3.019 -37.033 -48.224 1.00 39.20 ? 107 GLY C N 1 ATOM 3898 C CA . GLY C 3 104 ? 3.416 -35.697 -47.788 1.00 40.22 ? 107 GLY C CA 1 ATOM 3899 C C . GLY C 3 104 ? 4.552 -35.776 -46.782 1.00 40.81 ? 107 GLY C C 1 ATOM 3900 O O . GLY C 3 104 ? 4.728 -36.796 -46.112 1.00 40.30 ? 107 GLY C O 1 ATOM 3901 N N . ALA C 3 105 ? 5.319 -34.694 -46.667 1.00 42.42 ? 108 ALA C N 1 ATOM 3902 C CA . ALA C 3 105 ? 6.491 -34.656 -45.787 1.00 43.50 ? 108 ALA C CA 1 ATOM 3903 C C . ALA C 3 105 ? 6.137 -34.875 -44.318 1.00 42.69 ? 108 ALA C C 1 ATOM 3904 O O . ALA C 3 105 ? 6.963 -35.356 -43.539 1.00 43.52 ? 108 ALA C O 1 ATOM 3905 C CB . ALA C 3 105 ? 7.239 -33.349 -45.961 1.00 45.73 ? 108 ALA C CB 1 ATOM 3906 N N . GLY C 3 106 ? 4.912 -34.518 -43.946 1.00 41.62 ? 109 GLY C N 1 ATOM 3907 C CA . GLY C 3 106 ? 4.438 -34.708 -42.583 1.00 41.06 ? 109 GLY C CA 1 ATOM 3908 C C . GLY C 3 106 ? 4.490 -33.456 -41.729 1.00 42.09 ? 109 GLY C C 1 ATOM 3909 O O . GLY C 3 106 ? 5.290 -32.553 -41.982 1.00 43.33 ? 109 GLY C O 1 ATOM 3910 N N . THR C 3 107 ? 3.616 -33.408 -40.726 1.00 41.75 ? 110 THR C N 1 ATOM 3911 C CA . THR C 3 107 ? 3.651 -32.381 -39.692 1.00 43.16 ? 110 THR C CA 1 ATOM 3912 C C . THR C 3 107 ? 4.187 -33.005 -38.407 1.00 43.61 ? 110 THR C C 1 ATOM 3913 O O . THR C 3 107 ? 3.720 -34.063 -37.984 1.00 43.04 ? 110 THR C O 1 ATOM 3914 C CB . THR C 3 107 ? 2.247 -31.789 -39.413 1.00 43.15 ? 110 THR C CB 1 ATOM 3915 O OG1 . THR C 3 107 ? 1.657 -31.332 -40.636 1.00 43.53 ? 110 THR C OG1 1 ATOM 3916 C CG2 . THR C 3 107 ? 2.331 -30.622 -38.437 1.00 44.75 ? 110 THR C CG2 1 ATOM 3917 N N . GLN C 3 108 ? 5.171 -32.351 -37.798 1.00 45.24 ? 111 GLN C N 1 ATOM 3918 C CA . GLN C 3 108 ? 5.692 -32.777 -36.505 1.00 46.21 ? 111 GLN C CA 1 ATOM 3919 C C . GLN C 3 108 ? 4.857 -32.141 -35.395 1.00 46.81 ? 111 GLN C C 1 ATOM 3920 O O . GLN C 3 108 ? 4.800 -30.914 -35.278 1.00 47.99 ? 111 GLN C O 1 ATOM 3921 C CB . GLN C 3 108 ? 7.165 -32.385 -36.371 1.00 48.21 ? 111 GLN C CB 1 ATOM 3922 C CG . GLN C 3 108 ? 7.869 -32.944 -35.136 1.00 50.14 ? 111 GLN C CG 1 ATOM 3923 C CD . GLN C 3 108 ? 9.345 -32.568 -35.084 0.70 53.07 ? 111 GLN C CD 1 ATOM 3924 O OE1 . GLN C 3 108 ? 9.781 -31.837 -34.190 0.70 54.65 ? 111 GLN C OE1 1 ATOM 3925 N NE2 . GLN C 3 108 ? 10.118 -33.059 -36.051 0.70 53.53 ? 111 GLN C NE2 1 ATOM 3926 N N . LEU C 3 109 ? 4.199 -32.978 -34.594 1.00 46.37 ? 112 LEU C N 1 ATOM 3927 C CA . LEU C 3 109 ? 3.400 -32.494 -33.472 1.00 47.26 ? 112 LEU C CA 1 ATOM 3928 C C . LEU C 3 109 ? 4.166 -32.615 -32.161 1.00 49.13 ? 112 LEU C C 1 ATOM 3929 O O . LEU C 3 109 ? 4.621 -33.705 -31.800 1.00 49.47 ? 112 LEU C O 1 ATOM 3930 C CB . LEU C 3 109 ? 2.062 -33.236 -33.381 1.00 46.50 ? 112 LEU C CB 1 ATOM 3931 C CG . LEU C 3 109 ? 1.072 -32.725 -32.323 1.00 47.83 ? 112 LEU C CG 1 ATOM 3932 C CD1 . LEU C 3 109 ? 0.406 -31.426 -32.757 1.00 47.89 ? 112 LEU C CD1 1 ATOM 3933 C CD2 . LEU C 3 109 ? 0.022 -33.769 -32.006 1.00 47.91 ? 112 LEU C CD2 1 ATOM 3934 N N . ILE C 3 110 ? 4.301 -31.488 -31.463 1.00 50.61 ? 113 ILE C N 1 ATOM 3935 C CA . ILE C 3 110 ? 4.970 -31.431 -30.163 1.00 52.84 ? 113 ILE C CA 1 ATOM 3936 C C . ILE C 3 110 ? 3.980 -31.017 -29.072 1.00 54.08 ? 113 ILE C C 1 ATOM 3937 O O . ILE C 3 110 ? 3.464 -29.895 -29.074 1.00 54.64 ? 113 ILE C O 1 ATOM 3938 C CB . ILE C 3 110 ? 6.175 -30.451 -30.169 1.00 54.60 ? 113 ILE C CB 1 ATOM 3939 C CG1 . ILE C 3 110 ? 7.179 -30.830 -31.264 1.00 54.11 ? 113 ILE C CG1 1 ATOM 3940 C CG2 . ILE C 3 110 ? 6.853 -30.413 -28.791 1.00 57.07 ? 113 ILE C CG2 1 ATOM 3941 C CD1 . ILE C 3 110 ? 8.104 -29.695 -31.686 1.00 56.15 ? 113 ILE C CD1 1 ATOM 3942 N N . VAL C 3 111 ? 3.726 -31.930 -28.141 1.00 54.88 ? 114 VAL C N 1 ATOM 3943 C CA . VAL C 3 111 ? 2.781 -31.691 -27.057 1.00 56.53 ? 114 VAL C CA 1 ATOM 3944 C C . VAL C 3 111 ? 3.536 -31.325 -25.784 1.00 59.31 ? 114 VAL C C 1 ATOM 3945 O O . VAL C 3 111 ? 4.253 -32.153 -25.217 1.00 60.50 ? 114 VAL C O 1 ATOM 3946 C CB . VAL C 3 111 ? 1.874 -32.919 -26.819 1.00 56.46 ? 114 VAL C CB 1 ATOM 3947 C CG1 . VAL C 3 111 ? 0.887 -32.650 -25.692 1.00 59.00 ? 114 VAL C CG1 1 ATOM 3948 C CG2 . VAL C 3 111 ? 1.135 -33.287 -28.099 1.00 53.91 ? 114 VAL C CG2 1 ATOM 3949 N N . ILE C 3 112 ? 3.375 -30.076 -25.350 1.00 60.74 ? 115 ILE C N 1 ATOM 3950 C CA . ILE C 3 112 ? 4.069 -29.566 -24.167 1.00 63.63 ? 115 ILE C CA 1 ATOM 3951 C C . ILE C 3 112 ? 3.212 -29.693 -22.906 1.00 66.00 ? 115 ILE C C 1 ATOM 3952 O O . ILE C 3 112 ? 2.048 -29.286 -22.902 1.00 66.19 ? 115 ILE C O 1 ATOM 3953 C CB . ILE C 3 112 ? 4.565 -28.106 -24.355 1.00 64.67 ? 115 ILE C CB 1 ATOM 3954 C CG1 . ILE C 3 112 ? 3.455 -27.206 -24.913 1.00 64.03 ? 115 ILE C CG1 1 ATOM 3955 C CG2 . ILE C 3 112 ? 5.797 -28.080 -25.260 1.00 63.92 ? 115 ILE C CG2 1 ATOM 3956 C CD1 . ILE C 3 112 ? 3.689 -25.718 -24.698 1.00 66.52 ? 115 ILE C CD1 1 ATOM 3957 N N . PRO C 3 113 ? 3.789 -30.262 -21.830 1.00 59.19 ? 116 PRO C N 1 ATOM 3958 C CA . PRO C 3 113 ? 3.005 -30.565 -20.636 1.00 58.86 ? 116 PRO C CA 1 ATOM 3959 C C . PRO C 3 113 ? 2.611 -29.313 -19.863 1.00 59.14 ? 116 PRO C C 1 ATOM 3960 O O . PRO C 3 113 ? 3.388 -28.357 -19.787 1.00 58.01 ? 116 PRO C O 1 ATOM 3961 C CB . PRO C 3 113 ? 3.960 -31.427 -19.806 1.00 55.37 ? 116 PRO C CB 1 ATOM 3962 C CG . PRO C 3 113 ? 5.306 -30.952 -20.188 1.00 53.26 ? 116 PRO C CG 1 ATOM 3963 C CD . PRO C 3 113 ? 5.218 -30.582 -21.641 1.00 55.82 ? 116 PRO C CD 1 ATOM 3964 N N . ASP C 3 114 ? 1.402 -29.322 -19.309 1.00 61.17 ? 117 ASP C N 1 ATOM 3965 C CA . ASP C 3 114 ? 0.949 -28.241 -18.444 1.00 61.71 ? 117 ASP C CA 1 ATOM 3966 C C . ASP C 3 114 ? 1.492 -28.448 -17.033 1.00 58.46 ? 117 ASP C C 1 ATOM 3967 O O . ASP C 3 114 ? 0.983 -29.279 -16.279 1.00 58.69 ? 117 ASP C O 1 ATOM 3968 C CB . ASP C 3 114 ? -0.583 -28.160 -18.434 1.00 65.83 ? 117 ASP C CB 1 ATOM 3969 C CG . ASP C 3 114 ? -1.106 -27.000 -17.597 1.00 67.47 ? 117 ASP C CG 1 ATOM 3970 O OD1 . ASP C 3 114 ? -2.274 -27.068 -17.157 1.00 70.92 ? 117 ASP C OD1 1 ATOM 3971 O OD2 . ASP C 3 114 ? -0.358 -26.021 -17.378 1.00 66.25 ? 117 ASP C OD2 1 ATOM 3972 N N . ILE C 3 115 ? 2.532 -27.694 -16.690 1.00 55.91 ? 118 ILE C N 1 ATOM 3973 C CA . ILE C 3 115 ? 3.130 -27.755 -15.356 1.00 53.26 ? 118 ILE C CA 1 ATOM 3974 C C . ILE C 3 115 ? 2.363 -26.837 -14.403 1.00 54.74 ? 118 ILE C C 1 ATOM 3975 O O . ILE C 3 115 ? 2.477 -25.611 -14.479 1.00 55.50 ? 118 ILE C O 1 ATOM 3976 C CB . ILE C 3 115 ? 4.647 -27.393 -15.385 1.00 50.50 ? 118 ILE C CB 1 ATOM 3977 C CG1 . ILE C 3 115 ? 5.399 -28.226 -16.437 1.00 49.41 ? 118 ILE C CG1 1 ATOM 3978 C CG2 . ILE C 3 115 ? 5.281 -27.529 -13.995 1.00 48.47 ? 118 ILE C CG2 1 ATOM 3979 C CD1 . ILE C 3 115 ? 5.316 -29.751 -16.259 1.00 48.58 ? 118 ILE C CD1 1 ATOM 3980 N N . GLN C 3 116 ? 1.579 -27.447 -13.516 1.00 55.54 ? 119 GLN C N 1 ATOM 3981 C CA . GLN C 3 116 ? 0.698 -26.711 -12.604 1.00 57.72 ? 119 GLN C CA 1 ATOM 3982 C C . GLN C 3 116 ? 1.476 -25.964 -11.521 1.00 56.04 ? 119 GLN C C 1 ATOM 3983 O O . GLN C 3 116 ? 1.093 -24.863 -11.123 1.00 57.82 ? 119 GLN C O 1 ATOM 3984 C CB . GLN C 3 116 ? -0.320 -27.657 -11.958 1.00 59.56 ? 119 GLN C CB 1 ATOM 3985 C CG . GLN C 3 116 ? -1.603 -26.973 -11.465 1.00 63.35 ? 119 GLN C CG 1 ATOM 3986 C CD . GLN C 3 116 ? -2.747 -27.019 -12.476 0.70 66.74 ? 119 GLN C CD 1 ATOM 3987 O OE1 . GLN C 3 116 ? -3.917 -26.947 -12.100 0.70 69.83 ? 119 GLN C OE1 1 ATOM 3988 N NE2 . GLN C 3 116 ? -2.414 -27.140 -13.758 0.70 66.34 ? 119 GLN C NE2 1 ATOM 3989 N N . ASN C 3 117 ? 2.563 -26.570 -11.052 1.00 52.93 ? 120 ASN C N 1 ATOM 3990 C CA . ASN C 3 117 ? 3.404 -25.959 -10.030 1.00 51.53 ? 120 ASN C CA 1 ATOM 3991 C C . ASN C 3 117 ? 4.888 -25.963 -10.399 1.00 48.37 ? 120 ASN C C 1 ATOM 3992 O O . ASN C 3 117 ? 5.615 -26.909 -10.075 1.00 46.49 ? 120 ASN C O 1 ATOM 3993 C CB . ASN C 3 117 ? 3.160 -26.614 -8.669 1.00 51.90 ? 120 ASN C CB 1 ATOM 3994 C CG . ASN C 3 117 ? 1.814 -26.244 -8.088 1.00 55.90 ? 120 ASN C CG 1 ATOM 3995 O OD1 . ASN C 3 117 ? 1.610 -25.119 -7.627 1.00 57.96 ? 120 ASN C OD1 1 ATOM 3996 N ND2 . ASN C 3 117 ? 0.880 -27.189 -8.112 1.00 58.34 ? 120 ASN C ND2 1 ATOM 3997 N N . PRO C 3 118 ? 5.338 -24.898 -11.089 1.00 48.16 ? 121 PRO C N 1 ATOM 3998 C CA . PRO C 3 118 ? 6.744 -24.769 -11.446 1.00 45.74 ? 121 PRO C CA 1 ATOM 3999 C C . PRO C 3 118 ? 7.612 -24.627 -10.201 1.00 44.36 ? 121 PRO C C 1 ATOM 4000 O O . PRO C 3 118 ? 7.312 -23.824 -9.318 1.00 45.80 ? 121 PRO C O 1 ATOM 4001 C CB . PRO C 3 118 ? 6.783 -23.476 -12.269 1.00 47.36 ? 121 PRO C CB 1 ATOM 4002 C CG . PRO C 3 118 ? 5.379 -23.239 -12.697 1.00 50.21 ? 121 PRO C CG 1 ATOM 4003 C CD . PRO C 3 118 ? 4.541 -23.766 -11.591 1.00 50.86 ? 121 PRO C CD 1 ATOM 4004 N N . ASP C 3 119 ? 8.669 -25.426 -10.139 1.00 41.92 ? 122 ASP C N 1 ATOM 4005 C CA . ASP C 3 119 ? 9.667 -25.329 -9.087 1.00 40.71 ? 122 ASP C CA 1 ATOM 4006 C C . ASP C 3 119 ? 11.069 -25.305 -9.726 1.00 38.93 ? 122 ASP C C 1 ATOM 4007 O O . ASP C 3 119 ? 11.900 -26.174 -9.440 1.00 37.54 ? 122 ASP C O 1 ATOM 4008 C CB . ASP C 3 119 ? 9.508 -26.504 -8.114 1.00 40.40 ? 122 ASP C CB 1 ATOM 4009 C CG . ASP C 3 119 ? 10.306 -26.329 -6.835 0.70 40.51 ? 122 ASP C CG 1 ATOM 4010 O OD1 . ASP C 3 119 ? 10.763 -25.201 -6.540 0.70 41.24 ? 122 ASP C OD1 1 ATOM 4011 O OD2 . ASP C 3 119 ? 10.475 -27.335 -6.116 0.70 40.38 ? 122 ASP C OD2 1 ATOM 4012 N N . PRO C 3 120 ? 11.338 -24.297 -10.589 1.00 39.27 ? 123 PRO C N 1 ATOM 4013 C CA . PRO C 3 120 ? 12.565 -24.294 -11.387 1.00 38.27 ? 123 PRO C CA 1 ATOM 4014 C C . PRO C 3 120 ? 13.835 -24.272 -10.538 1.00 37.64 ? 123 PRO C C 1 ATOM 4015 O O . PRO C 3 120 ? 13.926 -23.511 -9.568 1.00 38.76 ? 123 PRO C O 1 ATOM 4016 C CB . PRO C 3 120 ? 12.448 -23.005 -12.207 1.00 40.01 ? 123 PRO C CB 1 ATOM 4017 C CG . PRO C 3 120 ? 11.568 -22.128 -11.405 1.00 41.64 ? 123 PRO C CG 1 ATOM 4018 C CD . PRO C 3 120 ? 10.583 -23.039 -10.753 1.00 41.31 ? 123 PRO C CD 1 ATOM 4019 N N . ALA C 3 121 ? 14.798 -25.110 -10.908 1.00 36.24 ? 124 ALA C N 1 ATOM 4020 C CA . ALA C 3 121 ? 16.078 -25.179 -10.217 1.00 36.10 ? 124 ALA C CA 1 ATOM 4021 C C . ALA C 3 121 ? 17.185 -25.718 -11.124 1.00 35.51 ? 124 ALA C C 1 ATOM 4022 O O . ALA C 3 121 ? 16.909 -26.398 -12.116 1.00 34.86 ? 124 ALA C O 1 ATOM 4023 C CB . ALA C 3 121 ? 15.952 -26.033 -8.962 1.00 35.83 ? 124 ALA C CB 1 ATOM 4024 N N . VAL C 3 122 ? 18.433 -25.396 -10.783 1.00 36.11 ? 125 VAL C N 1 ATOM 4025 C CA . VAL C 3 122 ? 19.605 -25.960 -11.458 1.00 36.09 ? 125 VAL C CA 1 ATOM 4026 C C . VAL C 3 122 ? 20.479 -26.699 -10.438 1.00 36.42 ? 125 VAL C C 1 ATOM 4027 O O . VAL C 3 122 ? 21.060 -26.085 -9.541 1.00 37.51 ? 125 VAL C O 1 ATOM 4028 C CB . VAL C 3 122 ? 20.428 -24.875 -12.213 1.00 37.29 ? 125 VAL C CB 1 ATOM 4029 C CG1 . VAL C 3 122 ? 21.685 -25.471 -12.820 1.00 37.47 ? 125 VAL C CG1 1 ATOM 4030 C CG2 . VAL C 3 122 ? 19.591 -24.220 -13.296 1.00 37.55 ? 125 VAL C CG2 1 ATOM 4031 N N . TYR C 3 123 ? 20.555 -28.019 -10.581 1.00 36.15 ? 126 TYR C N 1 ATOM 4032 C CA . TYR C 3 123 ? 21.290 -28.874 -9.644 1.00 36.96 ? 126 TYR C CA 1 ATOM 4033 C C . TYR C 3 123 ? 22.587 -29.390 -10.247 1.00 37.62 ? 126 TYR C C 1 ATOM 4034 O O . TYR C 3 123 ? 22.680 -29.583 -11.461 1.00 37.22 ? 126 TYR C O 1 ATOM 4035 C CB . TYR C 3 123 ? 20.434 -30.073 -9.225 1.00 36.68 ? 126 TYR C CB 1 ATOM 4036 C CG . TYR C 3 123 ? 19.123 -29.719 -8.562 1.00 37.01 ? 126 TYR C CG 1 ATOM 4037 C CD1 . TYR C 3 123 ? 19.086 -29.243 -7.254 1.00 38.07 ? 126 TYR C CD1 1 ATOM 4038 C CD2 . TYR C 3 123 ? 17.915 -29.879 -9.239 1.00 36.84 ? 126 TYR C CD2 1 ATOM 4039 C CE1 . TYR C 3 123 ? 17.881 -28.923 -6.645 1.00 38.86 ? 126 TYR C CE1 1 ATOM 4040 C CE2 . TYR C 3 123 ? 16.707 -29.563 -8.636 1.00 36.98 ? 126 TYR C CE2 1 ATOM 4041 C CZ . TYR C 3 123 ? 16.698 -29.089 -7.341 1.00 38.10 ? 126 TYR C CZ 1 ATOM 4042 O OH . TYR C 3 123 ? 15.504 -28.775 -6.742 1.00 39.69 ? 126 TYR C OH 1 ATOM 4043 N N . GLN C 3 124 ? 23.579 -29.622 -9.389 1.00 39.19 ? 127 GLN C N 1 ATOM 4044 C CA . GLN C 3 124 ? 24.844 -30.224 -9.807 1.00 40.60 ? 127 GLN C CA 1 ATOM 4045 C C . GLN C 3 124 ? 24.882 -31.703 -9.437 1.00 41.07 ? 127 GLN C C 1 ATOM 4046 O O . GLN C 3 124 ? 24.682 -32.067 -8.275 1.00 41.98 ? 127 GLN C O 1 ATOM 4047 C CB . GLN C 3 124 ? 26.041 -29.488 -9.196 1.00 42.61 ? 127 GLN C CB 1 ATOM 4048 C CG . GLN C 3 124 ? 27.393 -30.007 -9.702 1.00 45.38 ? 127 GLN C CG 1 ATOM 4049 C CD . GLN C 3 124 ? 28.571 -29.141 -9.291 1.00 48.88 ? 127 GLN C CD 1 ATOM 4050 O OE1 . GLN C 3 124 ? 28.537 -28.460 -8.264 1.00 51.00 ? 127 GLN C OE1 1 ATOM 4051 N NE2 . GLN C 3 124 ? 29.628 -29.171 -10.094 1.00 50.39 ? 127 GLN C NE2 1 ATOM 4052 N N . LEU C 3 125 ? 25.145 -32.546 -10.432 1.00 40.96 ? 128 LEU C N 1 ATOM 4053 C CA . LEU C 3 125 ? 25.168 -33.995 -10.237 1.00 41.96 ? 128 LEU C CA 1 ATOM 4054 C C . LEU C 3 125 ? 26.563 -34.554 -10.479 1.00 44.12 ? 128 LEU C C 1 ATOM 4055 O O . LEU C 3 125 ? 27.197 -34.233 -11.483 1.00 44.28 ? 128 LEU C O 1 ATOM 4056 C CB . LEU C 3 125 ? 24.154 -34.677 -11.162 1.00 40.68 ? 128 LEU C CB 1 ATOM 4057 C CG . LEU C 3 125 ? 22.662 -34.606 -10.812 1.00 39.38 ? 128 LEU C CG 1 ATOM 4058 C CD1 . LEU C 3 125 ? 22.045 -33.247 -11.125 1.00 37.49 ? 128 LEU C CD1 1 ATOM 4059 C CD2 . LEU C 3 125 ? 21.918 -35.691 -11.555 1.00 39.13 ? 128 LEU C CD2 1 ATOM 4060 N N . ARG C 3 126 ? 27.034 -35.396 -9.563 1.00 46.33 ? 129 ARG C N 1 ATOM 4061 C CA . ARG C 3 126 ? 28.386 -35.961 -9.659 1.00 49.13 ? 129 ARG C CA 1 ATOM 4062 C C . ARG C 3 126 ? 28.413 -37.400 -10.187 1.00 50.52 ? 129 ARG C C 1 ATOM 4063 O O . ARG C 3 126 ? 27.497 -38.187 -9.933 1.00 50.38 ? 129 ARG C O 1 ATOM 4064 C CB . ARG C 3 126 ? 29.128 -35.847 -8.318 1.00 51.55 ? 129 ARG C CB 1 ATOM 4065 C CG . ARG C 3 126 ? 29.408 -34.411 -7.910 1.00 51.03 ? 129 ARG C CG 1 ATOM 4066 C CD . ARG C 3 126 ? 30.565 -34.301 -6.937 0.70 55.11 ? 129 ARG C CD 1 ATOM 4067 N NE . ARG C 3 126 ? 30.988 -32.910 -6.764 0.70 55.42 ? 129 ARG C NE 1 ATOM 4068 C CZ . ARG C 3 126 ? 31.903 -32.297 -7.513 0.70 56.14 ? 129 ARG C CZ 1 ATOM 4069 N NH1 . ARG C 3 126 ? 32.511 -32.940 -8.503 0.70 56.80 ? 129 ARG C NH1 1 ATOM 4070 N NH2 . ARG C 3 126 ? 32.211 -31.030 -7.272 0.70 56.64 ? 129 ARG C NH2 1 ATOM 4071 N N . ASP C 3 127 ? 29.475 -37.717 -10.925 1.00 52.29 ? 130 ASP C N 1 ATOM 4072 C CA . ASP C 3 127 ? 29.677 -39.025 -11.549 1.00 54.36 ? 130 ASP C CA 1 ATOM 4073 C C . ASP C 3 127 ? 29.712 -40.147 -10.514 1.00 57.37 ? 130 ASP C C 1 ATOM 4074 O O . ASP C 3 127 ? 30.266 -39.988 -9.427 1.00 59.24 ? 130 ASP C O 1 ATOM 4075 C CB . ASP C 3 127 ? 30.976 -38.999 -12.375 1.00 56.33 ? 130 ASP C CB 1 ATOM 4076 C CG . ASP C 3 127 ? 31.237 -40.294 -13.146 1.00 58.65 ? 130 ASP C CG 1 ATOM 4077 O OD1 . ASP C 3 127 ? 30.320 -41.130 -13.303 1.00 58.30 ? 130 ASP C OD1 1 ATOM 4078 O OD2 . ASP C 3 127 ? 32.382 -40.465 -13.615 1.00 61.01 ? 130 ASP C OD2 1 ATOM 4079 N N . SER C 3 128 ? 29.103 -41.276 -10.864 1.00 58.47 ? 131 SER C N 1 ATOM 4080 C CA . SER C 3 128 ? 29.091 -42.465 -10.014 1.00 62.13 ? 131 SER C CA 1 ATOM 4081 C C . SER C 3 128 ? 30.488 -43.059 -9.824 1.00 66.63 ? 131 SER C C 1 ATOM 4082 O O . SER C 3 128 ? 30.839 -43.485 -8.725 1.00 69.71 ? 131 SER C O 1 ATOM 4083 C CB . SER C 3 128 ? 28.149 -43.524 -10.596 1.00 62.45 ? 131 SER C CB 1 ATOM 4084 O OG . SER C 3 128 ? 28.136 -44.696 -9.801 1.00 66.33 ? 131 SER C OG 1 ATOM 4085 N N . LYS C 3 129 ? 31.273 -43.086 -10.899 1.00 67.53 ? 132 LYS C N 1 ATOM 4086 C CA . LYS C 3 129 ? 32.616 -43.658 -10.862 1.00 72.31 ? 132 LYS C CA 1 ATOM 4087 C C . LYS C 3 129 ? 33.631 -42.682 -10.275 1.00 73.31 ? 132 LYS C C 1 ATOM 4088 O O . LYS C 3 129 ? 34.277 -42.980 -9.269 1.00 76.99 ? 132 LYS C O 1 ATOM 4089 C CB . LYS C 3 129 ? 33.057 -44.122 -12.259 1.00 73.21 ? 132 LYS C CB 1 ATOM 4090 C CG . LYS C 3 129 ? 32.397 -45.412 -12.745 1.00 74.64 ? 132 LYS C CG 1 ATOM 4091 C CD . LYS C 3 129 ? 32.965 -46.647 -12.051 1.00 80.11 ? 132 LYS C CD 1 ATOM 4092 N N . SER C 3 130 ? 33.764 -41.518 -10.902 0.70 70.83 ? 133 SER C N 1 ATOM 4093 C CA . SER C 3 130 ? 34.737 -40.523 -10.468 0.70 72.06 ? 133 SER C CA 1 ATOM 4094 C C . SER C 3 130 ? 34.067 -39.340 -9.781 0.70 69.07 ? 133 SER C C 1 ATOM 4095 O O . SER C 3 130 ? 32.917 -39.012 -10.067 0.70 65.40 ? 133 SER C O 1 ATOM 4096 C CB . SER C 3 130 ? 35.585 -40.047 -11.649 1.00 72.42 ? 133 SER C CB 1 ATOM 4097 O OG . SER C 3 130 ? 34.810 -39.301 -12.575 1.00 68.43 ? 133 SER C OG 1 ATOM 4098 N N . SER C 3 131 ? 34.796 -38.708 -8.868 1.00 71.20 ? 134 SER C N 1 ATOM 4099 C CA . SER C 3 131 ? 34.300 -37.529 -8.166 1.00 69.04 ? 134 SER C CA 1 ATOM 4100 C C . SER C 3 131 ? 34.370 -36.277 -9.045 1.00 66.68 ? 134 SER C C 1 ATOM 4101 O O . SER C 3 131 ? 33.486 -35.414 -8.979 1.00 63.52 ? 134 SER C O 1 ATOM 4102 C CB . SER C 3 131 ? 35.081 -37.315 -6.863 1.00 72.61 ? 134 SER C CB 1 ATOM 4103 O OG . SER C 3 131 ? 36.481 -37.432 -7.068 1.00 76.18 ? 134 SER C OG 1 ATOM 4104 N N . ASP C 3 132 ? 35.413 -36.205 -9.875 1.00 68.54 ? 135 ASP C N 1 ATOM 4105 C CA . ASP C 3 132 ? 35.752 -34.995 -10.634 1.00 67.54 ? 135 ASP C CA 1 ATOM 4106 C C . ASP C 3 132 ? 34.729 -34.567 -11.697 1.00 63.60 ? 135 ASP C C 1 ATOM 4107 O O . ASP C 3 132 ? 34.415 -33.379 -11.804 1.00 62.01 ? 135 ASP C O 1 ATOM 4108 C CB . ASP C 3 132 ? 37.159 -35.107 -11.243 1.00 71.23 ? 135 ASP C CB 1 ATOM 4109 C CG . ASP C 3 132 ? 37.289 -36.262 -12.228 0.70 72.16 ? 135 ASP C CG 1 ATOM 4110 O OD1 . ASP C 3 132 ? 36.514 -37.234 -12.125 0.70 70.98 ? 135 ASP C OD1 1 ATOM 4111 O OD2 . ASP C 3 132 ? 38.174 -36.196 -13.107 0.70 74.28 ? 135 ASP C OD2 1 ATOM 4112 N N . LYS C 3 133 ? 34.214 -35.524 -12.471 1.00 62.59 ? 136 LYS C N 1 ATOM 4113 C CA . LYS C 3 133 ? 33.234 -35.222 -13.527 1.00 59.31 ? 136 LYS C CA 1 ATOM 4114 C C . LYS C 3 133 ? 31.849 -34.926 -12.959 1.00 55.89 ? 136 LYS C C 1 ATOM 4115 O O . LYS C 3 133 ? 31.384 -35.610 -12.046 1.00 55.82 ? 136 LYS C O 1 ATOM 4116 C CB . LYS C 3 133 ? 33.147 -36.358 -14.555 1.00 60.00 ? 136 LYS C CB 1 ATOM 4117 C CG . LYS C 3 133 ? 34.349 -36.466 -15.494 1.00 63.10 ? 136 LYS C CG 1 ATOM 4118 C CD . LYS C 3 133 ? 33.987 -37.145 -16.825 1.00 63.41 ? 136 LYS C CD 1 ATOM 4119 C CE . LYS C 3 133 ? 33.875 -38.662 -16.703 1.00 64.79 ? 136 LYS C CE 1 ATOM 4120 N N . SER C 3 134 ? 31.199 -33.901 -13.504 1.00 53.55 ? 137 SER C N 1 ATOM 4121 C CA . SER C 3 134 ? 29.854 -33.516 -13.071 1.00 50.84 ? 137 SER C CA 1 ATOM 4122 C C . SER C 3 134 ? 29.009 -32.936 -14.210 1.00 48.96 ? 137 SER C C 1 ATOM 4123 O O . SER C 3 134 ? 29.546 -32.482 -15.222 1.00 49.50 ? 137 SER C O 1 ATOM 4124 C CB . SER C 3 134 ? 29.921 -32.527 -11.898 1.00 50.79 ? 137 SER C CB 1 ATOM 4125 O OG . SER C 3 134 ? 30.392 -31.258 -12.313 1.00 50.91 ? 137 SER C OG 1 ATOM 4126 N N . VAL C 3 135 ? 27.686 -32.973 -14.032 1.00 47.09 ? 138 VAL C N 1 ATOM 4127 C CA . VAL C 3 135 ? 26.739 -32.331 -14.952 1.00 45.96 ? 138 VAL C CA 1 ATOM 4128 C C . VAL C 3 135 ? 25.834 -31.338 -14.211 1.00 44.78 ? 138 VAL C C 1 ATOM 4129 O O . VAL C 3 135 ? 25.757 -31.360 -12.981 1.00 44.90 ? 138 VAL C O 1 ATOM 4130 C CB . VAL C 3 135 ? 25.863 -33.360 -15.744 1.00 45.23 ? 138 VAL C CB 1 ATOM 4131 C CG1 . VAL C 3 135 ? 26.716 -34.211 -16.668 1.00 47.06 ? 138 VAL C CG1 1 ATOM 4132 C CG2 . VAL C 3 135 ? 25.047 -34.239 -14.808 1.00 44.86 ? 138 VAL C CG2 1 ATOM 4133 N N . CYS C 3 136 ? 25.167 -30.467 -14.967 1.00 44.45 ? 139 CYS C N 1 ATOM 4134 C CA . CYS C 3 136 ? 24.163 -29.548 -14.420 1.00 43.70 ? 139 CYS C CA 1 ATOM 4135 C C . CYS C 3 136 ? 22.789 -29.881 -14.987 1.00 42.32 ? 139 CYS C C 1 ATOM 4136 O O . CYS C 3 136 ? 22.631 -30.044 -16.202 1.00 42.60 ? 139 CYS C O 1 ATOM 4137 C CB . CYS C 3 136 ? 24.506 -28.095 -14.739 1.00 44.80 ? 139 CYS C CB 1 ATOM 4138 S SG . CYS C 3 136 ? 26.156 -27.597 -14.235 1.00 48.47 ? 139 CYS C SG 1 ATOM 4139 N N . LEU C 3 137 ? 21.803 -29.983 -14.100 1.00 41.15 ? 140 LEU C N 1 ATOM 4140 C CA . LEU C 3 137 ? 20.441 -30.328 -14.488 1.00 40.05 ? 140 LEU C CA 1 ATOM 4141 C C . LEU C 3 137 ? 19.478 -29.186 -14.183 1.00 39.76 ? 140 LEU C C 1 ATOM 4142 O O . LEU C 3 137 ? 19.178 -28.905 -13.020 1.00 39.45 ? 140 LEU C O 1 ATOM 4143 C CB . LEU C 3 137 ? 19.994 -31.613 -13.783 1.00 39.78 ? 140 LEU C CB 1 ATOM 4144 C CG . LEU C 3 137 ? 18.550 -32.089 -13.958 1.00 39.11 ? 140 LEU C CG 1 ATOM 4145 C CD1 . LEU C 3 137 ? 18.377 -32.854 -15.262 1.00 39.42 ? 140 LEU C CD1 1 ATOM 4146 C CD2 . LEU C 3 137 ? 18.161 -32.949 -12.781 1.00 39.07 ? 140 LEU C CD2 1 ATOM 4147 N N . PHE C 3 138 ? 19.018 -28.524 -15.242 1.00 40.09 ? 141 PHE C N 1 ATOM 4148 C CA . PHE C 3 138 ? 17.968 -27.519 -15.148 1.00 40.25 ? 141 PHE C CA 1 ATOM 4149 C C . PHE C 3 138 ? 16.653 -28.271 -15.245 1.00 39.93 ? 141 PHE C C 1 ATOM 4150 O O . PHE C 3 138 ? 16.403 -28.953 -16.237 1.00 40.09 ? 141 PHE C O 1 ATOM 4151 C CB . PHE C 3 138 ? 18.114 -26.500 -16.281 1.00 41.56 ? 141 PHE C CB 1 ATOM 4152 C CG . PHE C 3 138 ? 17.096 -25.386 -16.262 1.00 42.06 ? 141 PHE C CG 1 ATOM 4153 C CD1 . PHE C 3 138 ? 16.562 -24.911 -15.068 1.00 40.97 ? 141 PHE C CD1 1 ATOM 4154 C CD2 . PHE C 3 138 ? 16.706 -24.781 -17.454 1.00 43.26 ? 141 PHE C CD2 1 ATOM 4155 C CE1 . PHE C 3 138 ? 15.635 -23.874 -15.066 1.00 42.16 ? 141 PHE C CE1 1 ATOM 4156 C CE2 . PHE C 3 138 ? 15.783 -23.738 -17.459 1.00 44.37 ? 141 PHE C CE2 1 ATOM 4157 C CZ . PHE C 3 138 ? 15.246 -23.286 -16.263 1.00 43.81 ? 141 PHE C CZ 1 ATOM 4158 N N . THR C 3 139 ? 15.828 -28.158 -14.205 1.00 39.76 ? 142 THR C N 1 ATOM 4159 C CA . THR C 3 139 ? 14.625 -28.978 -14.085 1.00 39.80 ? 142 THR C CA 1 ATOM 4160 C C . THR C 3 139 ? 13.442 -28.254 -13.437 1.00 40.57 ? 142 THR C C 1 ATOM 4161 O O . THR C 3 139 ? 13.625 -27.264 -12.725 1.00 40.89 ? 142 THR C O 1 ATOM 4162 C CB . THR C 3 139 ? 14.922 -30.298 -13.318 1.00 39.29 ? 142 THR C CB 1 ATOM 4163 O OG1 . THR C 3 139 ? 13.756 -31.132 -13.316 1.00 40.36 ? 142 THR C OG1 1 ATOM 4164 C CG2 . THR C 3 139 ? 15.344 -30.021 -11.883 1.00 38.72 ? 142 THR C CG2 1 ATOM 4165 N N . ASP C 3 140 ? 12.238 -28.769 -13.702 1.00 41.28 ? 143 ASP C N 1 ATOM 4166 C CA . ASP C 3 140 ? 10.978 -28.325 -13.077 1.00 42.45 ? 143 ASP C CA 1 ATOM 4167 C C . ASP C 3 140 ? 10.545 -26.907 -13.445 1.00 43.80 ? 143 ASP C C 1 ATOM 4168 O O . ASP C 3 140 ? 9.861 -26.240 -12.671 1.00 44.79 ? 143 ASP C O 1 ATOM 4169 C CB . ASP C 3 140 ? 11.008 -28.505 -11.548 1.00 42.24 ? 143 ASP C CB 1 ATOM 4170 C CG . ASP C 3 140 ? 11.328 -29.931 -11.127 1.00 42.15 ? 143 ASP C CG 1 ATOM 4171 O OD1 . ASP C 3 140 ? 11.092 -30.865 -11.922 1.00 42.46 ? 143 ASP C OD1 1 ATOM 4172 O OD2 . ASP C 3 140 ? 11.818 -30.120 -9.993 1.00 42.69 ? 143 ASP C OD2 1 ATOM 4173 N N . PHE C 3 141 ? 10.940 -26.459 -14.632 1.00 44.41 ? 144 PHE C N 1 ATOM 4174 C CA . PHE C 3 141 ? 10.512 -25.164 -15.151 1.00 46.59 ? 144 PHE C CA 1 ATOM 4175 C C . PHE C 3 141 ? 9.242 -25.315 -15.986 1.00 48.86 ? 144 PHE C C 1 ATOM 4176 O O . PHE C 3 141 ? 8.988 -26.385 -16.541 1.00 48.47 ? 144 PHE C O 1 ATOM 4177 C CB . PHE C 3 141 ? 11.633 -24.499 -15.964 1.00 46.71 ? 144 PHE C CB 1 ATOM 4178 C CG . PHE C 3 141 ? 12.274 -25.402 -16.993 1.00 45.61 ? 144 PHE C CG 1 ATOM 4179 C CD1 . PHE C 3 141 ? 11.813 -25.420 -18.306 1.00 46.50 ? 144 PHE C CD1 1 ATOM 4180 C CD2 . PHE C 3 141 ? 13.354 -26.219 -16.653 1.00 43.03 ? 144 PHE C CD2 1 ATOM 4181 C CE1 . PHE C 3 141 ? 12.406 -26.242 -19.256 1.00 45.66 ? 144 PHE C CE1 1 ATOM 4182 C CE2 . PHE C 3 141 ? 13.952 -27.042 -17.597 1.00 41.82 ? 144 PHE C CE2 1 ATOM 4183 C CZ . PHE C 3 141 ? 13.478 -27.054 -18.900 1.00 43.57 ? 144 PHE C CZ 1 ATOM 4184 N N . ASP C 3 142 ? 8.440 -24.255 -16.063 1.00 51.77 ? 145 ASP C N 1 ATOM 4185 C CA . ASP C 3 142 ? 7.230 -24.287 -16.887 1.00 54.95 ? 145 ASP C CA 1 ATOM 4186 C C . ASP C 3 142 ? 7.553 -24.240 -18.385 1.00 56.59 ? 145 ASP C C 1 ATOM 4187 O O . ASP C 3 142 ? 8.619 -23.768 -18.791 1.00 56.26 ? 145 ASP C O 1 ATOM 4188 C CB . ASP C 3 142 ? 6.227 -23.189 -16.486 1.00 57.72 ? 145 ASP C CB 1 ATOM 4189 C CG . ASP C 3 142 ? 6.778 -21.777 -16.658 0.70 59.65 ? 145 ASP C CG 1 ATOM 4190 O OD1 . ASP C 3 142 ? 7.981 -21.611 -16.964 0.70 59.05 ? 145 ASP C OD1 1 ATOM 4191 O OD2 . ASP C 3 142 ? 5.993 -20.820 -16.476 0.70 62.45 ? 145 ASP C OD2 1 ATOM 4192 N N . SER C 3 143 ? 6.618 -24.730 -19.195 1.00 58.97 ? 146 SER C N 1 ATOM 4193 C CA . SER C 3 143 ? 6.789 -24.820 -20.643 1.00 61.16 ? 146 SER C CA 1 ATOM 4194 C C . SER C 3 143 ? 6.913 -23.443 -21.310 1.00 64.40 ? 146 SER C C 1 ATOM 4195 O O . SER C 3 143 ? 7.029 -23.331 -22.535 1.00 66.60 ? 146 SER C O 1 ATOM 4196 C CB . SER C 3 143 ? 5.640 -25.635 -21.240 1.00 63.18 ? 146 SER C CB 1 ATOM 4197 O OG . SER C 3 143 ? 5.530 -26.887 -20.579 1.00 60.90 ? 146 SER C OG 1 ATOM 4198 N N . GLN C 3 144 ? 6.906 -22.405 -20.477 1.00 65.19 ? 147 GLN C N 1 ATOM 4199 C CA . GLN C 3 144 ? 7.134 -21.027 -20.897 1.00 68.50 ? 147 GLN C CA 1 ATOM 4200 C C . GLN C 3 144 ? 8.607 -20.801 -21.253 1.00 67.45 ? 147 GLN C C 1 ATOM 4201 O O . GLN C 3 144 ? 8.930 -19.943 -22.077 1.00 70.47 ? 147 GLN C O 1 ATOM 4202 C CB . GLN C 3 144 ? 6.715 -20.081 -19.768 1.00 69.35 ? 147 GLN C CB 1 ATOM 4203 C CG . GLN C 3 144 ? 6.339 -18.667 -20.201 0.70 74.27 ? 147 GLN C CG 1 ATOM 4204 C CD . GLN C 3 144 ? 5.543 -17.915 -19.138 0.70 76.06 ? 147 GLN C CD 1 ATOM 4205 O OE1 . GLN C 3 144 ? 4.587 -17.207 -19.452 0.70 80.54 ? 147 GLN C OE1 1 ATOM 4206 N NE2 . GLN C 3 144 ? 5.933 -18.072 -17.876 0.70 72.98 ? 147 GLN C NE2 1 ATOM 4207 N N . THR C 3 145 ? 9.487 -21.584 -20.631 1.00 63.75 ? 148 THR C N 1 ATOM 4208 C CA . THR C 3 145 ? 10.934 -21.452 -20.805 1.00 62.65 ? 148 THR C CA 1 ATOM 4209 C C . THR C 3 145 ? 11.454 -22.229 -22.021 1.00 62.91 ? 148 THR C C 1 ATOM 4210 O O . THR C 3 145 ? 11.203 -23.433 -22.158 1.00 61.38 ? 148 THR C O 1 ATOM 4211 C CB . THR C 3 145 ? 11.694 -21.917 -19.533 1.00 58.98 ? 148 THR C CB 1 ATOM 4212 O OG1 . THR C 3 145 ? 11.137 -21.281 -18.376 1.00 59.05 ? 148 THR C OG1 1 ATOM 4213 C CG2 . THR C 3 145 ? 13.179 -21.581 -19.625 1.00 58.25 ? 148 THR C CG2 1 ATOM 4214 N N . ASN C 3 146 ? 12.173 -21.525 -22.896 1.00 65.28 ? 149 ASN C N 1 ATOM 4215 C CA . ASN C 3 146 ? 12.904 -22.149 -23.999 1.00 65.71 ? 149 ASN C CA 1 ATOM 4216 C C . ASN C 3 146 ? 14.392 -22.233 -23.676 1.00 63.80 ? 149 ASN C C 1 ATOM 4217 O O . ASN C 3 146 ? 15.015 -21.227 -23.328 1.00 64.77 ? 149 ASN C O 1 ATOM 4218 C CB . ASN C 3 146 ? 12.690 -21.379 -25.305 1.00 70.39 ? 149 ASN C CB 1 ATOM 4219 C CG . ASN C 3 146 ? 11.300 -21.581 -25.885 1.00 72.94 ? 149 ASN C CG 1 ATOM 4220 O OD1 . ASN C 3 146 ? 10.890 -22.705 -26.178 1.00 72.22 ? 149 ASN C OD1 1 ATOM 4221 N ND2 . ASN C 3 146 ? 10.573 -20.486 -26.067 1.00 76.82 ? 149 ASN C ND2 1 ATOM 4222 N N . VAL C 3 147 ? 14.953 -23.436 -23.788 1.00 61.57 ? 150 VAL C N 1 ATOM 4223 C CA . VAL C 3 147 ? 16.362 -23.671 -23.466 1.00 59.87 ? 150 VAL C CA 1 ATOM 4224 C C . VAL C 3 147 ? 17.246 -23.391 -24.682 1.00 62.57 ? 150 VAL C C 1 ATOM 4225 O O . VAL C 3 147 ? 17.238 -24.144 -25.655 1.00 63.40 ? 150 VAL C O 1 ATOM 4226 C CB . VAL C 3 147 ? 16.601 -25.109 -22.925 1.00 56.69 ? 150 VAL C CB 1 ATOM 4227 C CG1 . VAL C 3 147 ? 18.069 -25.322 -22.570 1.00 55.48 ? 150 VAL C CG1 1 ATOM 4228 C CG2 . VAL C 3 147 ? 15.725 -25.377 -21.710 1.00 54.34 ? 150 VAL C CG2 1 ATOM 4229 N N . SER C 3 148 ? 17.997 -22.294 -24.612 1.00 64.38 ? 151 SER C N 1 ATOM 4230 C CA . SER C 3 148 ? 18.883 -21.874 -25.696 1.00 67.68 ? 151 SER C CA 1 ATOM 4231 C C . SER C 3 148 ? 20.135 -22.739 -25.757 1.00 66.42 ? 151 SER C C 1 ATOM 4232 O O . SER C 3 148 ? 20.497 -23.397 -24.781 1.00 63.25 ? 151 SER C O 1 ATOM 4233 C CB . SER C 3 148 ? 19.273 -20.402 -25.536 1.00 70.40 ? 151 SER C CB 1 ATOM 4234 O OG . SER C 3 148 ? 18.128 -19.571 -25.496 1.00 72.18 ? 151 SER C OG 1 ATOM 4235 N N . GLN C 3 149 ? 20.794 -22.727 -26.911 1.00 69.54 ? 152 GLN C N 1 ATOM 4236 C CA . GLN C 3 149 ? 21.991 -23.529 -27.125 1.00 69.32 ? 152 GLN C CA 1 ATOM 4237 C C . GLN C 3 149 ? 23.237 -22.834 -26.566 1.00 69.93 ? 152 GLN C C 1 ATOM 4238 O O . GLN C 3 149 ? 23.147 -21.749 -25.985 1.00 70.64 ? 152 GLN C O 1 ATOM 4239 C CB . GLN C 3 149 ? 22.146 -23.873 -28.616 1.00 72.68 ? 152 GLN C CB 1 ATOM 4240 C CG . GLN C 3 149 ? 22.971 -25.136 -28.905 1.00 72.60 ? 152 GLN C CG 1 ATOM 4241 C CD . GLN C 3 149 ? 22.723 -26.260 -27.900 0.90 69.21 ? 152 GLN C CD 1 ATOM 4242 O OE1 . GLN C 3 149 ? 21.584 -26.697 -27.701 0.90 68.01 ? 152 GLN C OE1 1 ATOM 4243 N NE2 . GLN C 3 149 ? 23.795 -26.732 -27.265 1.00 67.74 ? 152 GLN C NE2 1 ATOM 4244 N N . SER C 3 150 ? 24.391 -23.470 -26.742 1.00 70.03 ? 153 SER C N 1 ATOM 4245 C CA . SER C 3 150 ? 25.647 -22.993 -26.177 1.00 70.70 ? 153 SER C CA 1 ATOM 4246 C C . SER C 3 150 ? 26.399 -22.055 -27.124 1.00 75.35 ? 153 SER C C 1 ATOM 4247 O O . SER C 3 150 ? 26.607 -22.371 -28.300 1.00 77.84 ? 153 SER C O 1 ATOM 4248 C CB . SER C 3 150 ? 26.525 -24.187 -25.795 1.00 68.85 ? 153 SER C CB 1 ATOM 4249 O OG . SER C 3 150 ? 27.711 -23.770 -25.142 1.00 69.92 ? 153 SER C OG 1 ATOM 4250 N N . LYS C 3 151 ? 26.798 -20.900 -26.594 1.00 76.82 ? 154 LYS C N 1 ATOM 4251 C CA . LYS C 3 151 ? 27.605 -19.926 -27.330 1.00 81.60 ? 154 LYS C CA 1 ATOM 4252 C C . LYS C 3 151 ? 29.082 -20.330 -27.301 1.00 82.50 ? 154 LYS C C 1 ATOM 4253 O O . LYS C 3 151 ? 29.858 -19.960 -28.187 1.00 86.79 ? 154 LYS C O 1 ATOM 4254 C CB . LYS C 3 151 ? 27.418 -18.526 -26.735 1.00 83.42 ? 154 LYS C CB 1 ATOM 4255 C CG . LYS C 3 151 ? 27.829 -17.384 -27.652 1.00 89.38 ? 154 LYS C CG 1 ATOM 4256 N N . ASP C 3 152 ? 29.457 -21.089 -26.272 1.00 78.78 ? 155 ASP C N 1 ATOM 4257 C CA . ASP C 3 152 ? 30.807 -21.626 -26.131 1.00 79.38 ? 155 ASP C CA 1 ATOM 4258 C C . ASP C 3 152 ? 30.864 -23.037 -26.707 1.00 77.81 ? 155 ASP C C 1 ATOM 4259 O O . ASP C 3 152 ? 29.960 -23.844 -26.482 1.00 74.44 ? 155 ASP C O 1 ATOM 4260 C CB . ASP C 3 152 ? 31.213 -21.645 -24.653 1.00 77.12 ? 155 ASP C CB 1 ATOM 4261 C CG . ASP C 3 152 ? 32.722 -21.754 -24.448 0.90 79.78 ? 155 ASP C CG 1 ATOM 4262 O OD1 . ASP C 3 152 ? 33.421 -22.363 -25.289 0.90 81.81 ? 155 ASP C OD1 1 ATOM 4263 O OD2 . ASP C 3 152 ? 33.209 -21.230 -23.423 0.90 80.35 ? 155 ASP C OD2 1 ATOM 4264 N N . SER C 3 153 ? 31.931 -23.329 -27.448 1.00 80.60 ? 156 SER C N 1 ATOM 4265 C CA . SER C 3 153 ? 32.127 -24.653 -28.042 1.00 79.83 ? 156 SER C CA 1 ATOM 4266 C C . SER C 3 153 ? 32.530 -25.702 -27.003 1.00 76.51 ? 156 SER C C 1 ATOM 4267 O O . SER C 3 153 ? 32.398 -26.904 -27.247 1.00 75.36 ? 156 SER C O 1 ATOM 4268 C CB . SER C 3 153 ? 33.164 -24.592 -29.168 1.00 84.80 ? 156 SER C CB 1 ATOM 4269 O OG . SER C 3 153 ? 34.409 -24.106 -28.696 1.00 87.18 ? 156 SER C OG 1 ATOM 4270 N N . ASP C 3 154 ? 33.011 -25.240 -25.849 1.00 75.29 ? 157 ASP C N 1 ATOM 4271 C CA . ASP C 3 154 ? 33.446 -26.123 -24.766 1.00 72.71 ? 157 ASP C CA 1 ATOM 4272 C C . ASP C 3 154 ? 32.306 -26.509 -23.818 1.00 67.89 ? 157 ASP C C 1 ATOM 4273 O O . ASP C 3 154 ? 32.454 -27.422 -22.998 1.00 65.98 ? 157 ASP C O 1 ATOM 4274 C CB . ASP C 3 154 ? 34.598 -25.482 -23.980 1.00 74.89 ? 157 ASP C CB 1 ATOM 4275 C CG . ASP C 3 154 ? 35.899 -25.424 -24.776 1.00 79.78 ? 157 ASP C CG 1 ATOM 4276 O OD1 . ASP C 3 154 ? 36.816 -24.682 -24.356 1.00 82.68 ? 157 ASP C OD1 1 ATOM 4277 O OD2 . ASP C 3 154 ? 36.013 -26.114 -25.815 1.00 81.27 ? 157 ASP C OD2 1 ATOM 4278 N N . VAL C 3 155 ? 31.179 -25.810 -23.934 1.00 66.17 ? 158 VAL C N 1 ATOM 4279 C CA . VAL C 3 155 ? 29.991 -26.100 -23.132 1.00 61.90 ? 158 VAL C CA 1 ATOM 4280 C C . VAL C 3 155 ? 28.940 -26.804 -23.989 1.00 60.57 ? 158 VAL C C 1 ATOM 4281 O O . VAL C 3 155 ? 28.659 -26.379 -25.111 1.00 62.48 ? 158 VAL C O 1 ATOM 4282 C CB . VAL C 3 155 ? 29.390 -24.813 -22.512 1.00 61.50 ? 158 VAL C CB 1 ATOM 4283 C CG1 . VAL C 3 155 ? 28.219 -25.147 -21.593 1.00 57.90 ? 158 VAL C CG1 1 ATOM 4284 C CG2 . VAL C 3 155 ? 30.451 -24.035 -21.751 1.00 63.18 ? 158 VAL C CG2 1 ATOM 4285 N N . TYR C 3 156 ? 28.370 -27.883 -23.456 1.00 57.54 ? 159 TYR C N 1 ATOM 4286 C CA . TYR C 3 156 ? 27.334 -28.644 -24.152 1.00 56.42 ? 159 TYR C CA 1 ATOM 4287 C C . TYR C 3 156 ? 26.009 -28.559 -23.403 1.00 53.54 ? 159 TYR C C 1 ATOM 4288 O O . TYR C 3 156 ? 25.939 -28.893 -22.224 1.00 51.56 ? 159 TYR C O 1 ATOM 4289 C CB . TYR C 3 156 ? 27.753 -30.109 -24.316 1.00 56.34 ? 159 TYR C CB 1 ATOM 4290 C CG . TYR C 3 156 ? 29.153 -30.291 -24.855 1.00 59.26 ? 159 TYR C CG 1 ATOM 4291 C CD1 . TYR C 3 156 ? 29.422 -30.143 -26.214 1.00 62.00 ? 159 TYR C CD1 1 ATOM 4292 C CD2 . TYR C 3 156 ? 30.213 -30.604 -24.004 1.00 59.71 ? 159 TYR C CD2 1 ATOM 4293 C CE1 . TYR C 3 156 ? 30.709 -30.300 -26.711 1.00 65.19 ? 159 TYR C CE1 1 ATOM 4294 C CE2 . TYR C 3 156 ? 31.509 -30.765 -24.494 1.00 62.66 ? 159 TYR C CE2 1 ATOM 4295 C CZ . TYR C 3 156 ? 31.747 -30.612 -25.849 1.00 65.45 ? 159 TYR C CZ 1 ATOM 4296 O OH . TYR C 3 156 ? 33.021 -30.774 -26.346 1.00 69.02 ? 159 TYR C OH 1 ATOM 4297 N N . ILE C 3 157 ? 24.968 -28.103 -24.094 1.00 53.87 ? 160 ILE C N 1 ATOM 4298 C CA . ILE C 3 157 ? 23.625 -28.009 -23.521 1.00 51.72 ? 160 ILE C CA 1 ATOM 4299 C C . ILE C 3 157 ? 22.623 -28.783 -24.383 1.00 52.08 ? 160 ILE C C 1 ATOM 4300 O O . ILE C 3 157 ? 22.562 -28.597 -25.602 1.00 54.33 ? 160 ILE C O 1 ATOM 4301 C CB . ILE C 3 157 ? 23.167 -26.535 -23.368 1.00 52.37 ? 160 ILE C CB 1 ATOM 4302 C CG1 . ILE C 3 157 ? 24.134 -25.760 -22.472 1.00 52.40 ? 160 ILE C CG1 1 ATOM 4303 C CG2 . ILE C 3 157 ? 21.754 -26.464 -22.801 1.00 50.64 ? 160 ILE C CG2 1 ATOM 4304 C CD1 . ILE C 3 157 ? 24.107 -24.262 -22.680 1.00 54.44 ? 160 ILE C CD1 1 ATOM 4305 N N . THR C 3 158 ? 21.847 -29.653 -23.742 1.00 50.17 ? 161 THR C N 1 ATOM 4306 C CA . THR C 3 158 ? 20.828 -30.435 -24.438 1.00 50.92 ? 161 THR C CA 1 ATOM 4307 C C . THR C 3 158 ? 19.518 -29.653 -24.532 1.00 51.39 ? 161 THR C C 1 ATOM 4308 O O . THR C 3 158 ? 19.318 -28.677 -23.812 1.00 50.72 ? 161 THR C O 1 ATOM 4309 C CB . THR C 3 158 ? 20.572 -31.801 -23.751 1.00 49.25 ? 161 THR C CB 1 ATOM 4310 O OG1 . THR C 3 158 ? 19.932 -31.602 -22.483 1.00 47.41 ? 161 THR C OG1 1 ATOM 4311 C CG2 . THR C 3 158 ? 21.878 -32.564 -23.550 1.00 49.40 ? 161 THR C CG2 1 ATOM 4312 N N . ASP C 3 159 ? 18.637 -30.081 -25.432 1.00 53.23 ? 162 ASP C N 1 ATOM 4313 C CA . ASP C 3 159 ? 17.297 -29.510 -25.533 1.00 54.25 ? 162 ASP C CA 1 ATOM 4314 C C . ASP C 3 159 ? 16.430 -30.083 -24.416 1.00 52.10 ? 162 ASP C C 1 ATOM 4315 O O . ASP C 3 159 ? 16.748 -31.144 -23.865 1.00 50.80 ? 162 ASP C O 1 ATOM 4316 C CB . ASP C 3 159 ? 16.685 -29.822 -26.901 1.00 57.33 ? 162 ASP C CB 1 ATOM 4317 C CG . ASP C 3 159 ? 15.480 -28.951 -27.221 1.00 59.68 ? 162 ASP C CG 1 ATOM 4318 O OD1 . ASP C 3 159 ? 15.144 -28.056 -26.413 1.00 59.26 ? 162 ASP C OD1 1 ATOM 4319 O OD2 . ASP C 3 159 ? 14.868 -29.159 -28.292 1.00 62.94 ? 162 ASP C OD2 1 ATOM 4320 N N . LYS C 3 160 ? 15.344 -29.386 -24.084 1.00 52.30 ? 163 LYS C N 1 ATOM 4321 C CA . LYS C 3 160 ? 14.473 -29.796 -22.978 1.00 50.60 ? 163 LYS C CA 1 ATOM 4322 C C . LYS C 3 160 ? 13.734 -31.106 -23.244 1.00 51.16 ? 163 LYS C C 1 ATOM 4323 O O . LYS C 3 160 ? 13.440 -31.449 -24.386 1.00 53.33 ? 163 LYS C O 1 ATOM 4324 C CB . LYS C 3 160 ? 13.502 -28.676 -22.573 1.00 51.08 ? 163 LYS C CB 1 ATOM 4325 C CG . LYS C 3 160 ? 12.514 -28.242 -23.643 1.00 54.05 ? 163 LYS C CG 1 ATOM 4326 C CD . LYS C 3 160 ? 11.490 -27.285 -23.063 1.00 54.67 ? 163 LYS C CD 1 ATOM 4327 C CE . LYS C 3 160 ? 10.547 -26.755 -24.124 1.00 58.19 ? 163 LYS C CE 1 ATOM 4328 N NZ . LYS C 3 160 ? 9.536 -25.842 -23.523 1.00 59.77 ? 163 LYS C NZ 1 ATOM 4329 N N . CYS C 3 161 ? 13.453 -31.828 -22.163 1.00 49.83 ? 164 CYS C N 1 ATOM 4330 C CA . CYS C 3 161 ? 12.904 -33.177 -22.214 1.00 50.63 ? 164 CYS C CA 1 ATOM 4331 C C . CYS C 3 161 ? 11.786 -33.311 -21.180 1.00 49.84 ? 164 CYS C C 1 ATOM 4332 O O . CYS C 3 161 ? 11.910 -32.814 -20.058 1.00 48.40 ? 164 CYS C O 1 ATOM 4333 C CB . CYS C 3 161 ? 14.014 -34.178 -21.899 1.00 49.87 ? 164 CYS C CB 1 ATOM 4334 S SG . CYS C 3 161 ? 13.921 -35.749 -22.767 1.00 54.26 ? 164 CYS C SG 1 ATOM 4335 N N . VAL C 3 162 ? 10.710 -33.995 -21.557 1.00 51.27 ? 165 VAL C N 1 ATOM 4336 C CA . VAL C 3 162 ? 9.540 -34.170 -20.696 1.00 51.28 ? 165 VAL C CA 1 ATOM 4337 C C . VAL C 3 162 ? 9.482 -35.592 -20.138 1.00 51.23 ? 165 VAL C C 1 ATOM 4338 O O . VAL C 3 162 ? 9.446 -36.554 -20.902 1.00 52.95 ? 165 VAL C O 1 ATOM 4339 C CB . VAL C 3 162 ? 8.230 -33.890 -21.477 1.00 54.02 ? 165 VAL C CB 1 ATOM 4340 C CG1 . VAL C 3 162 ? 7.008 -34.073 -20.585 1.00 54.85 ? 165 VAL C CG1 1 ATOM 4341 C CG2 . VAL C 3 162 ? 8.254 -32.499 -22.088 1.00 54.65 ? 165 VAL C CG2 1 ATOM 4342 N N . LEU C 3 163 ? 9.465 -35.726 -18.814 1.00 49.82 ? 166 LEU C N 1 ATOM 4343 C CA . LEU C 3 163 ? 9.314 -37.046 -18.197 1.00 50.54 ? 166 LEU C CA 1 ATOM 4344 C C . LEU C 3 163 ? 8.033 -37.185 -17.372 1.00 51.70 ? 166 LEU C C 1 ATOM 4345 O O . LEU C 3 163 ? 7.665 -36.286 -16.612 1.00 50.82 ? 166 LEU C O 1 ATOM 4346 C CB . LEU C 3 163 ? 10.561 -37.451 -17.390 1.00 48.85 ? 166 LEU C CB 1 ATOM 4347 C CG . LEU C 3 163 ? 10.983 -36.729 -16.107 1.00 47.29 ? 166 LEU C CG 1 ATOM 4348 C CD1 . LEU C 3 163 ? 10.274 -37.294 -14.876 1.00 48.19 ? 166 LEU C CD1 1 ATOM 4349 C CD2 . LEU C 3 163 ? 12.488 -36.825 -15.927 1.00 46.09 ? 166 LEU C CD2 1 ATOM 4350 N N . ASP C 3 164 ? 7.364 -38.321 -17.547 1.00 54.08 ? 167 ASP C N 1 ATOM 4351 C CA . ASP C 3 164 ? 6.139 -38.639 -16.827 1.00 56.04 ? 167 ASP C CA 1 ATOM 4352 C C . ASP C 3 164 ? 6.446 -39.649 -15.727 1.00 56.44 ? 167 ASP C C 1 ATOM 4353 O O . ASP C 3 164 ? 6.868 -40.773 -16.005 1.00 57.73 ? 167 ASP C O 1 ATOM 4354 C CB . ASP C 3 164 ? 5.086 -39.199 -17.800 1.00 59.29 ? 167 ASP C CB 1 ATOM 4355 C CG . ASP C 3 164 ? 3.700 -39.382 -17.162 1.00 62.28 ? 167 ASP C CG 1 ATOM 4356 O OD1 . ASP C 3 164 ? 3.516 -39.101 -15.957 1.00 61.75 ? 167 ASP C OD1 1 ATOM 4357 O OD2 . ASP C 3 164 ? 2.776 -39.813 -17.885 1.00 66.05 ? 167 ASP C OD2 1 ATOM 4358 N N . MET C 3 165 ? 6.256 -39.229 -14.479 1.00 55.77 ? 168 MET C N 1 ATOM 4359 C CA . MET C 3 165 ? 6.268 -40.148 -13.348 1.00 57.23 ? 168 MET C CA 1 ATOM 4360 C C . MET C 3 165 ? 4.839 -40.651 -13.174 1.00 60.56 ? 168 MET C C 1 ATOM 4361 O O . MET C 3 165 ? 4.005 -39.992 -12.545 1.00 61.03 ? 168 MET C O 1 ATOM 4362 C CB . MET C 3 165 ? 6.800 -39.466 -12.084 1.00 55.48 ? 168 MET C CB 1 ATOM 4363 C CG . MET C 3 165 ? 8.293 -39.149 -12.148 1.00 53.17 ? 168 MET C CG 1 ATOM 4364 S SD . MET C 3 165 ? 8.982 -38.377 -10.668 1.00 52.68 ? 168 MET C SD 1 ATOM 4365 C CE . MET C 3 165 ? 9.046 -39.774 -9.546 1.00 55.49 ? 168 MET C CE 1 ATOM 4366 N N . ARG C 3 166 ? 4.575 -41.822 -13.756 1.00 63.18 ? 169 ARG C N 1 ATOM 4367 C CA . ARG C 3 166 ? 3.217 -42.323 -13.996 1.00 66.81 ? 169 ARG C CA 1 ATOM 4368 C C . ARG C 3 166 ? 2.347 -42.502 -12.751 1.00 69.00 ? 169 ARG C C 1 ATOM 4369 O O . ARG C 3 166 ? 1.228 -41.984 -12.699 1.00 70.38 ? 169 ARG C O 1 ATOM 4370 C CB . ARG C 3 166 ? 3.256 -43.629 -14.804 1.00 69.76 ? 169 ARG C CB 1 ATOM 4371 C CG . ARG C 3 166 ? 3.768 -43.486 -16.235 1.00 68.94 ? 169 ARG C CG 1 ATOM 4372 C CD . ARG C 3 166 ? 3.761 -44.831 -16.950 0.70 72.89 ? 169 ARG C CD 1 ATOM 4373 N NE . ARG C 3 166 ? 4.484 -44.793 -18.222 0.70 72.31 ? 169 ARG C NE 1 ATOM 4374 C CZ . ARG C 3 166 ? 4.588 -45.820 -19.063 0.70 75.36 ? 169 ARG C CZ 1 ATOM 4375 N NH1 . ARG C 3 166 ? 4.014 -46.983 -18.782 0.70 79.52 ? 169 ARG C NH1 1 ATOM 4376 N NH2 . ARG C 3 166 ? 5.267 -45.684 -20.194 0.70 74.65 ? 169 ARG C NH2 1 ATOM 4377 N N . SER C 3 167 ? 2.858 -43.234 -11.760 1.00 69.73 ? 170 SER C N 1 ATOM 4378 C CA . SER C 3 167 ? 2.092 -43.556 -10.548 1.00 72.50 ? 170 SER C CA 1 ATOM 4379 C C . SER C 3 167 ? 1.863 -42.328 -9.670 1.00 70.59 ? 170 SER C C 1 ATOM 4380 O O . SER C 3 167 ? 1.009 -42.335 -8.780 1.00 73.12 ? 170 SER C O 1 ATOM 4381 C CB . SER C 3 167 ? 2.781 -44.666 -9.745 1.00 74.33 ? 170 SER C CB 1 ATOM 4382 O OG . SER C 3 167 ? 3.954 -44.193 -9.105 1.00 71.13 ? 170 SER C OG 1 ATOM 4383 N N . MET C 3 168 ? 2.631 -41.278 -9.941 1.00 66.49 ? 171 MET C N 1 ATOM 4384 C CA . MET C 3 168 ? 2.555 -40.026 -9.204 1.00 64.69 ? 171 MET C CA 1 ATOM 4385 C C . MET C 3 168 ? 1.773 -38.971 -9.976 1.00 63.96 ? 171 MET C C 1 ATOM 4386 O O . MET C 3 168 ? 1.463 -37.907 -9.435 1.00 63.26 ? 171 MET C O 1 ATOM 4387 C CB . MET C 3 168 ? 3.967 -39.510 -8.930 1.00 61.40 ? 171 MET C CB 1 ATOM 4388 C CG . MET C 3 168 ? 4.754 -40.344 -7.930 1.00 62.71 ? 171 MET C CG 1 ATOM 4389 S SD . MET C 3 168 ? 4.346 -39.915 -6.232 1.00 65.08 ? 171 MET C SD 1 ATOM 4390 C CE . MET C 3 168 ? 5.146 -38.308 -6.115 1.00 60.47 ? 171 MET C CE 1 ATOM 4391 N N . ASP C 3 169 ? 1.460 -39.284 -11.237 1.00 64.54 ? 172 ASP C N 1 ATOM 4392 C CA . ASP C 3 169 ? 0.870 -38.341 -12.199 1.00 64.10 ? 172 ASP C CA 1 ATOM 4393 C C . ASP C 3 169 ? 1.613 -37.001 -12.175 1.00 60.47 ? 172 ASP C C 1 ATOM 4394 O O . ASP C 3 169 ? 1.009 -35.935 -12.045 1.00 60.64 ? 172 ASP C O 1 ATOM 4395 C CB . ASP C 3 169 ? -0.637 -38.163 -11.956 1.00 67.67 ? 172 ASP C CB 1 ATOM 4396 C CG . ASP C 3 169 ? -1.403 -37.805 -13.224 0.70 69.37 ? 172 ASP C CG 1 ATOM 4397 O OD1 . ASP C 3 169 ? -2.380 -38.514 -13.545 0.70 73.09 ? 172 ASP C OD1 1 ATOM 4398 O OD2 . ASP C 3 169 ? -1.036 -36.821 -13.901 0.70 67.56 ? 172 ASP C OD2 1 ATOM 4399 N N . PHE C 3 170 ? 2.936 -37.080 -12.290 1.00 57.58 ? 173 PHE C N 1 ATOM 4400 C CA . PHE C 3 170 ? 3.797 -35.908 -12.208 1.00 54.51 ? 173 PHE C CA 1 ATOM 4401 C C . PHE C 3 170 ? 4.645 -35.758 -13.461 1.00 52.81 ? 173 PHE C C 1 ATOM 4402 O O . PHE C 3 170 ? 5.347 -36.686 -13.867 1.00 52.49 ? 173 PHE C O 1 ATOM 4403 C CB . PHE C 3 170 ? 4.691 -35.972 -10.963 1.00 53.07 ? 173 PHE C CB 1 ATOM 4404 C CG . PHE C 3 170 ? 5.647 -34.818 -10.842 1.00 50.26 ? 173 PHE C CG 1 ATOM 4405 C CD1 . PHE C 3 170 ? 5.218 -33.591 -10.342 1.00 49.90 ? 173 PHE C CD1 1 ATOM 4406 C CD2 . PHE C 3 170 ? 6.976 -34.955 -11.236 1.00 48.05 ? 173 PHE C CD2 1 ATOM 4407 C CE1 . PHE C 3 170 ? 6.098 -32.519 -10.237 1.00 47.76 ? 173 PHE C CE1 1 ATOM 4408 C CE2 . PHE C 3 170 ? 7.861 -33.890 -11.134 1.00 45.56 ? 173 PHE C CE2 1 ATOM 4409 C CZ . PHE C 3 170 ? 7.422 -32.671 -10.631 1.00 45.54 ? 173 PHE C CZ 1 ATOM 4410 N N . LYS C 3 171 ? 4.566 -34.574 -14.060 1.00 52.20 ? 174 LYS C N 1 ATOM 4411 C CA . LYS C 3 171 ? 5.313 -34.241 -15.265 1.00 51.14 ? 174 LYS C CA 1 ATOM 4412 C C . LYS C 3 171 ? 6.317 -33.136 -14.973 1.00 48.69 ? 174 LYS C C 1 ATOM 4413 O O . LYS C 3 171 ? 6.014 -32.196 -14.235 1.00 48.79 ? 174 LYS C O 1 ATOM 4414 C CB . LYS C 3 171 ? 4.357 -33.803 -16.380 1.00 53.28 ? 174 LYS C CB 1 ATOM 4415 C CG . LYS C 3 171 ? 3.992 -34.897 -17.377 1.00 55.84 ? 174 LYS C CG 1 ATOM 4416 C CD . LYS C 3 171 ? 3.099 -35.978 -16.780 1.00 59.20 ? 174 LYS C CD 1 ATOM 4417 C CE . LYS C 3 171 ? 1.621 -35.675 -16.975 1.00 63.38 ? 174 LYS C CE 1 ATOM 4418 N NZ . LYS C 3 171 ? 0.766 -36.770 -16.436 1.00 66.45 ? 174 LYS C NZ 1 ATOM 4419 N N . SER C 3 172 ? 7.514 -33.255 -15.540 1.00 47.04 ? 175 SER C N 1 ATOM 4420 C CA . SER C 3 172 ? 8.537 -32.224 -15.379 1.00 45.20 ? 175 SER C CA 1 ATOM 4421 C C . SER C 3 172 ? 9.434 -32.096 -16.602 1.00 44.70 ? 175 SER C C 1 ATOM 4422 O O . SER C 3 172 ? 9.678 -33.075 -17.311 1.00 45.17 ? 175 SER C O 1 ATOM 4423 C CB . SER C 3 172 ? 9.380 -32.482 -14.127 1.00 43.81 ? 175 SER C CB 1 ATOM 4424 O OG . SER C 3 172 ? 10.137 -33.672 -14.249 1.00 43.50 ? 175 SER C OG 1 ATOM 4425 N N . ASN C 3 173 ? 9.907 -30.876 -16.841 1.00 44.24 ? 176 ASN C N 1 ATOM 4426 C CA . ASN C 3 173 ? 10.861 -30.589 -17.906 1.00 44.13 ? 176 ASN C CA 1 ATOM 4427 C C . ASN C 3 173 ? 12.276 -30.586 -17.358 1.00 42.39 ? 176 ASN C C 1 ATOM 4428 O O . ASN C 3 173 ? 12.491 -30.261 -16.190 1.00 41.62 ? 176 ASN C O 1 ATOM 4429 C CB . ASN C 3 173 ? 10.570 -29.227 -18.541 1.00 45.50 ? 176 ASN C CB 1 ATOM 4430 C CG . ASN C 3 173 ? 9.225 -29.173 -19.231 1.00 47.67 ? 176 ASN C CG 1 ATOM 4431 O OD1 . ASN C 3 173 ? 8.888 -30.050 -20.020 1.00 49.42 ? 176 ASN C OD1 1 ATOM 4432 N ND2 . ASN C 3 173 ? 8.453 -28.129 -18.949 1.00 48.72 ? 176 ASN C ND2 1 ATOM 4433 N N . SER C 3 174 ? 13.239 -30.951 -18.199 1.00 42.27 ? 177 SER C N 1 ATOM 4434 C CA . SER C 3 174 ? 14.647 -30.909 -17.806 1.00 41.00 ? 177 SER C CA 1 ATOM 4435 C C . SER C 3 174 ? 15.581 -30.769 -19.002 1.00 41.63 ? 177 SER C C 1 ATOM 4436 O O . SER C 3 174 ? 15.309 -31.293 -20.082 1.00 42.71 ? 177 SER C O 1 ATOM 4437 C CB . SER C 3 174 ? 15.030 -32.138 -16.966 1.00 40.24 ? 177 SER C CB 1 ATOM 4438 O OG . SER C 3 174 ? 14.887 -33.341 -17.702 1.00 41.03 ? 177 SER C OG 1 ATOM 4439 N N . ALA C 3 175 ? 16.673 -30.042 -18.786 1.00 41.28 ? 178 ALA C N 1 ATOM 4440 C CA . ALA C 3 175 ? 17.755 -29.907 -19.755 1.00 42.25 ? 178 ALA C CA 1 ATOM 4441 C C . ALA C 3 175 ? 19.093 -30.125 -19.047 1.00 41.61 ? 178 ALA C C 1 ATOM 4442 O O . ALA C 3 175 ? 19.273 -29.705 -17.897 1.00 40.87 ? 178 ALA C O 1 ATOM 4443 C CB . ALA C 3 175 ? 17.713 -28.541 -20.412 1.00 43.54 ? 178 ALA C CB 1 ATOM 4444 N N . VAL C 3 176 ? 20.022 -30.788 -19.731 1.00 42.22 ? 179 VAL C N 1 ATOM 4445 C CA . VAL C 3 176 ? 21.308 -31.143 -19.134 1.00 42.09 ? 179 VAL C CA 1 ATOM 4446 C C . VAL C 3 176 ? 22.440 -30.353 -19.786 1.00 43.55 ? 179 VAL C C 1 ATOM 4447 O O . VAL C 3 176 ? 22.502 -30.230 -21.012 1.00 45.09 ? 179 VAL C O 1 ATOM 4448 C CB . VAL C 3 176 ? 21.580 -32.676 -19.219 1.00 42.37 ? 179 VAL C CB 1 ATOM 4449 C CG1 . VAL C 3 176 ? 22.895 -33.043 -18.553 1.00 42.80 ? 179 VAL C CG1 1 ATOM 4450 C CG2 . VAL C 3 176 ? 20.445 -33.467 -18.576 1.00 41.67 ? 179 VAL C CG2 1 ATOM 4451 N N . ALA C 3 177 ? 23.327 -29.811 -18.955 1.00 43.58 ? 180 ALA C N 1 ATOM 4452 C CA . ALA C 3 177 ? 24.493 -29.081 -19.439 1.00 45.34 ? 180 ALA C CA 1 ATOM 4453 C C . ALA C 3 177 ? 25.771 -29.548 -18.756 1.00 45.97 ? 180 ALA C C 1 ATOM 4454 O O . ALA C 3 177 ? 25.777 -29.821 -17.553 1.00 45.02 ? 180 ALA C O 1 ATOM 4455 C CB . ALA C 3 177 ? 24.305 -27.593 -19.240 1.00 45.80 ? 180 ALA C CB 1 ATOM 4456 N N . TRP C 3 178 ? 26.848 -29.642 -19.532 1.00 48.06 ? 181 TRP C N 1 ATOM 4457 C CA . TRP C 3 178 ? 28.171 -29.967 -18.992 1.00 49.52 ? 181 TRP C CA 1 ATOM 4458 C C . TRP C 3 178 ? 29.290 -29.315 -19.805 1.00 52.52 ? 181 TRP C C 1 ATOM 4459 O O . TRP C 3 178 ? 29.091 -28.932 -20.959 1.00 53.58 ? 181 TRP C O 1 ATOM 4460 C CB . TRP C 3 178 ? 28.371 -31.487 -18.880 1.00 49.27 ? 181 TRP C CB 1 ATOM 4461 C CG . TRP C 3 178 ? 28.580 -32.191 -20.186 1.00 50.33 ? 181 TRP C CG 1 ATOM 4462 C CD1 . TRP C 3 178 ? 29.770 -32.609 -20.705 1.00 52.88 ? 181 TRP C CD1 1 ATOM 4463 C CD2 . TRP C 3 178 ? 27.573 -32.572 -21.134 1.00 49.68 ? 181 TRP C CD2 1 ATOM 4464 N NE1 . TRP C 3 178 ? 29.571 -33.222 -21.917 1.00 53.76 ? 181 TRP C NE1 1 ATOM 4465 C CE2 . TRP C 3 178 ? 28.232 -33.214 -22.206 1.00 51.91 ? 181 TRP C CE2 1 ATOM 4466 C CE3 . TRP C 3 178 ? 26.179 -32.435 -21.183 1.00 47.82 ? 181 TRP C CE3 1 ATOM 4467 C CZ2 . TRP C 3 178 ? 27.546 -33.716 -23.317 1.00 52.35 ? 181 TRP C CZ2 1 ATOM 4468 C CZ3 . TRP C 3 178 ? 25.498 -32.932 -22.291 1.00 48.20 ? 181 TRP C CZ3 1 ATOM 4469 C CH2 . TRP C 3 178 ? 26.184 -33.565 -23.340 1.00 50.48 ? 181 TRP C CH2 1 ATOM 4470 N N . SER C 3 179 ? 30.461 -29.179 -19.189 1.00 54.48 ? 182 SER C N 1 ATOM 4471 C CA . SER C 3 179 ? 31.614 -28.588 -19.855 1.00 58.12 ? 182 SER C CA 1 ATOM 4472 C C . SER C 3 179 ? 32.895 -29.303 -19.469 1.00 60.58 ? 182 SER C C 1 ATOM 4473 O O . SER C 3 179 ? 33.051 -29.743 -18.330 1.00 60.14 ? 182 SER C O 1 ATOM 4474 C CB . SER C 3 179 ? 31.728 -27.098 -19.532 1.00 58.92 ? 182 SER C CB 1 ATOM 4475 O OG . SER C 3 179 ? 32.878 -26.529 -20.134 1.00 62.46 ? 182 SER C OG 1 ATOM 4476 N N . ASN C 3 180 ? 33.810 -29.401 -20.430 1.00 64.01 ? 183 ASN C N 1 ATOM 4477 C CA . ASN C 3 180 ? 35.097 -30.064 -20.231 1.00 67.17 ? 183 ASN C CA 1 ATOM 4478 C C . ASN C 3 180 ? 36.052 -29.255 -19.350 1.00 69.45 ? 183 ASN C C 1 ATOM 4479 O O . ASN C 3 180 ? 37.076 -29.776 -18.904 1.00 71.91 ? 183 ASN C O 1 ATOM 4480 C CB . ASN C 3 180 ? 35.758 -30.364 -21.584 1.00 70.21 ? 183 ASN C CB 1 ATOM 4481 C CG . ASN C 3 180 ? 34.846 -31.134 -22.537 0.70 69.00 ? 183 ASN C CG 1 ATOM 4482 O OD1 . ASN C 3 180 ? 33.831 -31.706 -22.132 0.70 66.20 ? 183 ASN C OD1 1 ATOM 4483 N ND2 . ASN C 3 180 ? 35.214 -31.151 -23.815 0.70 71.50 ? 183 ASN C ND2 1 ATOM 4484 N N . LYS C 3 181 ? 35.709 -27.989 -19.108 1.00 69.26 ? 184 LYS C N 1 ATOM 4485 C CA . LYS C 3 181 ? 36.546 -27.070 -18.330 1.00 71.84 ? 184 LYS C CA 1 ATOM 4486 C C . LYS C 3 181 ? 36.584 -27.443 -16.848 1.00 71.05 ? 184 LYS C C 1 ATOM 4487 O O . LYS C 3 181 ? 35.541 -27.599 -16.206 1.00 68.09 ? 184 LYS C O 1 ATOM 4488 C CB . LYS C 3 181 ? 36.055 -25.627 -18.490 1.00 71.94 ? 184 LYS C CB 1 ATOM 4489 C CG . LYS C 3 181 ? 36.162 -25.073 -19.902 1.00 74.28 ? 184 LYS C CG 1 ATOM 4490 C CD . LYS C 3 181 ? 35.593 -23.665 -19.986 1.00 75.00 ? 184 LYS C CD 1 ATOM 4491 N N . ASP C 3 183 ? 36.509 -23.000 -14.986 1.00 74.61 ? 186 ASP C N 1 ATOM 4492 C CA . ASP C 3 183 ? 35.725 -21.849 -14.542 1.00 74.12 ? 186 ASP C CA 1 ATOM 4493 C C . ASP C 3 183 ? 34.215 -22.088 -14.671 1.00 69.89 ? 186 ASP C C 1 ATOM 4494 O O . ASP C 3 183 ? 33.405 -21.266 -14.227 1.00 69.27 ? 186 ASP C O 1 ATOM 4495 C CB . ASP C 3 183 ? 36.144 -20.584 -15.306 1.00 77.71 ? 186 ASP C CB 1 ATOM 4496 C CG . ASP C 3 183 ? 35.849 -20.670 -16.796 0.70 77.54 ? 186 ASP C CG 1 ATOM 4497 O OD1 . ASP C 3 183 ? 36.796 -20.899 -17.578 0.70 80.28 ? 186 ASP C OD1 1 ATOM 4498 O OD2 . ASP C 3 183 ? 34.672 -20.510 -17.186 0.70 74.98 ? 186 ASP C OD2 1 ATOM 4499 N N . PHE C 3 184 ? 33.853 -23.218 -15.279 1.00 67.37 ? 187 PHE C N 1 ATOM 4500 C CA . PHE C 3 184 ? 32.458 -23.599 -15.487 1.00 63.54 ? 187 PHE C CA 1 ATOM 4501 C C . PHE C 3 184 ? 31.743 -23.895 -14.170 1.00 61.31 ? 187 PHE C C 1 ATOM 4502 O O . PHE C 3 184 ? 32.271 -24.604 -13.311 1.00 61.64 ? 187 PHE C O 1 ATOM 4503 C CB . PHE C 3 184 ? 32.383 -24.811 -16.421 1.00 62.14 ? 187 PHE C CB 1 ATOM 4504 C CG . PHE C 3 184 ? 30.982 -25.262 -16.735 1.00 58.35 ? 187 PHE C CG 1 ATOM 4505 C CD1 . PHE C 3 184 ? 30.474 -26.430 -16.173 1.00 55.29 ? 187 PHE C CD1 1 ATOM 4506 C CD2 . PHE C 3 184 ? 30.175 -24.531 -17.607 1.00 57.68 ? 187 PHE C CD2 1 ATOM 4507 C CE1 . PHE C 3 184 ? 29.181 -26.861 -16.468 1.00 52.23 ? 187 PHE C CE1 1 ATOM 4508 C CE2 . PHE C 3 184 ? 28.882 -24.956 -17.909 1.00 54.56 ? 187 PHE C CE2 1 ATOM 4509 C CZ . PHE C 3 184 ? 28.386 -26.123 -17.338 1.00 51.81 ? 187 PHE C CZ 1 ATOM 4510 N N . ALA C 3 185 ? 30.542 -23.340 -14.027 1.00 59.54 ? 188 ALA C N 1 ATOM 4511 C CA . ALA C 3 185 ? 29.711 -23.541 -12.845 1.00 57.59 ? 188 ALA C CA 1 ATOM 4512 C C . ALA C 3 185 ? 28.234 -23.580 -13.237 1.00 55.12 ? 188 ALA C C 1 ATOM 4513 O O . ALA C 3 185 ? 27.801 -22.828 -14.114 1.00 55.61 ? 188 ALA C O 1 ATOM 4514 C CB . ALA C 3 185 ? 29.963 -22.442 -11.830 1.00 59.48 ? 188 ALA C CB 1 ATOM 4515 N N . CYS C 3 186 ? 27.471 -24.452 -12.576 1.00 52.91 ? 189 CYS C N 1 ATOM 4516 C CA . CYS C 3 186 ? 26.046 -24.642 -12.864 1.00 50.82 ? 189 CYS C CA 1 ATOM 4517 C C . CYS C 3 186 ? 25.222 -23.357 -12.799 1.00 51.14 ? 189 CYS C C 1 ATOM 4518 O O . CYS C 3 186 ? 24.305 -23.165 -13.595 1.00 50.69 ? 189 CYS C O 1 ATOM 4519 C CB . CYS C 3 186 ? 25.440 -25.696 -11.932 1.00 49.10 ? 189 CYS C CB 1 ATOM 4520 S SG . CYS C 3 186 ? 26.017 -27.407 -12.207 1.00 50.02 ? 189 CYS C SG 1 ATOM 4521 N N . ALA C 3 187 ? 25.561 -22.477 -11.862 1.00 52.62 ? 190 ALA C N 1 ATOM 4522 C CA . ALA C 3 187 ? 24.823 -21.230 -11.658 1.00 53.62 ? 190 ALA C CA 1 ATOM 4523 C C . ALA C 3 187 ? 24.841 -20.285 -12.865 1.00 55.33 ? 190 ALA C C 1 ATOM 4524 O O . ALA C 3 187 ? 23.969 -19.428 -12.990 1.00 56.20 ? 190 ALA C O 1 ATOM 4525 C CB . ALA C 3 187 ? 25.321 -20.515 -10.407 1.00 55.69 ? 190 ALA C CB 1 ATOM 4526 N N . ASN C 3 188 ? 25.830 -20.441 -13.744 1.00 56.20 ? 191 ASN C N 1 ATOM 4527 C CA . ASN C 3 188 ? 25.889 -19.666 -14.987 1.00 58.12 ? 191 ASN C CA 1 ATOM 4528 C C . ASN C 3 188 ? 26.018 -20.542 -16.247 1.00 57.13 ? 191 ASN C C 1 ATOM 4529 O O . ASN C 3 188 ? 26.461 -20.075 -17.299 1.00 59.41 ? 191 ASN C O 1 ATOM 4530 C CB . ASN C 3 188 ? 27.011 -18.614 -14.919 1.00 61.83 ? 191 ASN C CB 1 ATOM 4531 C CG . ASN C 3 188 ? 26.695 -17.467 -13.956 1.00 63.75 ? 191 ASN C CG 1 ATOM 4532 O OD1 . ASN C 3 188 ? 25.558 -17.000 -13.867 1.00 63.45 ? 191 ASN C OD1 1 ATOM 4533 N ND2 . ASN C 3 188 ? 27.713 -17.002 -13.242 1.00 66.41 ? 191 ASN C ND2 1 ATOM 4534 N N . ALA C 3 189 ? 25.618 -21.808 -16.129 1.00 54.02 ? 192 ALA C N 1 ATOM 4535 C CA . ALA C 3 189 ? 25.683 -22.765 -17.239 1.00 53.12 ? 192 ALA C CA 1 ATOM 4536 C C . ALA C 3 189 ? 24.651 -22.467 -18.326 1.00 53.32 ? 192 ALA C C 1 ATOM 4537 O O . ALA C 3 189 ? 24.921 -22.650 -19.516 1.00 54.57 ? 192 ALA C O 1 ATOM 4538 C CB . ALA C 3 189 ? 25.505 -24.186 -16.725 1.00 50.54 ? 192 ALA C CB 1 ATOM 4539 N N . PHE C 3 190 ? 23.476 -22.009 -17.901 1.00 52.33 ? 193 PHE C N 1 ATOM 4540 C CA . PHE C 3 190 ? 22.381 -21.691 -18.807 1.00 52.87 ? 193 PHE C CA 1 ATOM 4541 C C . PHE C 3 190 ? 22.277 -20.180 -19.028 1.00 56.11 ? 193 PHE C C 1 ATOM 4542 O O . PHE C 3 190 ? 21.186 -19.637 -19.220 1.00 56.83 ? 193 PHE C O 1 ATOM 4543 C CB . PHE C 3 190 ? 21.068 -22.279 -18.271 1.00 50.37 ? 193 PHE C CB 1 ATOM 4544 C CG . PHE C 3 190 ? 21.067 -23.784 -18.193 1.00 47.75 ? 193 PHE C CG 1 ATOM 4545 C CD1 . PHE C 3 190 ? 21.568 -24.440 -17.072 1.00 46.00 ? 193 PHE C CD1 1 ATOM 4546 C CD2 . PHE C 3 190 ? 20.579 -24.547 -19.249 1.00 47.53 ? 193 PHE C CD2 1 ATOM 4547 C CE1 . PHE C 3 190 ? 21.579 -25.834 -17.001 1.00 44.10 ? 193 PHE C CE1 1 ATOM 4548 C CE2 . PHE C 3 190 ? 20.583 -25.939 -19.188 1.00 45.76 ? 193 PHE C CE2 1 ATOM 4549 C CZ . PHE C 3 190 ? 21.084 -26.584 -18.059 1.00 44.01 ? 193 PHE C CZ 1 ATOM 4550 N N . ASN C 3 191 ? 23.432 -19.514 -19.018 1.00 58.52 ? 194 ASN C N 1 ATOM 4551 C CA . ASN C 3 191 ? 23.513 -18.058 -19.172 1.00 62.36 ? 194 ASN C CA 1 ATOM 4552 C C . ASN C 3 191 ? 23.054 -17.525 -20.534 1.00 65.35 ? 194 ASN C C 1 ATOM 4553 O O . ASN C 3 191 ? 22.808 -16.323 -20.679 1.00 68.77 ? 194 ASN C O 1 ATOM 4554 C CB . ASN C 3 191 ? 24.925 -17.543 -18.831 1.00 64.63 ? 194 ASN C CB 1 ATOM 4555 C CG . ASN C 3 191 ? 25.985 -17.974 -19.844 1.00 66.16 ? 194 ASN C CG 1 ATOM 4556 O OD1 . ASN C 3 191 ? 26.581 -17.138 -20.525 1.00 69.86 ? 194 ASN C OD1 1 ATOM 4557 N ND2 . ASN C 3 191 ? 26.232 -19.278 -19.935 1.00 63.79 ? 194 ASN C ND2 1 ATOM 4558 N N . ASN C 3 192 ? 22.947 -18.419 -21.519 1.00 64.57 ? 195 ASN C N 1 ATOM 4559 C CA A ASN C 3 192 ? 22.472 -18.068 -22.857 0.50 67.53 ? 195 ASN C CA 1 ATOM 4560 C CA B ASN C 3 192 ? 22.467 -18.038 -22.846 0.50 67.55 ? 195 ASN C CA 1 ATOM 4561 C C . ASN C 3 192 ? 20.946 -18.138 -22.950 1.00 66.79 ? 195 ASN C C 1 ATOM 4562 O O . ASN C 3 192 ? 20.344 -17.596 -23.881 1.00 69.97 ? 195 ASN C O 1 ATOM 4563 C CB A ASN C 3 192 ? 23.110 -18.982 -23.907 0.50 67.69 ? 195 ASN C CB 1 ATOM 4564 C CB B ASN C 3 192 ? 23.144 -18.868 -23.941 0.50 68.00 ? 195 ASN C CB 1 ATOM 4565 C CG A ASN C 3 192 ? 24.629 -18.999 -23.828 0.50 68.67 ? 195 ASN C CG 1 ATOM 4566 C CG B ASN C 3 192 ? 23.108 -18.183 -25.298 0.50 72.49 ? 195 ASN C CG 1 ATOM 4567 O OD1 A ASN C 3 192 ? 25.256 -20.055 -23.927 0.50 66.79 ? 195 ASN C OD1 1 ATOM 4568 O OD1 B ASN C 3 192 ? 22.888 -16.975 -25.390 0.50 75.62 ? 195 ASN C OD1 1 ATOM 4569 N ND2 A ASN C 3 192 ? 25.225 -17.827 -23.644 0.50 71.82 ? 195 ASN C ND2 1 ATOM 4570 N ND2 B ASN C 3 192 ? 23.328 -18.954 -26.357 0.50 72.98 ? 195 ASN C ND2 1 ATOM 4571 N N . SER C 3 193 ? 20.331 -18.817 -21.982 1.00 63.03 ? 196 SER C N 1 ATOM 4572 C CA . SER C 3 193 ? 18.873 -18.930 -21.895 1.00 62.41 ? 196 SER C CA 1 ATOM 4573 C C . SER C 3 193 ? 18.305 -17.893 -20.918 1.00 63.36 ? 196 SER C C 1 ATOM 4574 O O . SER C 3 193 ? 19.046 -17.310 -20.120 1.00 63.75 ? 196 SER C O 1 ATOM 4575 C CB . SER C 3 193 ? 18.469 -20.337 -21.445 1.00 58.39 ? 196 SER C CB 1 ATOM 4576 O OG . SER C 3 193 ? 19.103 -21.337 -22.225 1.00 57.87 ? 196 SER C OG 1 ATOM 4577 N N . ILE C 3 194 ? 16.995 -17.661 -20.987 1.00 64.16 ? 197 ILE C N 1 ATOM 4578 C CA . ILE C 3 194 ? 16.321 -16.798 -20.019 1.00 65.00 ? 197 ILE C CA 1 ATOM 4579 C C . ILE C 3 194 ? 15.707 -17.636 -18.895 1.00 61.30 ? 197 ILE C C 1 ATOM 4580 O O . ILE C 3 194 ? 14.879 -18.518 -19.138 1.00 59.75 ? 197 ILE C O 1 ATOM 4581 C CB . ILE C 3 194 ? 15.289 -15.844 -20.692 1.00 69.24 ? 197 ILE C CB 1 ATOM 4582 C CG1 . ILE C 3 194 ? 15.975 -14.556 -21.162 1.00 73.89 ? 197 ILE C CG1 1 ATOM 4583 C CG2 . ILE C 3 194 ? 14.172 -15.455 -19.732 1.00 69.28 ? 197 ILE C CG2 1 ATOM 4584 C CD1 . ILE C 3 194 ? 16.668 -14.650 -22.509 1.00 76.50 ? 197 ILE C CD1 1 ATOM 4585 N N . ILE C 3 195 ? 16.145 -17.357 -17.668 1.00 60.28 ? 198 ILE C N 1 ATOM 4586 C CA . ILE C 3 195 ? 15.737 -18.111 -16.485 1.00 57.09 ? 198 ILE C CA 1 ATOM 4587 C C . ILE C 3 195 ? 14.628 -17.392 -15.717 1.00 58.58 ? 198 ILE C C 1 ATOM 4588 O O . ILE C 3 195 ? 14.584 -16.157 -15.707 1.00 61.83 ? 198 ILE C O 1 ATOM 4589 C CB . ILE C 3 195 ? 16.928 -18.318 -15.514 1.00 55.50 ? 198 ILE C CB 1 ATOM 4590 C CG1 . ILE C 3 195 ? 18.035 -19.155 -16.156 1.00 53.96 ? 198 ILE C CG1 1 ATOM 4591 C CD1 . ILE C 3 195 ? 17.789 -20.639 -16.107 1.00 51.44 ? 198 ILE C CD1 1 ATOM 4592 N N . PRO C 3 196 ? 13.727 -18.161 -15.071 1.00 56.64 ? 199 PRO C N 1 ATOM 4593 C CA . PRO C 3 196 ? 12.754 -17.583 -14.141 1.00 58.03 ? 199 PRO C CA 1 ATOM 4594 C C . PRO C 3 196 ? 13.428 -16.888 -12.954 1.00 58.77 ? 199 PRO C C 1 ATOM 4595 O O . PRO C 3 196 ? 14.526 -17.278 -12.545 1.00 57.00 ? 199 PRO C O 1 ATOM 4596 C CB . PRO C 3 196 ? 11.967 -18.804 -13.659 1.00 55.39 ? 199 PRO C CB 1 ATOM 4597 C CG . PRO C 3 196 ? 12.086 -19.785 -14.764 1.00 53.81 ? 199 PRO C CG 1 ATOM 4598 C CD . PRO C 3 196 ? 13.467 -19.595 -15.307 1.00 53.77 ? 199 PRO C CD 1 ATOM 4599 N N . GLU C 3 197 ? 12.766 -15.867 -12.414 1.00 61.76 ? 200 GLU C N 1 ATOM 4600 C CA . GLU C 3 197 ? 13.297 -15.093 -11.290 1.00 63.30 ? 200 GLU C CA 1 ATOM 4601 C C . GLU C 3 197 ? 13.525 -15.943 -10.038 1.00 60.68 ? 200 GLU C C 1 ATOM 4602 O O . GLU C 3 197 ? 14.502 -15.739 -9.313 1.00 60.79 ? 200 GLU C O 1 ATOM 4603 C CB . GLU C 3 197 ? 12.371 -13.915 -10.965 1.00 67.25 ? 200 GLU C CB 1 ATOM 4604 N N . ASP C 3 198 ? 12.628 -16.898 -9.803 1.00 58.78 ? 201 ASP C N 1 ATOM 4605 C CA . ASP C 3 198 ? 12.670 -17.735 -8.603 1.00 56.83 ? 201 ASP C CA 1 ATOM 4606 C C . ASP C 3 198 ? 13.335 -19.098 -8.826 1.00 53.31 ? 201 ASP C C 1 ATOM 4607 O O . ASP C 3 198 ? 12.958 -20.092 -8.195 1.00 51.90 ? 201 ASP C O 1 ATOM 4608 C CB . ASP C 3 198 ? 11.261 -17.895 -8.007 1.00 57.75 ? 201 ASP C CB 1 ATOM 4609 C CG . ASP C 3 198 ? 10.226 -18.344 -9.034 1.00 57.99 ? 201 ASP C CG 1 ATOM 4610 O OD1 . ASP C 3 198 ? 9.159 -17.696 -9.112 1.00 61.62 ? 201 ASP C OD1 1 ATOM 4611 O OD2 . ASP C 3 198 ? 10.466 -19.335 -9.758 1.00 55.49 ? 201 ASP C OD2 1 ATOM 4612 N N . THR C 3 199 ? 14.326 -19.138 -9.716 1.00 52.32 ? 202 THR C N 1 ATOM 4613 C CA . THR C 3 199 ? 15.088 -20.362 -9.975 1.00 49.35 ? 202 THR C CA 1 ATOM 4614 C C . THR C 3 199 ? 16.029 -20.651 -8.809 1.00 48.70 ? 202 THR C C 1 ATOM 4615 O O . THR C 3 199 ? 16.772 -19.774 -8.372 1.00 50.38 ? 202 THR C O 1 ATOM 4616 C CB . THR C 3 199 ? 15.901 -20.272 -11.285 1.00 49.27 ? 202 THR C CB 1 ATOM 4617 O OG1 . THR C 3 199 ? 15.060 -19.806 -12.348 1.00 50.63 ? 202 THR C OG1 1 ATOM 4618 C CG2 . THR C 3 199 ? 16.474 -21.635 -11.661 1.00 46.65 ? 202 THR C CG2 1 ATOM 4619 N N . PHE C 3 200 ? 15.984 -21.883 -8.310 1.00 46.67 ? 203 PHE C N 1 ATOM 4620 C CA . PHE C 3 200 ? 16.790 -22.286 -7.163 1.00 46.37 ? 203 PHE C CA 1 ATOM 4621 C C . PHE C 3 200 ? 18.184 -22.729 -7.600 1.00 45.68 ? 203 PHE C C 1 ATOM 4622 O O . PHE C 3 200 ? 18.339 -23.713 -8.327 1.00 43.94 ? 203 PHE C O 1 ATOM 4623 C CB . PHE C 3 200 ? 16.061 -23.377 -6.359 1.00 45.42 ? 203 PHE C CB 1 ATOM 4624 C CG . PHE C 3 200 ? 16.844 -23.921 -5.190 1.00 45.48 ? 203 PHE C CG 1 ATOM 4625 C CD1 . PHE C 3 200 ? 17.480 -23.071 -4.287 1.00 46.84 ? 203 PHE C CD1 1 ATOM 4626 C CD2 . PHE C 3 200 ? 16.916 -25.296 -4.974 1.00 44.40 ? 203 PHE C CD2 1 ATOM 4627 C CE1 . PHE C 3 200 ? 18.195 -23.584 -3.204 1.00 47.36 ? 203 PHE C CE1 1 ATOM 4628 C CE2 . PHE C 3 200 ? 17.624 -25.817 -3.888 1.00 44.80 ? 203 PHE C CE2 1 ATOM 4629 C CZ . PHE C 3 200 ? 18.267 -24.957 -3.006 1.00 46.36 ? 203 PHE C CZ 1 ATOM 4630 N N . PHE C 3 201 ? 19.190 -21.974 -7.165 1.00 47.36 ? 204 PHE C N 1 ATOM 4631 C CA . PHE C 3 201 ? 20.585 -22.295 -7.444 1.00 47.56 ? 204 PHE C CA 1 ATOM 4632 C C . PHE C 3 201 ? 21.307 -22.651 -6.146 1.00 48.74 ? 204 PHE C C 1 ATOM 4633 O O . PHE C 3 201 ? 21.836 -21.764 -5.469 1.00 50.99 ? 204 PHE C O 1 ATOM 4634 C CB . PHE C 3 201 ? 21.300 -21.121 -8.124 1.00 49.34 ? 204 PHE C CB 1 ATOM 4635 C CG . PHE C 3 201 ? 20.813 -20.818 -9.514 1.00 48.83 ? 204 PHE C CG 1 ATOM 4636 C CD1 . PHE C 3 201 ? 19.892 -19.797 -9.734 1.00 49.92 ? 204 PHE C CD1 1 ATOM 4637 C CD2 . PHE C 3 201 ? 21.295 -21.532 -10.607 1.00 47.66 ? 204 PHE C CD2 1 ATOM 4638 C CE1 . PHE C 3 201 ? 19.447 -19.500 -11.016 1.00 50.28 ? 204 PHE C CE1 1 ATOM 4639 C CE2 . PHE C 3 201 ? 20.858 -21.242 -11.896 1.00 47.74 ? 204 PHE C CE2 1 ATOM 4640 C CZ . PHE C 3 201 ? 19.930 -20.228 -12.101 1.00 49.37 ? 204 PHE C CZ 1 ATOM 4641 N N . PRO C 3 202 ? 21.332 -23.951 -5.792 1.00 47.81 ? 205 PRO C N 1 ATOM 4642 C CA . PRO C 3 202 ? 21.992 -24.391 -4.563 1.00 49.38 ? 205 PRO C CA 1 ATOM 4643 C C . PRO C 3 202 ? 23.493 -24.138 -4.621 1.00 51.21 ? 205 PRO C C 1 ATOM 4644 O O . PRO C 3 202 ? 24.100 -24.262 -5.687 1.00 50.67 ? 205 PRO C O 1 ATOM 4645 C CB . PRO C 3 202 ? 21.724 -25.901 -4.531 1.00 47.98 ? 205 PRO C CB 1 ATOM 4646 C CG . PRO C 3 202 ? 20.692 -26.160 -5.570 1.00 45.80 ? 205 PRO C CG 1 ATOM 4647 C CD . PRO C 3 202 ? 20.814 -25.084 -6.577 1.00 45.61 ? 205 PRO C CD 1 ATOM 4648 N N . SER C 3 203 ? 24.083 -23.778 -3.486 1.00 53.98 ? 206 SER C N 1 ATOM 4649 C CA . SER C 3 203 ? 25.525 -23.561 -3.413 1.00 56.38 ? 206 SER C CA 1 ATOM 4650 C C . SER C 3 203 ? 26.276 -24.890 -3.355 1.00 56.52 ? 206 SER C C 1 ATOM 4651 O O . SER C 3 203 ? 25.954 -25.743 -2.525 1.00 56.88 ? 206 SER C O 1 ATOM 4652 C CB . SER C 3 203 ? 25.888 -22.674 -2.219 1.00 59.58 ? 206 SER C CB 1 ATOM 4653 O OG . SER C 3 203 ? 25.542 -21.324 -2.480 1.00 60.30 ? 206 SER C OG 1 ATOM 4654 N N . PRO C 3 204 ? 27.270 -25.071 -4.248 1.00 56.81 ? 207 PRO C N 1 ATOM 4655 C CA . PRO C 3 204 ? 28.081 -26.293 -4.326 1.00 57.41 ? 207 PRO C CA 1 ATOM 4656 C C . PRO C 3 204 ? 28.953 -26.525 -3.094 1.00 60.80 ? 207 PRO C C 1 ATOM 4657 O O . PRO C 3 204 ? 29.273 -25.578 -2.376 1.00 63.30 ? 207 PRO C O 1 ATOM 4658 C CB . PRO C 3 204 ? 28.963 -26.054 -5.560 1.00 57.50 ? 207 PRO C CB 1 ATOM 4659 C CG . PRO C 3 204 ? 28.977 -24.583 -5.752 1.00 58.19 ? 207 PRO C CG 1 ATOM 4660 C CD . PRO C 3 204 ? 27.627 -24.114 -5.312 1.00 56.85 ? 207 PRO C CD 1 ATOM 4661 N N . ALA D 4 3 ? 1.540 -57.657 -39.568 1.00 88.66 ? 3 ALA D N 1 ATOM 4662 C CA . ALA D 4 3 ? 2.952 -57.472 -39.121 1.00 86.66 ? 3 ALA D CA 1 ATOM 4663 C C . ALA D 4 3 ? 3.935 -57.616 -40.284 1.00 82.22 ? 3 ALA D C 1 ATOM 4664 O O . ALA D 4 3 ? 3.816 -58.529 -41.104 1.00 83.14 ? 3 ALA D O 1 ATOM 4665 C CB . ALA D 4 3 ? 3.290 -58.458 -38.007 1.00 92.22 ? 3 ALA D CB 1 ATOM 4666 N N . VAL D 4 4 ? 4.895 -56.698 -40.352 1.00 77.90 ? 4 VAL D N 1 ATOM 4667 C CA . VAL D 4 4 ? 5.947 -56.737 -41.366 1.00 74.11 ? 4 VAL D CA 1 ATOM 4668 C C . VAL D 4 4 ? 7.301 -56.565 -40.674 1.00 73.63 ? 4 VAL D C 1 ATOM 4669 O O . VAL D 4 4 ? 7.498 -55.622 -39.902 1.00 72.77 ? 4 VAL D O 1 ATOM 4670 C CB . VAL D 4 4 ? 5.747 -55.646 -42.456 1.00 69.30 ? 4 VAL D CB 1 ATOM 4671 C CG1 . VAL D 4 4 ? 6.854 -55.709 -43.500 1.00 66.55 ? 4 VAL D CG1 1 ATOM 4672 C CG2 . VAL D 4 4 ? 4.390 -55.790 -43.133 1.00 70.08 ? 4 VAL D CG2 1 ATOM 4673 N N . THR D 4 5 ? 8.223 -57.486 -40.947 1.00 74.59 ? 5 THR D N 1 ATOM 4674 C CA . THR D 4 5 ? 9.534 -57.496 -40.297 1.00 74.95 ? 5 THR D CA 1 ATOM 4675 C C . THR D 4 5 ? 10.631 -57.046 -41.258 1.00 70.96 ? 5 THR D C 1 ATOM 4676 O O . THR D 4 5 ? 10.590 -57.356 -42.448 1.00 69.68 ? 5 THR D O 1 ATOM 4677 C CB . THR D 4 5 ? 9.876 -58.901 -39.740 1.00 80.32 ? 5 THR D CB 1 ATOM 4678 O OG1 . THR D 4 5 ? 8.722 -59.461 -39.104 1.00 84.54 ? 5 THR D OG1 1 ATOM 4679 C CG2 . THR D 4 5 ? 11.017 -58.830 -38.725 1.00 82.05 ? 5 THR D CG2 1 ATOM 4680 N N . GLN D 4 6 ? 11.601 -56.304 -40.729 1.00 69.50 ? 6 GLN D N 1 ATOM 4681 C CA . GLN D 4 6 ? 12.783 -55.893 -41.488 1.00 66.60 ? 6 GLN D CA 1 ATOM 4682 C C . GLN D 4 6 ? 14.054 -56.269 -40.731 1.00 68.89 ? 6 GLN D C 1 ATOM 4683 O O . GLN D 4 6 ? 14.091 -56.203 -39.501 1.00 71.12 ? 6 GLN D O 1 ATOM 4684 C CB . GLN D 4 6 ? 12.774 -54.381 -41.733 1.00 62.49 ? 6 GLN D CB 1 ATOM 4685 C CG . GLN D 4 6 ? 11.634 -53.871 -42.600 1.00 59.96 ? 6 GLN D CG 1 ATOM 4686 C CD . GLN D 4 6 ? 11.655 -52.360 -42.773 1.00 56.74 ? 6 GLN D CD 1 ATOM 4687 O OE1 . GLN D 4 6 ? 10.647 -51.691 -42.562 1.00 56.40 ? 6 GLN D OE1 1 ATOM 4688 N NE2 . GLN D 4 6 ? 12.806 -51.817 -43.157 1.00 55.13 ? 6 GLN D NE2 1 ATOM 4689 N N . SER D 4 7 ? 15.086 -56.671 -41.468 1.00 68.79 ? 7 SER D N 1 ATOM 4690 C CA . SER D 4 7 ? 16.414 -56.879 -40.887 1.00 70.83 ? 7 SER D CA 1 ATOM 4691 C C . SER D 4 7 ? 17.510 -56.461 -41.875 1.00 68.72 ? 7 SER D C 1 ATOM 4692 O O . SER D 4 7 ? 17.395 -56.731 -43.072 1.00 67.77 ? 7 SER D O 1 ATOM 4693 C CB . SER D 4 7 ? 16.606 -58.328 -40.404 1.00 76.08 ? 7 SER D CB 1 ATOM 4694 O OG . SER D 4 7 ? 17.135 -59.165 -41.417 1.00 77.45 ? 7 SER D OG 1 ATOM 4695 N N . PRO D 4 8 ? 18.561 -55.775 -41.383 1.00 68.39 ? 8 PRO D N 1 ATOM 4696 C CA . PRO D 4 8 ? 18.733 -55.360 -39.988 1.00 69.63 ? 8 PRO D CA 1 ATOM 4697 C C . PRO D 4 8 ? 17.900 -54.122 -39.658 1.00 66.62 ? 8 PRO D C 1 ATOM 4698 O O . PRO D 4 8 ? 17.205 -53.594 -40.529 1.00 63.54 ? 8 PRO D O 1 ATOM 4699 C CB . PRO D 4 8 ? 20.228 -55.043 -39.901 1.00 70.35 ? 8 PRO D CB 1 ATOM 4700 C CG . PRO D 4 8 ? 20.601 -54.615 -41.272 1.00 67.74 ? 8 PRO D CG 1 ATOM 4701 C CD . PRO D 4 8 ? 19.688 -55.339 -42.229 1.00 67.25 ? 8 PRO D CD 1 ATOM 4702 N N . ARG D 4 9 ? 17.958 -53.680 -38.405 1.00 68.03 ? 9 ARG D N 1 ATOM 4703 C CA . ARG D 4 9 ? 17.261 -52.471 -37.980 1.00 66.06 ? 9 ARG D CA 1 ATOM 4704 C C . ARG D 4 9 ? 18.212 -51.279 -38.045 1.00 64.21 ? 9 ARG D C 1 ATOM 4705 O O . ARG D 4 9 ? 17.783 -50.138 -38.237 1.00 61.88 ? 9 ARG D O 1 ATOM 4706 C CB . ARG D 4 9 ? 16.694 -52.642 -36.566 1.00 69.42 ? 9 ARG D CB 1 ATOM 4707 C CG . ARG D 4 9 ? 15.912 -53.941 -36.351 1.00 72.99 ? 9 ARG D CG 1 ATOM 4708 C CD . ARG D 4 9 ? 14.481 -53.869 -36.889 1.00 72.00 ? 9 ARG D CD 1 ATOM 4709 N NE . ARG D 4 9 ? 13.539 -53.409 -35.867 1.00 74.11 ? 9 ARG D NE 1 ATOM 4710 C CZ . ARG D 4 9 ? 12.997 -52.195 -35.823 1.00 72.02 ? 9 ARG D CZ 1 ATOM 4711 N NH1 . ARG D 4 9 ? 13.281 -51.291 -36.757 1.00 67.62 ? 9 ARG D NH1 1 ATOM 4712 N NH2 . ARG D 4 9 ? 12.157 -51.887 -34.843 1.00 74.53 ? 9 ARG D NH2 1 ATOM 4713 N N . ASN D 4 10 ? 19.504 -51.558 -37.879 1.00 65.75 ? 10 ASN D N 1 ATOM 4714 C CA . ASN D 4 10 ? 20.558 -50.554 -37.990 1.00 64.67 ? 10 ASN D CA 1 ATOM 4715 C C . ASN D 4 10 ? 21.769 -51.129 -38.721 1.00 65.56 ? 10 ASN D C 1 ATOM 4716 O O . ASN D 4 10 ? 22.183 -52.259 -38.448 1.00 68.62 ? 10 ASN D O 1 ATOM 4717 C CB . ASN D 4 10 ? 20.986 -50.050 -36.606 1.00 67.03 ? 10 ASN D CB 1 ATOM 4718 C CG . ASN D 4 10 ? 19.870 -49.336 -35.863 1.00 66.56 ? 10 ASN D CG 1 ATOM 4719 O OD1 . ASN D 4 10 ? 19.772 -48.109 -35.900 1.00 65.03 ? 10 ASN D OD1 1 ATOM 4720 N ND2 . ASN D 4 10 ? 19.027 -50.101 -35.175 1.00 68.36 ? 10 ASN D ND2 1 ATOM 4721 N N . LYS D 4 11 ? 22.335 -50.355 -39.646 1.00 63.47 ? 11 LYS D N 1 ATOM 4722 C CA . LYS D 4 11 ? 23.516 -50.795 -40.392 1.00 64.73 ? 11 LYS D CA 1 ATOM 4723 C C . LYS D 4 11 ? 24.474 -49.649 -40.724 1.00 64.19 ? 11 LYS D C 1 ATOM 4724 O O . LYS D 4 11 ? 24.066 -48.613 -41.258 1.00 61.68 ? 11 LYS D O 1 ATOM 4725 C CB . LYS D 4 11 ? 23.107 -51.548 -41.669 1.00 63.81 ? 11 LYS D CB 1 ATOM 4726 C CG . LYS D 4 11 ? 24.231 -52.339 -42.353 1.00 66.58 ? 11 LYS D CG 1 ATOM 4727 C CD . LYS D 4 11 ? 24.687 -53.540 -41.516 1.00 70.91 ? 11 LYS D CD 1 ATOM 4728 C CE . LYS D 4 11 ? 25.527 -54.526 -42.327 1.00 73.86 ? 11 LYS D CE 1 ATOM 4729 N NZ . LYS D 4 11 ? 26.868 -53.990 -42.694 1.00 75.16 ? 11 LYS D NZ 1 ATOM 4730 N N . VAL D 4 12 ? 25.747 -49.851 -40.392 1.00 66.97 ? 12 VAL D N 1 ATOM 4731 C CA . VAL D 4 12 ? 26.808 -48.914 -40.747 1.00 67.45 ? 12 VAL D CA 1 ATOM 4732 C C . VAL D 4 12 ? 27.652 -49.545 -41.851 1.00 69.17 ? 12 VAL D C 1 ATOM 4733 O O . VAL D 4 12 ? 28.166 -50.655 -41.691 1.00 72.06 ? 12 VAL D O 1 ATOM 4734 C CB . VAL D 4 12 ? 27.695 -48.550 -39.527 1.00 70.26 ? 12 VAL D CB 1 ATOM 4735 C CG1 . VAL D 4 12 ? 28.742 -47.508 -39.906 1.00 71.11 ? 12 VAL D CG1 1 ATOM 4736 C CG2 . VAL D 4 12 ? 26.839 -48.044 -38.368 1.00 69.31 ? 12 VAL D CG2 1 ATOM 4737 N N . ALA D 4 13 ? 27.783 -48.833 -42.967 1.00 67.91 ? 13 ALA D N 1 ATOM 4738 C CA . ALA D 4 13 ? 28.450 -49.361 -44.154 1.00 69.71 ? 13 ALA D CA 1 ATOM 4739 C C . ALA D 4 13 ? 29.501 -48.406 -44.715 1.00 71.48 ? 13 ALA D C 1 ATOM 4740 O O . ALA D 4 13 ? 29.511 -47.215 -44.389 1.00 70.45 ? 13 ALA D O 1 ATOM 4741 C CB . ALA D 4 13 ? 27.422 -49.693 -45.218 1.00 67.35 ? 13 ALA D CB 1 ATOM 4742 N N . VAL D 4 14 ? 30.378 -48.944 -45.562 1.00 74.60 ? 14 VAL D N 1 ATOM 4743 C CA . VAL D 4 14 ? 31.426 -48.162 -46.216 1.00 77.28 ? 14 VAL D CA 1 ATOM 4744 C C . VAL D 4 14 ? 31.032 -47.848 -47.656 1.00 76.47 ? 14 VAL D C 1 ATOM 4745 O O . VAL D 4 14 ? 30.271 -48.597 -48.275 1.00 75.11 ? 14 VAL D O 1 ATOM 4746 C CB . VAL D 4 14 ? 32.775 -48.919 -46.257 1.00 82.63 ? 14 VAL D CB 1 ATOM 4747 C CG1 . VAL D 4 14 ? 33.930 -47.953 -46.036 1.00 85.49 ? 14 VAL D CG1 1 ATOM 4748 C CG2 . VAL D 4 14 ? 32.811 -50.037 -45.227 1.00 83.86 ? 14 VAL D CG2 1 ATOM 4749 N N . THR D 4 15 ? 31.556 -46.741 -48.180 1.00 77.81 ? 15 THR D N 1 ATOM 4750 C CA . THR D 4 15 ? 31.401 -46.393 -49.590 1.00 78.47 ? 15 THR D CA 1 ATOM 4751 C C . THR D 4 15 ? 32.037 -47.480 -50.451 1.00 82.24 ? 15 THR D C 1 ATOM 4752 O O . THR D 4 15 ? 33.202 -47.835 -50.256 1.00 86.50 ? 15 THR D O 1 ATOM 4753 C CB . THR D 4 15 ? 32.039 -45.019 -49.913 1.00 80.71 ? 15 THR D CB 1 ATOM 4754 O OG1 . THR D 4 15 ? 31.463 -44.014 -49.071 1.00 77.99 ? 15 THR D OG1 1 ATOM 4755 C CG2 . THR D 4 15 ? 31.809 -44.633 -51.372 1.00 81.83 ? 15 THR D CG2 1 ATOM 4756 N N . GLY D 4 16 ? 31.254 -48.016 -51.383 1.00 81.05 ? 16 GLY D N 1 ATOM 4757 C CA . GLY D 4 16 ? 31.722 -49.068 -52.278 1.00 85.01 ? 16 GLY D CA 1 ATOM 4758 C C . GLY D 4 16 ? 31.522 -50.471 -51.739 1.00 85.06 ? 16 GLY D C 1 ATOM 4759 O O . GLY D 4 16 ? 31.994 -51.441 -52.336 1.00 89.08 ? 16 GLY D O 1 ATOM 4760 N N . GLY D 4 17 ? 30.829 -50.579 -50.607 1.00 81.31 ? 17 GLY D N 1 ATOM 4761 C CA . GLY D 4 17 ? 30.501 -51.873 -50.012 1.00 81.52 ? 17 GLY D CA 1 ATOM 4762 C C . GLY D 4 17 ? 29.137 -52.382 -50.444 1.00 78.45 ? 17 GLY D C 1 ATOM 4763 O O . GLY D 4 17 ? 28.363 -51.657 -51.079 1.00 75.55 ? 17 GLY D O 1 ATOM 4764 N N . LYS D 4 18 ? 28.842 -53.634 -50.100 1.00 79.59 ? 18 LYS D N 1 ATOM 4765 C CA . LYS D 4 18 ? 27.553 -54.242 -50.426 1.00 77.27 ? 18 LYS D CA 1 ATOM 4766 C C . LYS D 4 18 ? 26.628 -54.258 -49.213 1.00 73.83 ? 18 LYS D C 1 ATOM 4767 O O . LYS D 4 18 ? 27.046 -54.595 -48.101 1.00 75.17 ? 18 LYS D O 1 ATOM 4768 C CB . LYS D 4 18 ? 27.730 -55.658 -50.990 1.00 81.56 ? 18 LYS D CB 1 ATOM 4769 C CG . LYS D 4 18 ? 26.457 -56.243 -51.599 1.00 80.17 ? 18 LYS D CG 1 ATOM 4770 C CD . LYS D 4 18 ? 26.693 -57.620 -52.208 1.00 85.80 ? 18 LYS D CD 1 ATOM 4771 C CE . LYS D 4 18 ? 25.442 -58.119 -52.920 1.00 84.42 ? 18 LYS D CE 1 ATOM 4772 N NZ . LYS D 4 18 ? 25.691 -59.385 -53.659 1.00 90.00 ? 18 LYS D NZ 1 ATOM 4773 N N . VAL D 4 19 ? 25.372 -53.881 -49.444 1.00 69.86 ? 19 VAL D N 1 ATOM 4774 C CA . VAL D 4 19 ? 24.355 -53.843 -48.399 1.00 66.88 ? 19 VAL D CA 1 ATOM 4775 C C . VAL D 4 19 ? 23.074 -54.517 -48.896 1.00 65.71 ? 19 VAL D C 1 ATOM 4776 O O . VAL D 4 19 ? 22.580 -54.206 -49.981 1.00 64.37 ? 19 VAL D O 1 ATOM 4777 C CB . VAL D 4 19 ? 24.066 -52.387 -47.941 1.00 63.35 ? 19 VAL D CB 1 ATOM 4778 C CG1 . VAL D 4 19 ? 22.859 -52.326 -47.012 1.00 60.52 ? 19 VAL D CG1 1 ATOM 4779 C CG2 . VAL D 4 19 ? 25.288 -51.786 -47.261 1.00 64.71 ? 19 VAL D CG2 1 ATOM 4780 N N . THR D 4 20 ? 22.556 -55.448 -48.099 1.00 66.73 ? 20 THR D N 1 ATOM 4781 C CA . THR D 4 20 ? 21.300 -56.123 -48.407 1.00 66.22 ? 20 THR D CA 1 ATOM 4782 C C . THR D 4 20 ? 20.313 -55.971 -47.250 1.00 64.38 ? 20 THR D C 1 ATOM 4783 O O . THR D 4 20 ? 20.540 -56.484 -46.152 1.00 66.36 ? 20 THR D O 1 ATOM 4784 C CB . THR D 4 20 ? 21.518 -57.620 -48.738 1.00 70.65 ? 20 THR D CB 1 ATOM 4785 O OG1 . THR D 4 20 ? 22.459 -57.743 -49.810 1.00 73.26 ? 20 THR D OG1 1 ATOM 4786 C CG2 . THR D 4 20 ? 20.210 -58.282 -49.153 1.00 70.37 ? 20 THR D CG2 1 ATOM 4787 N N . LEU D 4 21 ? 19.225 -55.250 -47.507 1.00 61.11 ? 21 LEU D N 1 ATOM 4788 C CA . LEU D 4 21 ? 18.165 -55.080 -46.521 1.00 59.92 ? 21 LEU D CA 1 ATOM 4789 C C . LEU D 4 21 ? 17.048 -56.080 -46.780 1.00 61.20 ? 21 LEU D C 1 ATOM 4790 O O . LEU D 4 21 ? 16.583 -56.231 -47.914 1.00 60.72 ? 21 LEU D O 1 ATOM 4791 C CB . LEU D 4 21 ? 17.624 -53.648 -46.535 1.00 56.23 ? 21 LEU D CB 1 ATOM 4792 C CG . LEU D 4 21 ? 18.628 -52.501 -46.359 1.00 55.49 ? 21 LEU D CG 1 ATOM 4793 C CD1 . LEU D 4 21 ? 17.915 -51.153 -46.386 1.00 52.52 ? 21 LEU D CD1 1 ATOM 4794 C CD2 . LEU D 4 21 ? 19.452 -52.650 -45.082 1.00 57.20 ? 21 LEU D CD2 1 ATOM 4795 N N . SER D 4 22 ? 16.631 -56.770 -45.725 1.00 63.43 ? 22 SER D N 1 ATOM 4796 C CA . SER D 4 22 ? 15.614 -57.809 -45.839 1.00 65.60 ? 22 SER D CA 1 ATOM 4797 C C . SER D 4 22 ? 14.240 -57.304 -45.411 1.00 63.82 ? 22 SER D C 1 ATOM 4798 O O . SER D 4 22 ? 14.127 -56.334 -44.655 1.00 61.99 ? 22 SER D O 1 ATOM 4799 C CB . SER D 4 22 ? 16.012 -59.045 -45.022 1.00 70.37 ? 22 SER D CB 1 ATOM 4800 N N . CYS D 4 23 ? 13.202 -57.967 -45.913 1.00 64.90 ? 23 CYS D N 1 ATOM 4801 C CA . CYS D 4 23 ? 11.825 -57.671 -45.540 1.00 64.23 ? 23 CYS D CA 1 ATOM 4802 C C . CYS D 4 23 ? 10.967 -58.931 -45.606 1.00 67.78 ? 23 CYS D C 1 ATOM 4803 O O . CYS D 4 23 ? 10.853 -59.559 -46.660 1.00 68.69 ? 23 CYS D O 1 ATOM 4804 C CB . CYS D 4 23 ? 11.242 -56.584 -46.441 1.00 60.40 ? 23 CYS D CB 1 ATOM 4805 S SG . CYS D 4 23 ? 9.539 -56.162 -46.056 1.00 60.84 ? 23 CYS D SG 1 ATOM 4806 N N . ASN D 4 24 ? 10.368 -59.287 -44.474 1.00 70.28 ? 24 ASN D N 1 ATOM 4807 C CA . ASN D 4 24 ? 9.537 -60.478 -44.374 1.00 74.55 ? 24 ASN D CA 1 ATOM 4808 C C . ASN D 4 24 ? 8.106 -60.146 -43.954 1.00 74.85 ? 24 ASN D C 1 ATOM 4809 O O . ASN D 4 24 ? 7.893 -59.367 -43.022 1.00 74.19 ? 24 ASN D O 1 ATOM 4810 C CB . ASN D 4 24 ? 10.163 -61.473 -43.392 1.00 79.42 ? 24 ASN D CB 1 ATOM 4811 C CG . ASN D 4 24 ? 9.532 -62.854 -43.467 1.00 84.65 ? 24 ASN D CG 1 ATOM 4812 O OD1 . ASN D 4 24 ? 8.931 -63.322 -42.502 1.00 88.45 ? 24 ASN D OD1 1 ATOM 4813 N ND2 . ASN D 4 24 ? 9.665 -63.511 -44.615 1.00 84.99 ? 24 ASN D ND2 1 ATOM 4814 N N . GLN D 4 25 ? 7.134 -60.730 -44.653 1.00 76.31 ? 25 GLN D N 1 ATOM 4815 C CA . GLN D 4 25 ? 5.721 -60.599 -44.285 1.00 77.69 ? 25 GLN D CA 1 ATOM 4816 C C . GLN D 4 25 ? 4.971 -61.925 -44.394 1.00 82.99 ? 25 GLN D C 1 ATOM 4817 O O . GLN D 4 25 ? 5.094 -62.639 -45.393 1.00 83.80 ? 25 GLN D O 1 ATOM 4818 C CB . GLN D 4 25 ? 5.018 -59.490 -45.093 1.00 73.45 ? 25 GLN D CB 1 ATOM 4819 C CG . GLN D 4 25 ? 5.113 -59.593 -46.623 1.00 71.55 ? 25 GLN D CG 1 ATOM 4820 C CD . GLN D 4 25 ? 3.954 -60.349 -47.271 1.00 74.92 ? 25 GLN D CD 1 ATOM 4821 O OE1 . GLN D 4 25 ? 3.024 -60.799 -46.598 1.00 79.02 ? 25 GLN D OE1 1 ATOM 4822 N NE2 . GLN D 4 25 ? 4.009 -60.485 -48.592 1.00 73.68 ? 25 GLN D NE2 1 ATOM 4823 N N . THR D 4 26 ? 4.207 -62.246 -43.353 1.00 87.12 ? 26 THR D N 1 ATOM 4824 C CA . THR D 4 26 ? 3.383 -63.457 -43.325 1.00 93.06 ? 26 THR D CA 1 ATOM 4825 C C . THR D 4 26 ? 1.910 -63.131 -43.576 1.00 93.46 ? 26 THR D C 1 ATOM 4826 O O . THR D 4 26 ? 1.028 -63.954 -43.319 1.00 98.96 ? 26 THR D O 1 ATOM 4827 C CB . THR D 4 26 ? 3.519 -64.219 -41.987 1.00 99.11 ? 26 THR D CB 1 ATOM 4828 O OG1 . THR D 4 26 ? 3.136 -63.365 -40.902 1.00 98.85 ? 26 THR D OG1 1 ATOM 4829 C CG2 . THR D 4 26 ? 4.950 -64.701 -41.780 1.00 99.82 ? 26 THR D CG2 1 ATOM 4830 N N . ASN D 4 27 ? 1.655 -61.928 -44.086 1.00 88.14 ? 27 ASN D N 1 ATOM 4831 C CA . ASN D 4 27 ? 0.300 -61.480 -44.404 1.00 88.27 ? 27 ASN D CA 1 ATOM 4832 C C . ASN D 4 27 ? -0.258 -62.131 -45.670 1.00 89.22 ? 27 ASN D C 1 ATOM 4833 O O . ASN D 4 27 ? -1.464 -62.063 -45.927 1.00 90.91 ? 27 ASN D O 1 ATOM 4834 C CB . ASN D 4 27 ? 0.258 -59.956 -44.545 1.00 82.80 ? 27 ASN D CB 1 ATOM 4835 C CG . ASN D 4 27 ? 0.687 -59.234 -43.280 1.00 82.22 ? 27 ASN D CG 1 ATOM 4836 O OD1 . ASN D 4 27 ? 0.183 -59.505 -42.191 1.00 86.41 ? 27 ASN D OD1 1 ATOM 4837 N ND2 . ASN D 4 27 ? 1.617 -58.295 -43.425 1.00 77.30 ? 27 ASN D ND2 1 ATOM 4838 N N . ASN D 4 28 ? 0.630 -62.758 -46.444 1.00 88.57 ? 28 ASN D N 1 ATOM 4839 C CA . ASN D 4 28 ? 0.292 -63.407 -47.718 1.00 89.70 ? 28 ASN D CA 1 ATOM 4840 C C . ASN D 4 28 ? -0.143 -62.405 -48.799 1.00 85.17 ? 28 ASN D C 1 ATOM 4841 O O . ASN D 4 28 ? -1.005 -62.695 -49.631 1.00 86.66 ? 28 ASN D O 1 ATOM 4842 C CB . ASN D 4 28 ? -0.751 -64.525 -47.518 1.00 96.40 ? 28 ASN D CB 1 ATOM 4843 C CG . ASN D 4 28 ? -0.787 -65.517 -48.673 0.70 98.91 ? 28 ASN D CG 1 ATOM 4844 O OD1 . ASN D 4 28 ? 0.232 -65.792 -49.310 0.70 97.43 ? 28 ASN D OD1 1 ATOM 4845 N ND2 . ASN D 4 28 ? -1.968 -66.064 -48.941 0.70 103.03 ? 28 ASN D ND2 1 ATOM 4846 N N . HIS D 4 29 ? 0.468 -61.222 -48.773 1.00 80.03 ? 29 HIS D N 1 ATOM 4847 C CA . HIS D 4 29 ? 0.203 -60.191 -49.771 1.00 76.02 ? 29 HIS D CA 1 ATOM 4848 C C . HIS D 4 29 ? 1.041 -60.417 -51.022 1.00 74.29 ? 29 HIS D C 1 ATOM 4849 O O . HIS D 4 29 ? 2.174 -60.896 -50.939 1.00 74.51 ? 29 HIS D O 1 ATOM 4850 C CB . HIS D 4 29 ? 0.485 -58.795 -49.202 1.00 72.00 ? 29 HIS D CB 1 ATOM 4851 C CG . HIS D 4 29 ? -0.472 -58.368 -48.131 1.00 73.91 ? 29 HIS D CG 1 ATOM 4852 N ND1 . HIS D 4 29 ? -0.090 -57.584 -47.064 1.00 72.59 ? 29 HIS D ND1 1 ATOM 4853 C CD2 . HIS D 4 29 ? -1.793 -58.618 -47.961 1.00 77.43 ? 29 HIS D CD2 1 ATOM 4854 C CE1 . HIS D 4 29 ? -1.136 -57.363 -46.286 1.00 75.35 ? 29 HIS D CE1 1 ATOM 4855 N NE2 . HIS D 4 29 ? -2.180 -57.983 -46.806 1.00 78.33 ? 29 HIS D NE2 1 ATOM 4856 N N . ASN D 4 30 ? 0.479 -60.073 -52.177 1.00 73.14 ? 30 ASN D N 1 ATOM 4857 C CA . ASN D 4 30 ? 1.198 -60.170 -53.444 1.00 71.85 ? 30 ASN D CA 1 ATOM 4858 C C . ASN D 4 30 ? 2.142 -58.990 -53.654 1.00 67.15 ? 30 ASN D C 1 ATOM 4859 O O . ASN D 4 30 ? 3.294 -59.175 -54.042 1.00 66.48 ? 30 ASN D O 1 ATOM 4860 C CB . ASN D 4 30 ? 0.221 -60.272 -54.621 1.00 73.26 ? 30 ASN D CB 1 ATOM 4861 C CG . ASN D 4 30 ? -0.660 -61.507 -54.551 1.00 78.55 ? 30 ASN D CG 1 ATOM 4862 O OD1 . ASN D 4 30 ? -0.209 -62.594 -54.184 1.00 81.73 ? 30 ASN D OD1 1 ATOM 4863 N ND2 . ASN D 4 30 ? -1.926 -61.344 -54.917 1.00 80.13 ? 30 ASN D ND2 1 ATOM 4864 N N . ASN D 4 31 ? 1.643 -57.785 -53.388 1.00 64.52 ? 31 ASN D N 1 ATOM 4865 C CA . ASN D 4 31 ? 2.396 -56.554 -53.614 1.00 60.67 ? 31 ASN D CA 1 ATOM 4866 C C . ASN D 4 31 ? 3.334 -56.219 -52.464 1.00 59.03 ? 31 ASN D C 1 ATOM 4867 O O . ASN D 4 31 ? 2.933 -56.245 -51.301 1.00 59.93 ? 31 ASN D O 1 ATOM 4868 C CB . ASN D 4 31 ? 1.448 -55.375 -53.856 1.00 59.36 ? 31 ASN D CB 1 ATOM 4869 C CG . ASN D 4 31 ? 0.514 -55.598 -55.032 1.00 61.40 ? 31 ASN D CG 1 ATOM 4870 O OD1 . ASN D 4 31 ? 0.576 -56.623 -55.714 1.00 64.13 ? 31 ASN D OD1 1 ATOM 4871 N ND2 . ASN D 4 31 ? -0.362 -54.630 -55.273 1.00 61.06 ? 31 ASN D ND2 1 ATOM 4872 N N . MET D 4 32 ? 4.583 -55.907 -52.798 1.00 57.07 ? 32 MET D N 1 ATOM 4873 C CA . MET D 4 32 ? 5.566 -55.479 -51.805 1.00 55.58 ? 32 MET D CA 1 ATOM 4874 C C . MET D 4 32 ? 6.336 -54.249 -52.285 1.00 52.55 ? 32 MET D C 1 ATOM 4875 O O . MET D 4 32 ? 6.613 -54.106 -53.476 1.00 52.32 ? 32 MET D O 1 ATOM 4876 C CB . MET D 4 32 ? 6.514 -56.624 -51.432 1.00 57.65 ? 32 MET D CB 1 ATOM 4877 C CG . MET D 4 32 ? 5.866 -57.682 -50.548 1.00 61.07 ? 32 MET D CG 1 ATOM 4878 S SD . MET D 4 32 ? 7.014 -58.893 -49.869 1.00 64.62 ? 32 MET D SD 1 ATOM 4879 C CE . MET D 4 32 ? 7.701 -57.995 -48.484 1.00 62.52 ? 32 MET D CE 1 ATOM 4880 N N . TYR D 4 33 ? 6.665 -53.364 -51.347 1.00 50.78 ? 33 TYR D N 1 ATOM 4881 C CA . TYR D 4 33 ? 7.225 -52.052 -51.672 1.00 48.42 ? 33 TYR D CA 1 ATOM 4882 C C . TYR D 4 33 ? 8.470 -51.736 -50.844 1.00 47.59 ? 33 TYR D C 1 ATOM 4883 O O . TYR D 4 33 ? 8.632 -52.239 -49.730 1.00 48.57 ? 33 TYR D O 1 ATOM 4884 C CB . TYR D 4 33 ? 6.168 -50.961 -51.463 1.00 47.60 ? 33 TYR D CB 1 ATOM 4885 C CG . TYR D 4 33 ? 4.857 -51.217 -52.179 1.00 48.80 ? 33 TYR D CG 1 ATOM 4886 C CD1 . TYR D 4 33 ? 3.881 -52.043 -51.616 1.00 50.85 ? 33 TYR D CD1 1 ATOM 4887 C CD2 . TYR D 4 33 ? 4.588 -50.630 -53.415 1.00 48.54 ? 33 TYR D CD2 1 ATOM 4888 C CE1 . TYR D 4 33 ? 2.678 -52.288 -52.272 1.00 52.44 ? 33 TYR D CE1 1 ATOM 4889 C CE2 . TYR D 4 33 ? 3.385 -50.866 -54.079 1.00 49.96 ? 33 TYR D CE2 1 ATOM 4890 C CZ . TYR D 4 33 ? 2.436 -51.696 -53.499 1.00 52.03 ? 33 TYR D CZ 1 ATOM 4891 O OH . TYR D 4 33 ? 1.245 -51.936 -54.145 1.00 54.43 ? 33 TYR D OH 1 ATOM 4892 N N . TRP D 4 34 ? 9.349 -50.908 -51.404 1.00 46.30 ? 34 TRP D N 1 ATOM 4893 C CA . TRP D 4 34 ? 10.545 -50.436 -50.704 1.00 45.54 ? 34 TRP D CA 1 ATOM 4894 C C . TRP D 4 34 ? 10.646 -48.916 -50.814 1.00 44.15 ? 34 TRP D C 1 ATOM 4895 O O . TRP D 4 34 ? 10.814 -48.373 -51.910 1.00 44.06 ? 34 TRP D O 1 ATOM 4896 C CB . TRP D 4 34 ? 11.813 -51.095 -51.265 1.00 46.46 ? 34 TRP D CB 1 ATOM 4897 C CG . TRP D 4 34 ? 12.288 -52.311 -50.510 1.00 47.96 ? 34 TRP D CG 1 ATOM 4898 C CD1 . TRP D 4 34 ? 12.367 -53.590 -50.983 1.00 50.09 ? 34 TRP D CD1 1 ATOM 4899 C CD2 . TRP D 4 34 ? 12.770 -52.356 -49.158 1.00 48.12 ? 34 TRP D CD2 1 ATOM 4900 N NE1 . TRP D 4 34 ? 12.857 -54.431 -50.010 1.00 51.35 ? 34 TRP D NE1 1 ATOM 4901 C CE2 . TRP D 4 34 ? 13.111 -53.700 -48.880 1.00 50.35 ? 34 TRP D CE2 1 ATOM 4902 C CE3 . TRP D 4 34 ? 12.943 -51.393 -48.154 1.00 46.78 ? 34 TRP D CE3 1 ATOM 4903 C CZ2 . TRP D 4 34 ? 13.614 -54.104 -47.642 1.00 51.63 ? 34 TRP D CZ2 1 ATOM 4904 C CZ3 . TRP D 4 34 ? 13.441 -51.797 -46.919 1.00 47.90 ? 34 TRP D CZ3 1 ATOM 4905 C CH2 . TRP D 4 34 ? 13.771 -53.141 -46.676 1.00 50.42 ? 34 TRP D CH2 1 ATOM 4906 N N . TYR D 4 35 ? 10.529 -48.239 -49.675 1.00 43.75 ? 35 TYR D N 1 ATOM 4907 C CA . TYR D 4 35 ? 10.617 -46.778 -49.614 1.00 43.08 ? 35 TYR D CA 1 ATOM 4908 C C . TYR D 4 35 ? 11.835 -46.340 -48.811 1.00 43.07 ? 35 TYR D C 1 ATOM 4909 O O . TYR D 4 35 ? 12.407 -47.132 -48.058 1.00 43.54 ? 35 TYR D O 1 ATOM 4910 C CB . TYR D 4 35 ? 9.371 -46.177 -48.949 1.00 43.26 ? 35 TYR D CB 1 ATOM 4911 C CG . TYR D 4 35 ? 8.045 -46.511 -49.589 1.00 43.68 ? 35 TYR D CG 1 ATOM 4912 C CD1 . TYR D 4 35 ? 7.254 -47.546 -49.091 1.00 45.05 ? 35 TYR D CD1 1 ATOM 4913 C CD2 . TYR D 4 35 ? 7.561 -45.774 -50.667 1.00 43.71 ? 35 TYR D CD2 1 ATOM 4914 C CE1 . TYR D 4 35 ? 6.020 -47.851 -49.661 1.00 45.45 ? 35 TYR D CE1 1 ATOM 4915 C CE2 . TYR D 4 35 ? 6.326 -46.070 -51.246 1.00 44.35 ? 35 TYR D CE2 1 ATOM 4916 C CZ . TYR D 4 35 ? 5.566 -47.111 -50.738 1.00 45.17 ? 35 TYR D CZ 1 ATOM 4917 O OH . TYR D 4 35 ? 4.350 -47.413 -51.301 1.00 46.59 ? 35 TYR D OH 1 ATOM 4918 N N . ARG D 4 36 ? 12.218 -45.074 -48.973 1.00 43.03 ? 36 ARG D N 1 ATOM 4919 C CA . ARG D 4 36 ? 13.176 -44.424 -48.078 1.00 43.40 ? 36 ARG D CA 1 ATOM 4920 C C . ARG D 4 36 ? 12.652 -43.071 -47.600 1.00 43.96 ? 36 ARG D C 1 ATOM 4921 O O . ARG D 4 36 ? 11.955 -42.374 -48.340 1.00 44.13 ? 36 ARG D O 1 ATOM 4922 C CB . ARG D 4 36 ? 14.553 -44.275 -48.736 1.00 43.96 ? 36 ARG D CB 1 ATOM 4923 C CG . ARG D 4 36 ? 14.592 -43.422 -49.996 1.00 44.38 ? 36 ARG D CG 1 ATOM 4924 C CD . ARG D 4 36 ? 16.022 -43.254 -50.502 1.00 45.79 ? 36 ARG D CD 1 ATOM 4925 N NE . ARG D 4 36 ? 16.761 -42.257 -49.731 1.00 46.73 ? 36 ARG D NE 1 ATOM 4926 C CZ . ARG D 4 36 ? 17.980 -41.817 -50.032 1.00 48.31 ? 36 ARG D CZ 1 ATOM 4927 N NH1 . ARG D 4 36 ? 18.628 -42.281 -51.095 1.00 49.14 ? 36 ARG D NH1 1 ATOM 4928 N NH2 . ARG D 4 36 ? 18.556 -40.906 -49.262 1.00 49.41 ? 36 ARG D NH2 1 ATOM 4929 N N . GLN D 4 37 ? 12.996 -42.706 -46.366 1.00 44.85 ? 37 GLN D N 1 ATOM 4930 C CA . GLN D 4 37 ? 12.526 -41.460 -45.761 1.00 46.17 ? 37 GLN D CA 1 ATOM 4931 C C . GLN D 4 37 ? 13.658 -40.481 -45.435 1.00 47.66 ? 37 GLN D C 1 ATOM 4932 O O . GLN D 4 37 ? 14.578 -40.805 -44.680 1.00 48.04 ? 37 GLN D O 1 ATOM 4933 C CB . GLN D 4 37 ? 11.704 -41.756 -44.507 1.00 46.88 ? 37 GLN D CB 1 ATOM 4934 C CG . GLN D 4 37 ? 10.886 -40.574 -44.006 1.00 48.16 ? 37 GLN D CG 1 ATOM 4935 C CD . GLN D 4 37 ? 10.121 -40.892 -42.743 1.00 49.28 ? 37 GLN D CD 1 ATOM 4936 O OE1 . GLN D 4 37 ? 10.596 -41.636 -41.888 1.00 49.38 ? 37 GLN D OE1 1 ATOM 4937 N NE2 . GLN D 4 37 ? 8.926 -40.326 -42.617 1.00 51.19 ? 37 GLN D NE2 1 ATOM 4938 N N . ASP D 4 38 ? 13.563 -39.281 -46.006 1.00 49.05 ? 38 ASP D N 1 ATOM 4939 C CA . ASP D 4 38 ? 14.552 -38.218 -45.817 1.00 51.18 ? 38 ASP D CA 1 ATOM 4940 C C . ASP D 4 38 ? 13.846 -36.914 -45.454 1.00 53.53 ? 38 ASP D C 1 ATOM 4941 O O . ASP D 4 38 ? 12.784 -36.613 -46.003 1.00 53.99 ? 38 ASP D O 1 ATOM 4942 C CB . ASP D 4 38 ? 15.363 -38.019 -47.100 1.00 51.58 ? 38 ASP D CB 1 ATOM 4943 C CG . ASP D 4 38 ? 15.993 -39.304 -47.600 1.00 50.33 ? 38 ASP D CG 1 ATOM 4944 O OD1 . ASP D 4 38 ? 17.096 -39.651 -47.129 1.00 51.14 ? 38 ASP D OD1 1 ATOM 4945 O OD2 . ASP D 4 38 ? 15.390 -39.961 -48.475 1.00 49.69 ? 38 ASP D OD2 1 ATOM 4946 N N . THR D 4 39 ? 14.439 -36.140 -44.545 1.00 55.72 ? 39 THR D N 1 ATOM 4947 C CA . THR D 4 39 ? 13.817 -34.906 -44.046 1.00 58.76 ? 39 THR D CA 1 ATOM 4948 C C . THR D 4 39 ? 13.415 -33.946 -45.163 1.00 60.38 ? 39 THR D C 1 ATOM 4949 O O . THR D 4 39 ? 14.182 -33.705 -46.098 1.00 60.74 ? 39 THR D O 1 ATOM 4950 C CB . THR D 4 39 ? 14.713 -34.153 -43.033 1.00 61.32 ? 39 THR D CB 1 ATOM 4951 O OG1 . THR D 4 39 ? 16.073 -34.176 -43.481 1.00 61.76 ? 39 THR D OG1 1 ATOM 4952 C CG2 . THR D 4 39 ? 14.625 -34.788 -41.651 1.00 61.36 ? 39 THR D CG2 1 ATOM 4953 N N . GLY D 4 40 ? 12.199 -33.415 -45.050 1.00 61.94 ? 40 GLY D N 1 ATOM 4954 C CA . GLY D 4 40 ? 11.658 -32.466 -46.016 1.00 64.15 ? 40 GLY D CA 1 ATOM 4955 C C . GLY D 4 40 ? 11.237 -33.098 -47.329 1.00 62.16 ? 40 GLY D C 1 ATOM 4956 O O . GLY D 4 40 ? 11.266 -32.440 -48.372 1.00 64.12 ? 40 GLY D O 1 ATOM 4957 N N . HIS D 4 41 ? 10.837 -34.369 -47.288 1.00 58.77 ? 41 HIS D N 1 ATOM 4958 C CA . HIS D 4 41 ? 10.402 -35.060 -48.503 1.00 57.00 ? 41 HIS D CA 1 ATOM 4959 C C . HIS D 4 41 ? 9.078 -35.808 -48.392 1.00 55.61 ? 41 HIS D C 1 ATOM 4960 O O . HIS D 4 41 ? 8.105 -35.463 -49.069 1.00 57.00 ? 41 HIS D O 1 ATOM 4961 C CB . HIS D 4 41 ? 11.501 -35.983 -49.039 1.00 54.84 ? 41 HIS D CB 1 ATOM 4962 C CG . HIS D 4 41 ? 12.403 -35.323 -50.033 1.00 56.98 ? 41 HIS D CG 1 ATOM 4963 N ND1 . HIS D 4 41 ? 13.597 -34.733 -49.679 1.00 59.07 ? 41 HIS D ND1 1 ATOM 4964 C CD2 . HIS D 4 41 ? 12.278 -35.147 -51.369 1.00 58.27 ? 41 HIS D CD2 1 ATOM 4965 C CE1 . HIS D 4 41 ? 14.173 -34.228 -50.755 1.00 61.12 ? 41 HIS D CE1 1 ATOM 4966 N NE2 . HIS D 4 41 ? 13.393 -34.466 -51.794 1.00 60.95 ? 41 HIS D NE2 1 ATOM 4967 N N . GLY D 4 42 ? 9.044 -36.832 -47.546 1.00 53.24 ? 42 GLY D N 1 ATOM 4968 C CA . GLY D 4 42 ? 7.943 -37.790 -47.564 1.00 51.58 ? 42 GLY D CA 1 ATOM 4969 C C . GLY D 4 42 ? 8.392 -39.021 -48.323 1.00 48.60 ? 42 GLY D C 1 ATOM 4970 O O . GLY D 4 42 ? 9.130 -38.911 -49.300 1.00 48.35 ? 42 GLY D O 1 ATOM 4971 N N . LEU D 4 43 ? 7.959 -40.192 -47.864 1.00 47.01 ? 43 LEU D N 1 ATOM 4972 C CA . LEU D 4 43 ? 8.373 -41.475 -48.432 1.00 44.78 ? 43 LEU D CA 1 ATOM 4973 C C . LEU D 4 43 ? 8.410 -41.483 -49.961 1.00 44.39 ? 43 LEU D C 1 ATOM 4974 O O . LEU D 4 43 ? 7.488 -40.993 -50.620 1.00 45.29 ? 43 LEU D O 1 ATOM 4975 C CB . LEU D 4 43 ? 7.468 -42.602 -47.917 1.00 44.64 ? 43 LEU D CB 1 ATOM 4976 C CG . LEU D 4 43 ? 7.846 -43.364 -46.638 1.00 44.65 ? 43 LEU D CG 1 ATOM 4977 C CD1 . LEU D 4 43 ? 7.927 -42.466 -45.408 1.00 45.88 ? 43 LEU D CD1 1 ATOM 4978 C CD2 . LEU D 4 43 ? 6.852 -44.488 -46.396 1.00 44.86 ? 43 LEU D CD2 1 ATOM 4979 N N . ARG D 4 44 ? 9.492 -42.033 -50.510 1.00 43.30 ? 44 ARG D N 1 ATOM 4980 C CA . ARG D 4 44 ? 9.669 -42.141 -51.956 1.00 43.40 ? 44 ARG D CA 1 ATOM 4981 C C . ARG D 4 44 ? 9.979 -43.574 -52.367 1.00 42.52 ? 44 ARG D C 1 ATOM 4982 O O . ARG D 4 44 ? 10.803 -44.247 -51.742 1.00 41.99 ? 44 ARG D O 1 ATOM 4983 C CB . ARG D 4 44 ? 10.773 -41.203 -52.440 1.00 44.48 ? 44 ARG D CB 1 ATOM 4984 C CG . ARG D 4 44 ? 10.381 -39.735 -52.476 1.00 46.23 ? 44 ARG D CG 1 ATOM 4985 C CD . ARG D 4 44 ? 11.567 -38.863 -52.863 1.00 48.24 ? 44 ARG D CD 1 ATOM 4986 N NE . ARG D 4 44 ? 12.669 -38.974 -51.909 0.70 47.47 ? 44 ARG D NE 1 ATOM 4987 C CZ . ARG D 4 44 ? 13.890 -38.483 -52.102 0.70 48.92 ? 44 ARG D CZ 1 ATOM 4988 N NH1 . ARG D 4 44 ? 14.189 -37.840 -53.223 0.70 51.06 ? 44 ARG D NH1 1 ATOM 4989 N NH2 . ARG D 4 44 ? 14.819 -38.642 -51.168 0.70 48.60 ? 44 ARG D NH2 1 ATOM 4990 N N . LEU D 4 45 ? 9.324 -44.022 -53.436 1.00 42.87 ? 45 LEU D N 1 ATOM 4991 C CA . LEU D 4 45 ? 9.378 -45.418 -53.867 1.00 42.59 ? 45 LEU D CA 1 ATOM 4992 C C . LEU D 4 45 ? 10.664 -45.759 -54.616 1.00 43.25 ? 45 LEU D C 1 ATOM 4993 O O . LEU D 4 45 ? 11.012 -45.117 -55.615 1.00 44.47 ? 45 LEU D O 1 ATOM 4994 C CB . LEU D 4 45 ? 8.145 -45.759 -54.716 1.00 43.20 ? 45 LEU D CB 1 ATOM 4995 C CG . LEU D 4 45 ? 7.818 -47.223 -55.034 1.00 43.60 ? 45 LEU D CG 1 ATOM 4996 C CD1 . LEU D 4 45 ? 7.759 -48.099 -53.788 1.00 43.21 ? 45 LEU D CD1 1 ATOM 4997 C CD2 . LEU D 4 45 ? 6.508 -47.300 -55.780 1.00 44.60 ? 45 LEU D CD2 1 ATOM 4998 N N . ILE D 4 46 ? 11.362 -46.776 -54.120 1.00 42.97 ? 46 ILE D N 1 ATOM 4999 C CA . ILE D 4 46 ? 12.595 -47.251 -54.740 1.00 44.10 ? 46 ILE D CA 1 ATOM 5000 C C . ILE D 4 46 ? 12.307 -48.401 -55.712 1.00 45.41 ? 46 ILE D C 1 ATOM 5001 O O . ILE D 4 46 ? 12.629 -48.319 -56.900 1.00 47.12 ? 46 ILE D O 1 ATOM 5002 C CB . ILE D 4 46 ? 13.627 -47.696 -53.682 1.00 43.83 ? 46 ILE D CB 1 ATOM 5003 C CG1 . ILE D 4 46 ? 14.009 -46.525 -52.776 1.00 42.73 ? 46 ILE D CG1 1 ATOM 5004 C CG2 . ILE D 4 46 ? 14.867 -48.264 -54.363 1.00 46.11 ? 46 ILE D CG2 1 ATOM 5005 C CD1 . ILE D 4 46 ? 14.706 -46.935 -51.489 1.00 42.22 ? 46 ILE D CD1 1 ATOM 5006 N N . HIS D 4 47 ? 11.703 -49.464 -55.190 1.00 45.17 ? 47 HIS D N 1 ATOM 5007 C CA . HIS D 4 47 ? 11.362 -50.646 -55.969 1.00 46.79 ? 47 HIS D CA 1 ATOM 5008 C C . HIS D 4 47 ? 10.089 -51.284 -55.419 1.00 46.41 ? 47 HIS D C 1 ATOM 5009 O O . HIS D 4 47 ? 9.832 -51.233 -54.215 1.00 45.38 ? 47 HIS D O 1 ATOM 5010 C CB . HIS D 4 47 ? 12.498 -51.676 -55.917 1.00 48.55 ? 47 HIS D CB 1 ATOM 5011 C CG . HIS D 4 47 ? 13.663 -51.361 -56.806 1.00 50.15 ? 47 HIS D CG 1 ATOM 5012 N ND1 . HIS D 4 47 ? 13.562 -51.312 -58.180 1.00 51.95 ? 47 HIS D ND1 1 ATOM 5013 C CD2 . HIS D 4 47 ? 14.965 -51.119 -56.517 1.00 50.99 ? 47 HIS D CD2 1 ATOM 5014 C CE1 . HIS D 4 47 ? 14.746 -51.029 -58.697 1.00 54.03 ? 47 HIS D CE1 1 ATOM 5015 N NE2 . HIS D 4 47 ? 15.615 -50.906 -57.709 1.00 52.91 ? 47 HIS D NE2 1 ATOM 5016 N N . TYR D 4 48 ? 9.300 -51.888 -56.301 1.00 47.75 ? 48 TYR D N 1 ATOM 5017 C CA . TYR D 4 48 ? 8.109 -52.625 -55.886 1.00 48.36 ? 48 TYR D CA 1 ATOM 5018 C C . TYR D 4 48 ? 7.957 -53.952 -56.639 1.00 51.24 ? 48 TYR D C 1 ATOM 5019 O O . TYR D 4 48 ? 8.594 -54.166 -57.676 1.00 52.71 ? 48 TYR D O 1 ATOM 5020 C CB . TYR D 4 48 ? 6.850 -51.757 -56.012 1.00 47.47 ? 48 TYR D CB 1 ATOM 5021 C CG . TYR D 4 48 ? 6.481 -51.360 -57.426 1.00 48.23 ? 48 TYR D CG 1 ATOM 5022 C CD1 . TYR D 4 48 ? 7.040 -50.230 -58.025 1.00 47.48 ? 48 TYR D CD1 1 ATOM 5023 C CD2 . TYR D 4 48 ? 5.558 -52.105 -58.158 1.00 49.67 ? 48 TYR D CD2 1 ATOM 5024 C CE1 . TYR D 4 48 ? 6.699 -49.865 -59.324 1.00 48.81 ? 48 TYR D CE1 1 ATOM 5025 C CE2 . TYR D 4 48 ? 5.208 -51.747 -59.451 1.00 50.78 ? 48 TYR D CE2 1 ATOM 5026 C CZ . TYR D 4 48 ? 5.780 -50.627 -60.030 1.00 50.40 ? 48 TYR D CZ 1 ATOM 5027 O OH . TYR D 4 48 ? 5.427 -50.272 -61.314 1.00 52.09 ? 48 TYR D OH 1 ATOM 5028 N N . SER D 4 49 ? 7.114 -54.835 -56.106 1.00 52.55 ? 49 SER D N 1 ATOM 5029 C CA . SER D 4 49 ? 6.954 -56.184 -56.640 1.00 55.78 ? 49 SER D CA 1 ATOM 5030 C C . SER D 4 49 ? 5.487 -56.589 -56.669 1.00 57.21 ? 49 SER D C 1 ATOM 5031 O O . SER D 4 49 ? 4.738 -56.261 -55.755 1.00 56.47 ? 49 SER D O 1 ATOM 5032 C CB . SER D 4 49 ? 7.756 -57.180 -55.794 1.00 57.36 ? 49 SER D CB 1 ATOM 5033 O OG . SER D 4 49 ? 7.551 -58.519 -56.217 1.00 60.70 ? 49 SER D OG 1 ATOM 5034 N N . TYR D 4 50 ? 5.091 -57.307 -57.717 1.00 59.98 ? 50 TYR D N 1 ATOM 5035 C CA . TYR D 4 50 ? 3.719 -57.801 -57.854 1.00 62.12 ? 50 TYR D CA 1 ATOM 5036 C C . TYR D 4 50 ? 3.572 -59.280 -57.485 1.00 66.01 ? 50 TYR D C 1 ATOM 5037 O O . TYR D 4 50 ? 2.495 -59.862 -57.653 1.00 68.60 ? 50 TYR D O 1 ATOM 5038 C CB . TYR D 4 50 ? 3.193 -57.560 -59.277 1.00 63.15 ? 50 TYR D CB 1 ATOM 5039 C CG . TYR D 4 50 ? 2.682 -56.157 -59.530 1.00 60.50 ? 50 TYR D CG 1 ATOM 5040 C CD1 . TYR D 4 50 ? 1.589 -55.654 -58.825 1.00 59.85 ? 50 TYR D CD1 1 ATOM 5041 C CD2 . TYR D 4 50 ? 3.277 -55.340 -60.489 1.00 59.52 ? 50 TYR D CD2 1 ATOM 5042 C CE1 . TYR D 4 50 ? 1.113 -54.366 -59.055 1.00 58.26 ? 50 TYR D CE1 1 ATOM 5043 C CE2 . TYR D 4 50 ? 2.806 -54.051 -60.731 1.00 57.92 ? 50 TYR D CE2 1 ATOM 5044 C CZ . TYR D 4 50 ? 1.725 -53.572 -60.008 1.00 57.27 ? 50 TYR D CZ 1 ATOM 5045 O OH . TYR D 4 50 ? 1.251 -52.302 -60.235 1.00 56.02 ? 50 TYR D OH 1 ATOM 5046 N N . GLY D 4 51 ? 4.651 -59.882 -56.984 1.00 66.97 ? 51 GLY D N 1 ATOM 5047 C CA . GLY D 4 51 ? 4.644 -61.291 -56.589 1.00 71.33 ? 51 GLY D CA 1 ATOM 5048 C C . GLY D 4 51 ? 5.970 -61.990 -56.821 1.00 73.54 ? 51 GLY D C 1 ATOM 5049 O O . GLY D 4 51 ? 6.915 -61.390 -57.335 1.00 71.61 ? 51 GLY D O 1 ATOM 5050 N N . ALA D 4 52 ? 6.030 -63.266 -56.447 1.00 78.26 ? 52 ALA D N 1 ATOM 5051 C CA . ALA D 4 52 ? 7.249 -64.070 -56.563 1.00 81.64 ? 52 ALA D CA 1 ATOM 5052 C C . ALA D 4 52 ? 7.798 -64.104 -57.991 1.00 83.16 ? 52 ALA D C 1 ATOM 5053 O O . ALA D 4 52 ? 7.177 -64.668 -58.897 1.00 86.18 ? 52 ALA D O 1 ATOM 5054 C CB . ALA D 4 52 ? 7.004 -65.483 -56.045 1.00 87.17 ? 52 ALA D CB 1 ATOM 5055 N N . GLY D 4 53 ? 8.962 -63.484 -58.177 1.00 81.60 ? 53 GLY D N 1 ATOM 5056 C CA . GLY D 4 53 ? 9.595 -63.376 -59.492 1.00 83.35 ? 53 GLY D CA 1 ATOM 5057 C C . GLY D 4 53 ? 9.574 -61.965 -60.062 1.00 79.36 ? 53 GLY D C 1 ATOM 5058 O O . GLY D 4 53 ? 10.395 -61.624 -60.917 1.00 80.18 ? 53 GLY D O 1 ATOM 5059 N N . SER D 4 54 ? 8.638 -61.144 -59.586 1.00 75.68 ? 54 SER D N 1 ATOM 5060 C CA . SER D 4 54 ? 8.466 -59.780 -60.086 1.00 72.34 ? 54 SER D CA 1 ATOM 5061 C C . SER D 4 54 ? 9.299 -58.749 -59.321 1.00 68.76 ? 54 SER D C 1 ATOM 5062 O O . SER D 4 54 ? 9.446 -58.829 -58.099 1.00 67.47 ? 54 SER D O 1 ATOM 5063 C CB . SER D 4 54 ? 6.985 -59.384 -60.057 1.00 70.94 ? 54 SER D CB 1 ATOM 5064 O OG . SER D 4 54 ? 6.790 -58.054 -60.511 1.00 68.30 ? 54 SER D OG 1 ATOM 5065 N N . THR D 4 55 ? 9.839 -57.786 -60.063 1.00 67.70 ? 55 THR D N 1 ATOM 5066 C CA . THR D 4 55 ? 10.578 -56.652 -59.503 1.00 64.63 ? 55 THR D CA 1 ATOM 5067 C C . THR D 4 55 ? 10.517 -55.479 -60.480 1.00 63.77 ? 55 THR D C 1 ATOM 5068 O O . THR D 4 55 ? 10.879 -55.618 -61.651 1.00 66.64 ? 55 THR D O 1 ATOM 5069 C CB . THR D 4 55 ? 12.056 -57.009 -59.156 1.00 65.99 ? 55 THR D CB 1 ATOM 5070 O OG1 . THR D 4 55 ? 12.817 -55.807 -58.982 1.00 63.80 ? 55 THR D OG1 1 ATOM 5071 C CG2 . THR D 4 55 ? 12.704 -57.867 -60.249 1.00 70.62 ? 55 THR D CG2 1 ATOM 5072 N N . GLU D 4 56 ? 10.039 -54.334 -60.003 1.00 60.52 ? 56 GLU D N 1 ATOM 5073 C CA . GLU D 4 56 ? 9.834 -53.174 -60.871 1.00 60.18 ? 56 GLU D CA 1 ATOM 5074 C C . GLU D 4 56 ? 10.420 -51.893 -60.285 1.00 57.76 ? 56 GLU D C 1 ATOM 5075 O O . GLU D 4 56 ? 10.425 -51.697 -59.069 1.00 55.48 ? 56 GLU D O 1 ATOM 5076 C CB . GLU D 4 56 ? 8.342 -52.975 -61.179 1.00 59.87 ? 56 GLU D CB 1 ATOM 5077 C CG . GLU D 4 56 ? 7.641 -54.167 -61.840 1.00 62.91 ? 56 GLU D CG 1 ATOM 5078 C CD . GLU D 4 56 ? 8.065 -54.407 -63.287 1.00 66.94 ? 56 GLU D CD 1 ATOM 5079 O OE1 . GLU D 4 56 ? 8.652 -53.495 -63.910 1.00 67.45 ? 56 GLU D OE1 1 ATOM 5080 O OE2 . GLU D 4 56 ? 7.797 -55.514 -63.806 1.00 69.70 ? 56 GLU D OE2 1 ATOM 5081 N N . LYS D 4 57 ? 10.902 -51.021 -61.167 1.00 58.83 ? 57 LYS D N 1 ATOM 5082 C CA . LYS D 4 57 ? 11.472 -49.738 -60.769 1.00 57.46 ? 57 LYS D CA 1 ATOM 5083 C C . LYS D 4 57 ? 10.392 -48.766 -60.295 1.00 55.43 ? 57 LYS D C 1 ATOM 5084 O O . LYS D 4 57 ? 9.324 -48.660 -60.904 1.00 56.19 ? 57 LYS D O 1 ATOM 5085 C CB . LYS D 4 57 ? 12.257 -49.115 -61.926 1.00 60.18 ? 57 LYS D CB 1 ATOM 5086 C CG . LYS D 4 57 ? 13.514 -49.877 -62.324 1.00 62.84 ? 57 LYS D CG 1 ATOM 5087 C CD . LYS D 4 57 ? 14.231 -49.184 -63.472 1.00 66.19 ? 57 LYS D CD 1 ATOM 5088 C CE . LYS D 4 57 ? 15.529 -49.886 -63.824 1.00 69.53 ? 57 LYS D CE 1 ATOM 5089 N NZ . LYS D 4 57 ? 16.336 -49.086 -64.786 1.00 73.36 ? 57 LYS D NZ 1 ATOM 5090 N N . GLY D 4 58 ? 10.679 -48.067 -59.201 1.00 53.34 ? 58 GLY D N 1 ATOM 5091 C CA . GLY D 4 58 ? 9.797 -47.023 -58.698 1.00 51.94 ? 58 GLY D CA 1 ATOM 5092 C C . GLY D 4 58 ? 10.217 -45.667 -59.228 1.00 53.14 ? 58 GLY D C 1 ATOM 5093 O O . GLY D 4 58 ? 10.700 -45.559 -60.358 1.00 55.43 ? 58 GLY D O 1 ATOM 5094 N N . ASP D 4 59 ? 10.039 -44.635 -58.407 1.00 52.15 ? 59 ASP D N 1 ATOM 5095 C CA . ASP D 4 59 ? 10.409 -43.271 -58.787 1.00 53.89 ? 59 ASP D CA 1 ATOM 5096 C C . ASP D 4 59 ? 11.911 -42.998 -58.675 1.00 54.59 ? 59 ASP D C 1 ATOM 5097 O O . ASP D 4 59 ? 12.452 -42.208 -59.450 1.00 57.22 ? 59 ASP D O 1 ATOM 5098 C CB . ASP D 4 59 ? 9.618 -42.247 -57.969 1.00 53.36 ? 59 ASP D CB 1 ATOM 5099 C CG . ASP D 4 59 ? 8.127 -42.294 -58.261 1.00 54.31 ? 59 ASP D CG 1 ATOM 5100 O OD1 . ASP D 4 59 ? 7.333 -42.327 -57.297 0.90 53.56 ? 59 ASP D OD1 1 ATOM 5101 O OD2 . ASP D 4 59 ? 7.746 -42.303 -59.454 0.90 56.94 ? 59 ASP D OD2 1 ATOM 5102 N N . ILE D 4 60 ? 12.576 -43.645 -57.718 1.00 52.76 ? 60 ILE D N 1 ATOM 5103 C CA . ILE D 4 60 ? 14.023 -43.471 -57.521 1.00 53.53 ? 60 ILE D CA 1 ATOM 5104 C C . ILE D 4 60 ? 14.782 -44.808 -57.412 1.00 53.39 ? 60 ILE D C 1 ATOM 5105 O O . ILE D 4 60 ? 15.222 -45.195 -56.326 1.00 52.13 ? 60 ILE D O 1 ATOM 5106 C CB . ILE D 4 60 ? 14.353 -42.545 -56.301 1.00 52.47 ? 60 ILE D CB 1 ATOM 5107 C CG1 . ILE D 4 60 ? 13.590 -42.982 -55.046 1.00 49.49 ? 60 ILE D CG1 1 ATOM 5108 C CG2 . ILE D 4 60 ? 14.056 -41.084 -56.631 1.00 54.13 ? 60 ILE D CG2 1 ATOM 5109 C CD1 . ILE D 4 60 ? 14.324 -42.701 -53.754 1.00 47.93 ? 60 ILE D CD1 1 ATOM 5110 N N . PRO D 4 61 ? 14.948 -45.518 -58.542 1.00 55.31 ? 61 PRO D N 1 ATOM 5111 C CA . PRO D 4 61 ? 15.599 -46.827 -58.476 1.00 55.80 ? 61 PRO D CA 1 ATOM 5112 C C . PRO D 4 61 ? 17.135 -46.806 -58.595 1.00 58.09 ? 61 PRO D C 1 ATOM 5113 O O . PRO D 4 61 ? 17.784 -47.806 -58.271 1.00 58.72 ? 61 PRO D O 1 ATOM 5114 C CB . PRO D 4 61 ? 14.976 -47.578 -59.656 1.00 57.41 ? 61 PRO D CB 1 ATOM 5115 C CG . PRO D 4 61 ? 14.648 -46.509 -60.654 1.00 59.09 ? 61 PRO D CG 1 ATOM 5116 C CD . PRO D 4 61 ? 14.475 -45.206 -59.905 1.00 57.65 ? 61 PRO D CD 1 ATOM 5117 N N . ASP D 4 62 ? 17.702 -45.683 -59.039 1.00 59.79 ? 62 ASP D N 1 ATOM 5118 C CA . ASP D 4 62 ? 19.147 -45.569 -59.293 1.00 62.85 ? 62 ASP D CA 1 ATOM 5119 C C . ASP D 4 62 ? 20.024 -45.855 -58.073 1.00 61.70 ? 62 ASP D C 1 ATOM 5120 O O . ASP D 4 62 ? 19.872 -45.233 -57.021 1.00 59.46 ? 62 ASP D O 1 ATOM 5121 C CB . ASP D 4 62 ? 19.488 -44.196 -59.885 1.00 65.40 ? 62 ASP D CB 1 ATOM 5122 C CG . ASP D 4 62 ? 19.214 -44.114 -61.380 1.00 69.12 ? 62 ASP D CG 1 ATOM 5123 O OD1 . ASP D 4 62 ? 19.796 -43.225 -62.038 1.00 73.12 ? 62 ASP D OD1 1 ATOM 5124 O OD2 . ASP D 4 62 ? 18.425 -44.933 -61.904 1.00 68.89 ? 62 ASP D OD2 1 ATOM 5125 N N . GLY D 4 63 ? 20.943 -46.804 -58.233 1.00 63.91 ? 63 GLY D N 1 ATOM 5126 C CA . GLY D 4 63 ? 21.839 -47.224 -57.158 1.00 63.55 ? 63 GLY D CA 1 ATOM 5127 C C . GLY D 4 63 ? 21.293 -48.381 -56.342 1.00 61.30 ? 63 GLY D C 1 ATOM 5128 O O . GLY D 4 63 ? 21.982 -48.909 -55.467 1.00 61.57 ? 63 GLY D O 1 ATOM 5129 N N . TYR D 4 64 ? 20.053 -48.773 -56.633 1.00 59.51 ? 65 TYR D N 1 ATOM 5130 C CA . TYR D 4 64 ? 19.376 -49.841 -55.904 1.00 57.91 ? 65 TYR D CA 1 ATOM 5131 C C . TYR D 4 64 ? 18.934 -50.972 -56.826 1.00 59.83 ? 65 TYR D C 1 ATOM 5132 O O . TYR D 4 64 ? 18.451 -50.729 -57.935 1.00 60.80 ? 65 TYR D O 1 ATOM 5133 C CB . TYR D 4 64 ? 18.138 -49.299 -55.190 1.00 54.43 ? 65 TYR D CB 1 ATOM 5134 C CG . TYR D 4 64 ? 18.382 -48.182 -54.201 1.00 52.79 ? 65 TYR D CG 1 ATOM 5135 C CD1 . TYR D 4 64 ? 18.694 -48.462 -52.872 1.00 52.13 ? 65 TYR D CD1 1 ATOM 5136 C CD2 . TYR D 4 64 ? 18.271 -46.846 -54.587 1.00 52.59 ? 65 TYR D CD2 1 ATOM 5137 C CE1 . TYR D 4 64 ? 18.911 -47.442 -51.955 1.00 51.16 ? 65 TYR D CE1 1 ATOM 5138 C CE2 . TYR D 4 64 ? 18.484 -45.814 -53.676 1.00 51.91 ? 65 TYR D CE2 1 ATOM 5139 C CZ . TYR D 4 64 ? 18.804 -46.121 -52.361 1.00 51.07 ? 65 TYR D CZ 1 ATOM 5140 O OH . TYR D 4 64 ? 19.018 -45.112 -51.448 1.00 50.62 ? 65 TYR D OH 1 ATOM 5141 N N . LYS D 4 65 ? 19.102 -52.206 -56.358 1.00 60.91 ? 66 LYS D N 1 ATOM 5142 C CA . LYS D 4 65 ? 18.503 -53.376 -56.996 1.00 62.53 ? 66 LYS D CA 1 ATOM 5143 C C . LYS D 4 65 ? 17.498 -54.013 -56.039 1.00 60.52 ? 66 LYS D C 1 ATOM 5144 O O . LYS D 4 65 ? 17.563 -53.797 -54.827 1.00 58.77 ? 66 LYS D O 1 ATOM 5145 C CB . LYS D 4 65 ? 19.572 -54.396 -57.394 1.00 67.01 ? 66 LYS D CB 1 ATOM 5146 C CG . LYS D 4 65 ? 20.241 -54.122 -58.729 1.00 70.62 ? 66 LYS D CG 1 ATOM 5147 C CD . LYS D 4 65 ? 21.193 -55.253 -59.098 1.00 76.28 ? 66 LYS D CD 1 ATOM 5148 C CE . LYS D 4 65 ? 21.665 -55.149 -60.545 1.00 80.82 ? 66 LYS D CE 1 ATOM 5149 N N . ALA D 4 66 ? 16.567 -54.788 -56.586 1.00 61.26 ? 67 ALA D N 1 ATOM 5150 C CA . ALA D 4 66 ? 15.567 -55.481 -55.780 1.00 60.20 ? 67 ALA D CA 1 ATOM 5151 C C . ALA D 4 66 ? 15.421 -56.934 -56.207 1.00 63.77 ? 67 ALA D C 1 ATOM 5152 O O . ALA D 4 66 ? 15.708 -57.282 -57.354 1.00 66.59 ? 67 ALA D O 1 ATOM 5153 C CB . ALA D 4 66 ? 14.238 -54.771 -55.863 1.00 57.40 ? 67 ALA D CB 1 ATOM 5154 N N . SER D 4 67 ? 14.972 -57.777 -55.280 1.00 64.26 ? 68 SER D N 1 ATOM 5155 C CA . SER D 4 67 ? 14.822 -59.208 -55.537 1.00 68.27 ? 68 SER D CA 1 ATOM 5156 C C . SER D 4 67 ? 13.665 -59.809 -54.742 1.00 68.15 ? 68 SER D C 1 ATOM 5157 O O . SER D 4 67 ? 13.558 -59.600 -53.531 1.00 66.80 ? 68 SER D O 1 ATOM 5158 C CB . SER D 4 67 ? 16.124 -59.947 -55.219 1.00 71.76 ? 68 SER D CB 1 ATOM 5159 O OG . SER D 4 67 ? 15.969 -61.345 -55.376 1.00 76.51 ? 68 SER D OG 1 ATOM 5160 N N . ARG D 4 68 ? 12.807 -60.554 -55.434 1.00 70.06 ? 69 ARG D N 1 ATOM 5161 C CA . ARG D 4 68 ? 11.670 -61.217 -54.808 1.00 70.88 ? 69 ARG D CA 1 ATOM 5162 C C . ARG D 4 68 ? 11.731 -62.726 -55.082 1.00 76.50 ? 69 ARG D C 1 ATOM 5163 O O . ARG D 4 68 ? 11.133 -63.209 -56.049 1.00 78.50 ? 69 ARG D O 1 ATOM 5164 C CB . ARG D 4 68 ? 10.355 -60.610 -55.316 1.00 68.47 ? 69 ARG D CB 1 ATOM 5165 C CG . ARG D 4 68 ? 9.094 -61.087 -54.597 1.00 69.06 ? 69 ARG D CG 1 ATOM 5166 C CD . ARG D 4 68 ? 8.711 -60.168 -53.453 1.00 64.95 ? 69 ARG D CD 1 ATOM 5167 N NE . ARG D 4 68 ? 7.547 -60.656 -52.714 1.00 66.12 ? 69 ARG D NE 1 ATOM 5168 C CZ . ARG D 4 68 ? 6.284 -60.350 -53.000 1.00 65.33 ? 69 ARG D CZ 1 ATOM 5169 N NH1 . ARG D 4 68 ? 5.996 -59.552 -54.021 1.00 62.74 ? 69 ARG D NH1 1 ATOM 5170 N NH2 . ARG D 4 68 ? 5.302 -60.843 -52.259 1.00 67.59 ? 69 ARG D NH2 1 ATOM 5171 N N . PRO D 4 69 ? 12.468 -63.475 -54.236 1.00 79.46 ? 70 PRO D N 1 ATOM 5172 C CA . PRO D 4 69 ? 12.611 -64.922 -54.423 1.00 85.59 ? 70 PRO D CA 1 ATOM 5173 C C . PRO D 4 69 ? 11.336 -65.687 -54.075 1.00 87.94 ? 70 PRO D C 1 ATOM 5174 O O . PRO D 4 69 ? 11.084 -66.752 -54.639 1.00 92.85 ? 70 PRO D O 1 ATOM 5175 C CB . PRO D 4 69 ? 13.734 -65.303 -53.444 1.00 87.72 ? 70 PRO D CB 1 ATOM 5176 C CG . PRO D 4 69 ? 14.326 -64.011 -52.970 1.00 82.69 ? 70 PRO D CG 1 ATOM 5177 C CD . PRO D 4 69 ? 13.233 -63.004 -53.069 1.00 77.77 ? 70 PRO D CD 1 ATOM 5178 N N . SER D 4 70 ? 10.547 -65.139 -53.155 1.00 85.04 ? 71 SER D N 1 ATOM 5179 C CA . SER D 4 70 ? 9.325 -65.780 -52.681 1.00 87.59 ? 71 SER D CA 1 ATOM 5180 C C . SER D 4 70 ? 8.269 -64.739 -52.323 1.00 83.14 ? 71 SER D C 1 ATOM 5181 O O . SER D 4 70 ? 8.548 -63.539 -52.309 1.00 78.22 ? 71 SER D O 1 ATOM 5182 C CB . SER D 4 70 ? 9.626 -66.664 -51.466 1.00 91.91 ? 71 SER D CB 1 ATOM 5183 O OG . SER D 4 70 ? 10.181 -65.905 -50.404 1.00 88.97 ? 71 SER D OG 1 ATOM 5184 N N . GLN D 4 71 ? 7.059 -65.214 -52.034 1.00 85.54 ? 72 GLN D N 1 ATOM 5185 C CA . GLN D 4 71 ? 5.944 -64.365 -51.614 1.00 82.60 ? 72 GLN D CA 1 ATOM 5186 C C . GLN D 4 71 ? 6.256 -63.629 -50.306 1.00 80.17 ? 72 GLN D C 1 ATOM 5187 O O . GLN D 4 71 ? 5.852 -62.479 -50.117 1.00 76.17 ? 72 GLN D O 1 ATOM 5188 C CB . GLN D 4 71 ? 4.672 -65.214 -51.465 1.00 87.05 ? 72 GLN D CB 1 ATOM 5189 C CG . GLN D 4 71 ? 3.404 -64.445 -51.091 1.00 85.26 ? 72 GLN D CG 1 ATOM 5190 C CD . GLN D 4 71 ? 2.701 -63.803 -52.280 1.00 82.93 ? 72 GLN D CD 1 ATOM 5191 O OE1 . GLN D 4 71 ? 3.293 -63.593 -53.342 1.00 81.18 ? 72 GLN D OE1 1 ATOM 5192 N NE2 . GLN D 4 71 ? 1.425 -63.484 -52.100 1.00 83.22 ? 72 GLN D NE2 1 ATOM 5193 N N . GLU D 4 72 ? 6.992 -64.297 -49.421 1.00 83.15 ? 73 GLU D N 1 ATOM 5194 C CA . GLU D 4 72 ? 7.285 -63.778 -48.087 1.00 82.04 ? 73 GLU D CA 1 ATOM 5195 C C . GLU D 4 72 ? 8.420 -62.754 -48.057 1.00 77.50 ? 73 GLU D C 1 ATOM 5196 O O . GLU D 4 72 ? 8.368 -61.801 -47.277 1.00 74.72 ? 73 GLU D O 1 ATOM 5197 C CB . GLU D 4 72 ? 7.594 -64.930 -47.122 1.00 87.84 ? 73 GLU D CB 1 ATOM 5198 C CG . GLU D 4 72 ? 6.413 -65.852 -46.837 1.00 93.01 ? 73 GLU D CG 1 ATOM 5199 N N . ASN D 4 73 ? 9.435 -62.948 -48.899 1.00 77.28 ? 74 ASN D N 1 ATOM 5200 C CA . ASN D 4 73 ? 10.644 -62.114 -48.863 1.00 74.03 ? 74 ASN D CA 1 ATOM 5201 C C . ASN D 4 73 ? 10.841 -61.164 -50.046 1.00 69.90 ? 74 ASN D C 1 ATOM 5202 O O . ASN D 4 73 ? 10.730 -61.564 -51.206 1.00 70.98 ? 74 ASN D O 1 ATOM 5203 C CB . ASN D 4 73 ? 11.894 -62.984 -48.686 1.00 77.78 ? 74 ASN D CB 1 ATOM 5204 C CG . ASN D 4 73 ? 12.083 -63.461 -47.254 1.00 81.07 ? 74 ASN D CG 1 ATOM 5205 O OD1 . ASN D 4 73 ? 12.163 -64.663 -46.995 1.00 86.48 ? 74 ASN D OD1 1 ATOM 5206 N ND2 . ASN D 4 73 ? 12.161 -62.519 -46.317 1.00 78.31 ? 74 ASN D ND2 1 ATOM 5207 N N . PHE D 4 74 ? 11.143 -59.907 -49.729 1.00 65.71 ? 75 PHE D N 1 ATOM 5208 C CA . PHE D 4 74 ? 11.517 -58.898 -50.720 1.00 62.22 ? 75 PHE D CA 1 ATOM 5209 C C . PHE D 4 74 ? 12.766 -58.166 -50.229 1.00 60.49 ? 75 PHE D C 1 ATOM 5210 O O . PHE D 4 74 ? 12.796 -57.666 -49.106 1.00 59.30 ? 75 PHE D O 1 ATOM 5211 C CB . PHE D 4 74 ? 10.354 -57.925 -50.952 1.00 59.20 ? 75 PHE D CB 1 ATOM 5212 C CG . PHE D 4 74 ? 10.526 -57.016 -52.147 1.00 56.79 ? 75 PHE D CG 1 ATOM 5213 C CD1 . PHE D 4 74 ? 11.134 -57.468 -53.316 1.00 58.19 ? 75 PHE D CD1 1 ATOM 5214 C CD2 . PHE D 4 74 ? 10.036 -55.712 -52.109 1.00 53.65 ? 75 PHE D CD2 1 ATOM 5215 C CE1 . PHE D 4 74 ? 11.278 -56.626 -54.416 1.00 56.96 ? 75 PHE D CE1 1 ATOM 5216 C CE2 . PHE D 4 74 ? 10.170 -54.862 -53.204 1.00 52.04 ? 75 PHE D CE2 1 ATOM 5217 C CZ . PHE D 4 74 ? 10.792 -55.319 -54.360 1.00 54.06 ? 75 PHE D CZ 1 ATOM 5218 N N . SER D 4 75 ? 13.799 -58.124 -51.069 1.00 60.83 ? 76 SER D N 1 ATOM 5219 C CA . SER D 4 75 ? 15.104 -57.598 -50.666 1.00 60.30 ? 76 SER D CA 1 ATOM 5220 C C . SER D 4 75 ? 15.573 -56.402 -51.485 1.00 57.73 ? 76 SER D C 1 ATOM 5221 O O . SER D 4 75 ? 15.373 -56.345 -52.698 1.00 57.82 ? 76 SER D O 1 ATOM 5222 C CB . SER D 4 75 ? 16.163 -58.699 -50.721 1.00 64.42 ? 76 SER D CB 1 ATOM 5223 O OG . SER D 4 75 ? 15.957 -59.646 -49.692 1.00 67.39 ? 76 SER D OG 1 ATOM 5224 N N . LEU D 4 76 ? 16.203 -55.452 -50.799 1.00 55.95 ? 77 LEU D N 1 ATOM 5225 C CA . LEU D 4 76 ? 16.802 -54.291 -51.439 1.00 54.31 ? 77 LEU D CA 1 ATOM 5226 C C . LEU D 4 76 ? 18.315 -54.425 -51.388 1.00 56.54 ? 77 LEU D C 1 ATOM 5227 O O . LEU D 4 76 ? 18.902 -54.538 -50.310 1.00 57.17 ? 77 LEU D O 1 ATOM 5228 C CB . LEU D 4 76 ? 16.347 -53.000 -50.757 1.00 51.09 ? 77 LEU D CB 1 ATOM 5229 C CG . LEU D 4 76 ? 16.685 -51.676 -51.448 1.00 49.75 ? 77 LEU D CG 1 ATOM 5230 C CD1 . LEU D 4 76 ? 15.956 -51.541 -52.781 1.00 49.18 ? 77 LEU D CD1 1 ATOM 5231 C CD2 . LEU D 4 76 ? 16.353 -50.503 -50.533 1.00 47.53 ? 77 LEU D CD2 1 ATOM 5232 N N . ILE D 4 77 ? 18.937 -54.422 -52.562 1.00 58.36 ? 78 ILE D N 1 ATOM 5233 C CA . ILE D 4 77 ? 20.370 -54.665 -52.684 1.00 61.58 ? 78 ILE D CA 1 ATOM 5234 C C . ILE D 4 77 ? 21.105 -53.414 -53.161 1.00 61.23 ? 78 ILE D C 1 ATOM 5235 O O . ILE D 4 77 ? 20.741 -52.811 -54.174 1.00 60.63 ? 78 ILE D O 1 ATOM 5236 C CB . ILE D 4 77 ? 20.671 -55.866 -53.622 1.00 65.56 ? 78 ILE D CB 1 ATOM 5237 C CG1 . ILE D 4 77 ? 19.950 -57.126 -53.126 1.00 66.81 ? 78 ILE D CG1 1 ATOM 5238 C CG2 . ILE D 4 77 ? 22.175 -56.111 -53.722 1.00 69.43 ? 78 ILE D CG2 1 ATOM 5239 C CD1 . ILE D 4 77 ? 19.819 -58.233 -54.160 1.00 70.83 ? 78 ILE D CD1 1 ATOM 5240 N N . LEU D 4 78 ? 22.132 -53.032 -52.406 1.00 62.17 ? 79 LEU D N 1 ATOM 5241 C CA . LEU D 4 78 ? 23.005 -51.920 -52.754 1.00 62.94 ? 79 LEU D CA 1 ATOM 5242 C C . LEU D 4 78 ? 24.381 -52.476 -53.115 1.00 67.73 ? 79 LEU D C 1 ATOM 5243 O O . LEU D 4 78 ? 25.155 -52.847 -52.232 1.00 69.38 ? 79 LEU D O 1 ATOM 5244 C CB . LEU D 4 78 ? 23.114 -50.937 -51.581 1.00 60.61 ? 79 LEU D CB 1 ATOM 5245 C CG . LEU D 4 78 ? 21.928 -50.041 -51.198 1.00 56.93 ? 79 LEU D CG 1 ATOM 5246 C CD1 . LEU D 4 78 ? 20.778 -50.816 -50.555 1.00 55.35 ? 79 LEU D CD1 1 ATOM 5247 C CD2 . LEU D 4 78 ? 22.399 -48.945 -50.260 1.00 55.95 ? 79 LEU D CD2 1 ATOM 5248 N N . GLU D 4 79 ? 24.673 -52.551 -54.413 1.00 70.69 ? 80 GLU D N 1 ATOM 5249 C CA . GLU D 4 79 ? 25.927 -53.144 -54.895 1.00 76.14 ? 80 GLU D CA 1 ATOM 5250 C C . GLU D 4 79 ? 27.143 -52.313 -54.499 1.00 77.85 ? 80 GLU D C 1 ATOM 5251 O O . GLU D 4 79 ? 28.083 -52.833 -53.895 1.00 80.85 ? 80 GLU D O 1 ATOM 5252 C CB . GLU D 4 79 ? 25.897 -53.356 -56.415 1.00 79.09 ? 80 GLU D CB 1 ATOM 5253 C CG . GLU D 4 79 ? 25.109 -54.577 -56.868 1.00 80.02 ? 80 GLU D CG 1 ATOM 5254 N N . LEU D 4 80 ? 27.115 -51.028 -54.843 1.00 76.64 ? 81 LEU D N 1 ATOM 5255 C CA . LEU D 4 80 ? 28.191 -50.103 -54.504 1.00 78.45 ? 81 LEU D CA 1 ATOM 5256 C C . LEU D 4 80 ? 27.608 -48.925 -53.738 1.00 74.35 ? 81 LEU D C 1 ATOM 5257 O O . LEU D 4 80 ? 27.185 -47.930 -54.333 1.00 73.59 ? 81 LEU D O 1 ATOM 5258 C CB . LEU D 4 80 ? 28.925 -49.627 -55.764 1.00 82.81 ? 81 LEU D CB 1 ATOM 5259 C CG . LEU D 4 80 ? 29.822 -50.641 -56.482 1.00 88.48 ? 81 LEU D CG 1 ATOM 5260 N N . ALA D 4 81 ? 27.580 -49.056 -52.414 1.00 72.40 ? 82 ALA D N 1 ATOM 5261 C CA . ALA D 4 81 ? 26.962 -48.066 -51.535 1.00 68.68 ? 82 ALA D CA 1 ATOM 5262 C C . ALA D 4 81 ? 27.602 -46.685 -51.657 1.00 69.92 ? 82 ALA D C 1 ATOM 5263 O O . ALA D 4 81 ? 28.821 -46.565 -51.781 1.00 73.75 ? 82 ALA D O 1 ATOM 5264 C CB . ALA D 4 81 ? 27.002 -48.548 -50.093 1.00 67.71 ? 82 ALA D CB 1 ATOM 5265 N N . THR D 4 82 ? 26.764 -45.652 -51.633 1.00 67.24 ? 83 THR D N 1 ATOM 5266 C CA . THR D 4 82 ? 27.219 -44.261 -51.671 1.00 68.58 ? 83 THR D CA 1 ATOM 5267 C C . THR D 4 82 ? 26.705 -43.517 -50.437 1.00 65.87 ? 83 THR D C 1 ATOM 5268 O O . THR D 4 82 ? 25.702 -43.925 -49.855 1.00 62.70 ? 83 THR D O 1 ATOM 5269 C CB . THR D 4 82 ? 26.740 -43.533 -52.949 1.00 69.27 ? 83 THR D CB 1 ATOM 5270 O OG1 . THR D 4 82 ? 25.321 -43.676 -53.089 1.00 65.71 ? 83 THR D OG1 1 ATOM 5271 C CG2 . THR D 4 82 ? 27.431 -44.094 -54.183 1.00 73.25 ? 83 THR D CG2 1 ATOM 5272 N N . PRO D 4 83 ? 27.392 -42.428 -50.027 1.00 67.76 ? 84 PRO D N 1 ATOM 5273 C CA . PRO D 4 83 ? 26.963 -41.645 -48.859 1.00 66.00 ? 84 PRO D CA 1 ATOM 5274 C C . PRO D 4 83 ? 25.543 -41.081 -48.968 1.00 63.06 ? 84 PRO D C 1 ATOM 5275 O O . PRO D 4 83 ? 24.873 -40.912 -47.949 1.00 61.12 ? 84 PRO D O 1 ATOM 5276 C CB . PRO D 4 83 ? 27.980 -40.503 -48.812 1.00 69.61 ? 84 PRO D CB 1 ATOM 5277 C CG . PRO D 4 83 ? 29.196 -41.061 -49.462 1.00 73.23 ? 84 PRO D CG 1 ATOM 5278 C CD . PRO D 4 83 ? 28.679 -41.940 -50.561 1.00 72.37 ? 84 PRO D CD 1 ATOM 5279 N N . SER D 4 84 ? 25.091 -40.802 -50.188 1.00 63.29 ? 85 SER D N 1 ATOM 5280 C CA . SER D 4 84 ? 23.739 -40.296 -50.421 1.00 60.93 ? 85 SER D CA 1 ATOM 5281 C C . SER D 4 84 ? 22.657 -41.325 -50.078 1.00 57.50 ? 85 SER D C 1 ATOM 5282 O O . SER D 4 84 ? 21.493 -40.966 -49.876 1.00 55.66 ? 85 SER D O 1 ATOM 5283 C CB . SER D 4 84 ? 23.583 -39.839 -51.870 1.00 62.71 ? 85 SER D CB 1 ATOM 5284 O OG . SER D 4 84 ? 23.702 -40.936 -52.758 1.00 62.86 ? 85 SER D OG 1 ATOM 5285 N N . GLN D 4 85 ? 23.045 -42.598 -50.012 1.00 57.25 ? 86 GLN D N 1 ATOM 5286 C CA . GLN D 4 85 ? 22.117 -43.678 -49.665 1.00 54.80 ? 86 GLN D CA 1 ATOM 5287 C C . GLN D 4 85 ? 21.972 -43.856 -48.149 1.00 53.83 ? 86 GLN D C 1 ATOM 5288 O O . GLN D 4 85 ? 21.440 -44.862 -47.675 1.00 52.75 ? 86 GLN D O 1 ATOM 5289 C CB . GLN D 4 85 ? 22.533 -44.990 -50.339 1.00 55.81 ? 86 GLN D CB 1 ATOM 5290 C CG . GLN D 4 85 ? 22.416 -44.967 -51.862 1.00 56.74 ? 86 GLN D CG 1 ATOM 5291 C CD . GLN D 4 85 ? 22.961 -46.220 -52.517 1.00 58.28 ? 86 GLN D CD 1 ATOM 5292 O OE1 . GLN D 4 85 ? 24.053 -46.687 -52.189 1.00 59.95 ? 86 GLN D OE1 1 ATOM 5293 N NE2 . GLN D 4 85 ? 22.201 -46.770 -53.457 1.00 58.06 ? 86 GLN D NE2 1 ATOM 5294 N N . THR D 4 86 ? 22.460 -42.873 -47.399 1.00 54.92 ? 87 THR D N 1 ATOM 5295 C CA . THR D 4 86 ? 22.212 -42.781 -45.971 1.00 54.43 ? 87 THR D CA 1 ATOM 5296 C C . THR D 4 86 ? 20.790 -42.268 -45.814 1.00 52.83 ? 87 THR D C 1 ATOM 5297 O O . THR D 4 86 ? 20.471 -41.158 -46.254 1.00 53.27 ? 87 THR D O 1 ATOM 5298 C CB . THR D 4 86 ? 23.203 -41.811 -45.288 1.00 56.57 ? 87 THR D CB 1 ATOM 5299 O OG1 . THR D 4 86 ? 24.545 -42.273 -45.492 1.00 58.45 ? 87 THR D OG1 1 ATOM 5300 C CG2 . THR D 4 86 ? 22.925 -41.695 -43.789 1.00 56.27 ? 87 THR D CG2 1 ATOM 5301 N N . SER D 4 87 ? 19.940 -43.090 -45.201 1.00 51.59 ? 88 SER D N 1 ATOM 5302 C CA . SER D 4 87 ? 18.522 -42.786 -45.030 1.00 50.24 ? 88 SER D CA 1 ATOM 5303 C C . SER D 4 87 ? 17.895 -43.788 -44.062 1.00 49.80 ? 88 SER D C 1 ATOM 5304 O O . SER D 4 87 ? 18.588 -44.641 -43.502 1.00 50.78 ? 88 SER D O 1 ATOM 5305 C CB . SER D 4 87 ? 17.803 -42.839 -46.387 1.00 49.28 ? 88 SER D CB 1 ATOM 5306 O OG . SER D 4 87 ? 16.470 -42.359 -46.296 1.00 48.85 ? 88 SER D OG 1 ATOM 5307 N N . VAL D 4 88 ? 16.587 -43.668 -43.856 1.00 48.88 ? 89 VAL D N 1 ATOM 5308 C CA . VAL D 4 88 ? 15.817 -44.681 -43.148 1.00 48.80 ? 89 VAL D CA 1 ATOM 5309 C C . VAL D 4 88 ? 14.962 -45.390 -44.192 1.00 47.65 ? 89 VAL D C 1 ATOM 5310 O O . VAL D 4 88 ? 14.250 -44.742 -44.961 1.00 46.92 ? 89 VAL D O 1 ATOM 5311 C CB . VAL D 4 88 ? 14.919 -44.078 -42.042 1.00 49.67 ? 89 VAL D CB 1 ATOM 5312 C CG1 . VAL D 4 88 ? 14.329 -45.180 -41.178 1.00 50.71 ? 89 VAL D CG1 1 ATOM 5313 C CG2 . VAL D 4 88 ? 15.701 -43.099 -41.177 1.00 51.00 ? 89 VAL D CG2 1 ATOM 5314 N N . TYR D 4 89 ? 15.042 -46.715 -44.226 1.00 47.98 ? 90 TYR D N 1 ATOM 5315 C CA . TYR D 4 89 ? 14.349 -47.493 -45.245 1.00 47.22 ? 90 TYR D CA 1 ATOM 5316 C C . TYR D 4 89 ? 13.119 -48.199 -44.687 1.00 48.03 ? 90 TYR D C 1 ATOM 5317 O O . TYR D 4 89 ? 13.189 -48.851 -43.645 1.00 49.72 ? 90 TYR D O 1 ATOM 5318 C CB . TYR D 4 89 ? 15.310 -48.485 -45.901 1.00 47.71 ? 90 TYR D CB 1 ATOM 5319 C CG . TYR D 4 89 ? 16.407 -47.812 -46.696 1.00 47.32 ? 90 TYR D CG 1 ATOM 5320 C CD1 . TYR D 4 89 ? 17.580 -47.379 -46.076 1.00 48.07 ? 90 TYR D CD1 1 ATOM 5321 C CD2 . TYR D 4 89 ? 16.268 -47.596 -48.066 1.00 46.64 ? 90 TYR D CD2 1 ATOM 5322 C CE1 . TYR D 4 89 ? 18.587 -46.750 -46.801 1.00 48.20 ? 90 TYR D CE1 1 ATOM 5323 C CE2 . TYR D 4 89 ? 17.271 -46.972 -48.800 1.00 47.07 ? 90 TYR D CE2 1 ATOM 5324 C CZ . TYR D 4 89 ? 18.427 -46.552 -48.160 1.00 47.93 ? 90 TYR D CZ 1 ATOM 5325 O OH . TYR D 4 89 ? 19.419 -45.934 -48.881 1.00 48.98 ? 90 TYR D OH 1 ATOM 5326 N N . PHE D 4 90 ? 11.995 -48.054 -45.386 1.00 47.33 ? 91 PHE D N 1 ATOM 5327 C CA . PHE D 4 90 ? 10.742 -48.684 -44.986 1.00 48.39 ? 91 PHE D CA 1 ATOM 5328 C C . PHE D 4 90 ? 10.261 -49.663 -46.036 1.00 48.59 ? 91 PHE D C 1 ATOM 5329 O O . PHE D 4 90 ? 10.270 -49.360 -47.231 1.00 47.50 ? 91 PHE D O 1 ATOM 5330 C CB . PHE D 4 90 ? 9.654 -47.636 -44.745 1.00 48.28 ? 91 PHE D CB 1 ATOM 5331 C CG . PHE D 4 90 ? 9.824 -46.871 -43.473 1.00 48.97 ? 91 PHE D CG 1 ATOM 5332 C CD1 . PHE D 4 90 ? 10.309 -45.571 -43.492 1.00 48.01 ? 91 PHE D CD1 1 ATOM 5333 C CD2 . PHE D 4 90 ? 9.500 -47.449 -42.253 1.00 51.09 ? 91 PHE D CD2 1 ATOM 5334 C CE1 . PHE D 4 90 ? 10.471 -44.857 -42.314 1.00 49.31 ? 91 PHE D CE1 1 ATOM 5335 C CE2 . PHE D 4 90 ? 9.660 -46.742 -41.069 1.00 52.70 ? 91 PHE D CE2 1 ATOM 5336 C CZ . PHE D 4 90 ? 10.149 -45.444 -41.101 1.00 51.50 ? 91 PHE D CZ 1 ATOM 5337 N N . CYS D 4 91 ? 9.830 -50.832 -45.578 1.00 50.63 ? 92 CYS D N 1 ATOM 5338 C CA . CYS D 4 91 ? 9.237 -51.834 -46.453 1.00 51.64 ? 92 CYS D CA 1 ATOM 5339 C C . CYS D 4 91 ? 7.731 -51.927 -46.216 1.00 52.67 ? 92 CYS D C 1 ATOM 5340 O O . CYS D 4 91 ? 7.262 -51.717 -45.096 1.00 54.13 ? 92 CYS D O 1 ATOM 5341 C CB . CYS D 4 91 ? 9.900 -53.188 -46.229 1.00 53.84 ? 92 CYS D CB 1 ATOM 5342 S SG . CYS D 4 91 ? 9.184 -54.524 -47.200 1.00 57.20 ? 92 CYS D SG 1 ATOM 5343 N N . ALA D 4 92 ? 6.979 -52.236 -47.271 1.00 52.50 ? 93 ALA D N 1 ATOM 5344 C CA . ALA D 4 92 ? 5.518 -52.327 -47.179 1.00 53.82 ? 93 ALA D CA 1 ATOM 5345 C C . ALA D 4 92 ? 4.935 -53.484 -47.993 1.00 55.47 ? 93 ALA D C 1 ATOM 5346 O O . ALA D 4 92 ? 5.563 -53.975 -48.931 1.00 54.85 ? 93 ALA D O 1 ATOM 5347 C CB . ALA D 4 92 ? 4.878 -51.009 -47.586 1.00 52.24 ? 93 ALA D CB 1 ATOM 5348 N N . SER D 4 93 ? 3.734 -53.915 -47.611 1.00 58.09 ? 94 SER D N 1 ATOM 5349 C CA . SER D 4 93 ? 3.007 -54.974 -48.314 1.00 60.42 ? 94 SER D CA 1 ATOM 5350 C C . SER D 4 93 ? 1.513 -54.676 -48.347 1.00 62.01 ? 94 SER D C 1 ATOM 5351 O O . SER D 4 93 ? 0.974 -54.086 -47.411 1.00 62.78 ? 94 SER D O 1 ATOM 5352 C CB . SER D 4 93 ? 3.252 -56.333 -47.657 1.00 63.81 ? 94 SER D CB 1 ATOM 5353 O OG . SER D 4 93 ? 2.589 -56.425 -46.408 1.00 66.82 ? 94 SER D OG 1 ATOM 5354 N N . GLY D 4 94 ? 0.851 -55.096 -49.424 1.00 63.05 ? 95 GLY D N 1 ATOM 5355 C CA . GLY D 4 94 ? -0.576 -54.840 -49.611 1.00 65.15 ? 95 GLY D CA 1 ATOM 5356 C C . GLY D 4 94 ? -1.270 -55.822 -50.537 1.00 67.90 ? 95 GLY D C 1 ATOM 5357 O O . GLY D 4 94 ? -0.636 -56.433 -51.403 1.00 67.57 ? 95 GLY D O 1 ATOM 5358 N N . ASP D 4 95 ? -2.580 -55.970 -50.353 1.00 71.15 ? 96 ASP D N 1 ATOM 5359 C CA . ASP D 4 95 ? -3.385 -56.871 -51.171 1.00 74.24 ? 96 ASP D CA 1 ATOM 5360 C C . ASP D 4 95 ? -4.079 -56.117 -52.303 1.00 73.28 ? 96 ASP D C 1 ATOM 5361 O O . ASP D 4 95 ? -3.610 -56.118 -53.442 1.00 71.61 ? 96 ASP D O 1 ATOM 5362 C CB . ASP D 4 95 ? -4.417 -57.604 -50.308 1.00 79.28 ? 96 ASP D CB 1 ATOM 5363 N N . GLU D 4 102 ? -4.738 -51.032 -49.325 1.00 69.89 ? 103 GLU D N 1 ATOM 5364 C CA . GLU D 4 102 ? -4.095 -50.654 -48.072 1.00 69.41 ? 103 GLU D CA 1 ATOM 5365 C C . GLU D 4 102 ? -2.719 -51.306 -47.941 1.00 66.86 ? 103 GLU D C 1 ATOM 5366 O O . GLU D 4 102 ? -2.582 -52.523 -48.088 1.00 68.03 ? 103 GLU D O 1 ATOM 5367 C CB . GLU D 4 102 ? -4.982 -51.030 -46.879 1.00 73.99 ? 103 GLU D CB 1 ATOM 5368 C CG . GLU D 4 102 ? -4.527 -50.443 -45.543 1.00 74.38 ? 103 GLU D CG 1 ATOM 5369 C CD . GLU D 4 102 ? -5.425 -50.834 -44.375 1.00 79.83 ? 103 GLU D CD 1 ATOM 5370 O OE1 . GLU D 4 102 ? -6.574 -51.273 -44.608 1.00 83.27 ? 103 GLU D OE1 1 ATOM 5371 O OE2 . GLU D 4 102 ? -4.976 -50.694 -43.217 1.00 80.74 ? 103 GLU D OE2 1 ATOM 5372 N N . GLN D 4 103 ? -1.708 -50.484 -47.669 1.00 63.87 ? 106 GLN D N 1 ATOM 5373 C CA . GLN D 4 103 ? -0.346 -50.968 -47.459 1.00 61.63 ? 106 GLN D CA 1 ATOM 5374 C C . GLN D 4 103 ? -0.009 -51.029 -45.970 1.00 62.90 ? 106 GLN D C 1 ATOM 5375 O O . GLN D 4 103 ? -0.440 -50.175 -45.188 1.00 64.00 ? 106 GLN D O 1 ATOM 5376 C CB . GLN D 4 103 ? 0.667 -50.092 -48.203 1.00 58.01 ? 106 GLN D CB 1 ATOM 5377 C CG . GLN D 4 103 ? 0.643 -50.253 -49.721 1.00 57.14 ? 106 GLN D CG 1 ATOM 5378 C CD . GLN D 4 103 ? 1.679 -49.393 -50.442 1.00 55.02 ? 106 GLN D CD 1 ATOM 5379 O OE1 . GLN D 4 103 ? 1.492 -49.027 -51.604 1.00 54.96 ? 106 GLN D OE1 1 ATOM 5380 N NE2 . GLN D 4 103 ? 2.773 -49.072 -49.759 1.00 53.39 ? 106 GLN D NE2 1 ATOM 5381 N N . PHE D 4 104 ? 0.753 -52.051 -45.590 1.00 63.08 ? 107 PHE D N 1 ATOM 5382 C CA . PHE D 4 104 ? 1.181 -52.233 -44.207 1.00 64.65 ? 107 PHE D CA 1 ATOM 5383 C C . PHE D 4 104 ? 2.695 -52.089 -44.110 1.00 61.73 ? 107 PHE D C 1 ATOM 5384 O O . PHE D 4 104 ? 3.444 -52.827 -44.752 1.00 60.69 ? 107 PHE D O 1 ATOM 5385 C CB . PHE D 4 104 ? 0.717 -53.588 -43.669 1.00 68.89 ? 107 PHE D CB 1 ATOM 5386 C CG . PHE D 4 104 ? -0.777 -53.718 -43.567 1.00 72.73 ? 107 PHE D CG 1 ATOM 5387 C CD1 . PHE D 4 104 ? -1.445 -53.322 -42.411 1.00 76.28 ? 107 PHE D CD1 1 ATOM 5388 C CD2 . PHE D 4 104 ? -1.519 -54.233 -44.630 1.00 73.31 ? 107 PHE D CD2 1 ATOM 5389 C CE1 . PHE D 4 104 ? -2.833 -53.437 -42.312 1.00 80.52 ? 107 PHE D CE1 1 ATOM 5390 C CE2 . PHE D 4 104 ? -2.905 -54.351 -44.543 1.00 77.27 ? 107 PHE D CE2 1 ATOM 5391 C CZ . PHE D 4 104 ? -3.565 -53.954 -43.380 1.00 80.86 ? 107 PHE D CZ 1 ATOM 5392 N N . PHE D 4 105 ? 3.131 -51.131 -43.297 1.00 60.83 ? 108 PHE D N 1 ATOM 5393 C CA . PHE D 4 105 ? 4.527 -50.714 -43.259 1.00 58.00 ? 108 PHE D CA 1 ATOM 5394 C C . PHE D 4 105 ? 5.327 -51.371 -42.140 1.00 59.88 ? 108 PHE D C 1 ATOM 5395 O O . PHE D 4 105 ? 4.809 -51.612 -41.045 1.00 63.27 ? 108 PHE D O 1 ATOM 5396 C CB . PHE D 4 105 ? 4.615 -49.191 -43.142 1.00 56.38 ? 108 PHE D CB 1 ATOM 5397 C CG . PHE D 4 105 ? 4.050 -48.459 -44.326 1.00 54.46 ? 108 PHE D CG 1 ATOM 5398 C CD1 . PHE D 4 105 ? 2.706 -48.103 -44.366 1.00 56.10 ? 108 PHE D CD1 1 ATOM 5399 C CD2 . PHE D 4 105 ? 4.862 -48.122 -45.401 1.00 51.48 ? 108 PHE D CD2 1 ATOM 5400 C CE1 . PHE D 4 105 ? 2.178 -47.426 -45.462 1.00 54.94 ? 108 PHE D CE1 1 ATOM 5401 C CE2 . PHE D 4 105 ? 4.343 -47.446 -46.502 1.00 50.61 ? 108 PHE D CE2 1 ATOM 5402 C CZ . PHE D 4 105 ? 2.997 -47.094 -46.530 1.00 51.97 ? 108 PHE D CZ 1 ATOM 5403 N N . GLY D 4 106 ? 6.594 -51.653 -42.433 1.00 58.10 ? 109 GLY D N 1 ATOM 5404 C CA . GLY D 4 106 ? 7.520 -52.227 -41.461 1.00 59.74 ? 109 GLY D CA 1 ATOM 5405 C C . GLY D 4 106 ? 8.090 -51.171 -40.533 1.00 59.42 ? 109 GLY D C 1 ATOM 5406 O O . GLY D 4 106 ? 7.806 -49.980 -40.698 1.00 57.72 ? 109 GLY D O 1 ATOM 5407 N N . PRO D 4 107 ? 8.914 -51.596 -39.556 1.00 61.40 ? 110 PRO D N 1 ATOM 5408 C CA . PRO D 4 107 ? 9.401 -50.697 -38.510 1.00 62.08 ? 110 PRO D CA 1 ATOM 5409 C C . PRO D 4 107 ? 10.568 -49.813 -38.957 1.00 59.08 ? 110 PRO D C 1 ATOM 5410 O O . PRO D 4 107 ? 10.922 -48.859 -38.260 1.00 59.44 ? 110 PRO D O 1 ATOM 5411 C CB . PRO D 4 107 ? 9.846 -51.656 -37.395 1.00 65.94 ? 110 PRO D CB 1 ATOM 5412 C CG . PRO D 4 107 ? 9.642 -53.062 -37.931 1.00 67.24 ? 110 PRO D CG 1 ATOM 5413 C CD . PRO D 4 107 ? 9.472 -52.948 -39.403 1.00 63.63 ? 110 PRO D CD 1 ATOM 5414 N N . GLY D 4 108 ? 11.160 -50.131 -40.105 1.00 56.76 ? 111 GLY D N 1 ATOM 5415 C CA . GLY D 4 108 ? 12.217 -49.308 -40.675 1.00 54.28 ? 111 GLY D CA 1 ATOM 5416 C C . GLY D 4 108 ? 13.623 -49.776 -40.370 1.00 55.16 ? 111 GLY D C 1 ATOM 5417 O O . GLY D 4 108 ? 13.867 -50.447 -39.362 1.00 58.04 ? 111 GLY D O 1 ATOM 5418 N N . THR D 4 109 ? 14.544 -49.408 -41.256 1.00 53.23 ? 112 THR D N 1 ATOM 5419 C CA . THR D 4 109 ? 15.962 -49.712 -41.114 1.00 54.02 ? 112 THR D CA 1 ATOM 5420 C C . THR D 4 109 ? 16.770 -48.424 -41.224 1.00 52.84 ? 112 THR D C 1 ATOM 5421 O O . THR D 4 109 ? 16.663 -47.699 -42.214 1.00 50.93 ? 112 THR D O 1 ATOM 5422 C CB . THR D 4 109 ? 16.425 -50.707 -42.197 1.00 54.02 ? 112 THR D CB 1 ATOM 5423 O OG1 . THR D 4 109 ? 15.795 -51.975 -41.980 1.00 55.81 ? 112 THR D OG1 1 ATOM 5424 C CG2 . THR D 4 109 ? 17.945 -50.885 -42.173 1.00 55.39 ? 112 THR D CG2 1 ATOM 5425 N N . ARG D 4 110 ? 17.570 -48.140 -40.200 1.00 54.45 ? 113 ARG D N 1 ATOM 5426 C CA . ARG D 4 110 ? 18.478 -47.000 -40.232 1.00 54.08 ? 113 ARG D CA 1 ATOM 5427 C C . ARG D 4 110 ? 19.811 -47.405 -40.848 1.00 54.40 ? 113 ARG D C 1 ATOM 5428 O O . ARG D 4 110 ? 20.525 -48.257 -40.313 1.00 56.49 ? 113 ARG D O 1 ATOM 5429 C CB . ARG D 4 110 ? 18.674 -46.410 -38.833 1.00 56.19 ? 113 ARG D CB 1 ATOM 5430 C CG . ARG D 4 110 ? 17.572 -45.446 -38.416 1.00 56.89 ? 113 ARG D CG 1 ATOM 5431 C CD . ARG D 4 110 ? 17.885 -44.772 -37.084 1.00 61.07 ? 113 ARG D CD 1 ATOM 5432 N NE . ARG D 4 110 ? 17.445 -43.377 -37.068 0.70 61.35 ? 113 ARG D NE 1 ATOM 5433 C CZ . ARG D 4 110 ? 18.192 -42.347 -37.463 0.70 61.54 ? 113 ARG D CZ 1 ATOM 5434 N NH1 . ARG D 4 110 ? 19.429 -42.541 -37.907 0.70 61.39 ? 113 ARG D NH1 1 ATOM 5435 N NH2 . ARG D 4 110 ? 17.700 -41.116 -37.412 0.70 62.27 ? 113 ARG D NH2 1 ATOM 5436 N N . LEU D 4 111 ? 20.130 -46.798 -41.987 1.00 52.78 ? 114 LEU D N 1 ATOM 5437 C CA . LEU D 4 111 ? 21.379 -47.072 -42.684 1.00 53.66 ? 114 LEU D CA 1 ATOM 5438 C C . LEU D 4 111 ? 22.269 -45.835 -42.749 1.00 54.14 ? 114 LEU D C 1 ATOM 5439 O O . LEU D 4 111 ? 21.815 -44.756 -43.138 1.00 52.97 ? 114 LEU D O 1 ATOM 5440 C CB . LEU D 4 111 ? 21.107 -47.602 -44.098 1.00 52.57 ? 114 LEU D CB 1 ATOM 5441 C CG . LEU D 4 111 ? 22.322 -47.826 -45.005 1.00 54.14 ? 114 LEU D CG 1 ATOM 5442 C CD1 . LEU D 4 111 ? 23.182 -48.991 -44.517 1.00 57.21 ? 114 LEU D CD1 1 ATOM 5443 C CD2 . LEU D 4 111 ? 21.890 -48.046 -46.437 1.00 53.43 ? 114 LEU D CD2 1 ATOM 5444 N N . THR D 4 112 ? 23.533 -46.007 -42.363 1.00 56.30 ? 115 THR D N 1 ATOM 5445 C CA . THR D 4 112 ? 24.548 -44.971 -42.521 1.00 57.50 ? 115 THR D CA 1 ATOM 5446 C C . THR D 4 112 ? 25.685 -45.486 -43.393 1.00 59.35 ? 115 THR D C 1 ATOM 5447 O O . THR D 4 112 ? 26.367 -46.449 -43.035 1.00 61.36 ? 115 THR D O 1 ATOM 5448 C CB . THR D 4 112 ? 25.106 -44.489 -41.162 1.00 59.38 ? 115 THR D CB 1 ATOM 5449 O OG1 . THR D 4 112 ? 24.041 -43.957 -40.370 1.00 58.54 ? 115 THR D OG1 1 ATOM 5450 C CG2 . THR D 4 112 ? 26.158 -43.401 -41.358 1.00 61.18 ? 115 THR D CG2 1 ATOM 5451 N N . VAL D 4 113 ? 25.868 -44.844 -44.543 1.00 59.21 ? 116 VAL D N 1 ATOM 5452 C CA . VAL D 4 113 ? 26.996 -45.131 -45.423 1.00 61.73 ? 116 VAL D CA 1 ATOM 5453 C C . VAL D 4 113 ? 28.045 -44.038 -45.248 1.00 64.20 ? 116 VAL D C 1 ATOM 5454 O O . VAL D 4 113 ? 27.753 -42.850 -45.425 1.00 63.72 ? 116 VAL D O 1 ATOM 5455 C CB . VAL D 4 113 ? 26.573 -45.223 -46.902 1.00 61.00 ? 116 VAL D CB 1 ATOM 5456 C CG1 . VAL D 4 113 ? 27.754 -45.632 -47.771 1.00 64.51 ? 116 VAL D CG1 1 ATOM 5457 C CG2 . VAL D 4 113 ? 25.426 -46.210 -47.070 1.00 58.77 ? 116 VAL D CG2 1 ATOM 5458 N N . LEU D 4 114 ? 29.259 -44.453 -44.894 1.00 67.24 ? 117 LEU D N 1 ATOM 5459 C CA . LEU D 4 114 ? 30.353 -43.526 -44.612 1.00 70.17 ? 117 LEU D CA 1 ATOM 5460 C C . LEU D 4 114 ? 31.451 -43.603 -45.665 1.00 73.78 ? 117 LEU D C 1 ATOM 5461 O O . LEU D 4 114 ? 31.537 -44.578 -46.416 1.00 74.51 ? 117 LEU D O 1 ATOM 5462 C CB . LEU D 4 114 ? 30.944 -43.810 -43.228 1.00 71.76 ? 117 LEU D CB 1 ATOM 5463 C CG . LEU D 4 114 ? 30.041 -43.567 -42.018 1.00 69.37 ? 117 LEU D CG 1 ATOM 5464 C CD1 . LEU D 4 114 ? 30.596 -44.274 -40.795 1.00 71.31 ? 117 LEU D CD1 1 ATOM 5465 C CD2 . LEU D 4 114 ? 29.866 -42.077 -41.753 1.00 69.34 ? 117 LEU D CD2 1 ATOM 5466 N N . GLU D 4 115 ? 32.284 -42.566 -45.714 1.00 76.57 ? 118 GLU D N 1 ATOM 5467 C CA . GLU D 4 115 ? 33.427 -42.534 -46.620 1.00 80.93 ? 118 GLU D CA 1 ATOM 5468 C C . GLU D 4 115 ? 34.587 -43.359 -46.064 1.00 84.45 ? 118 GLU D C 1 ATOM 5469 O O . GLU D 4 115 ? 35.308 -44.008 -46.820 1.00 87.76 ? 118 GLU D O 1 ATOM 5470 C CB . GLU D 4 115 ? 33.868 -41.093 -46.883 1.00 83.47 ? 118 GLU D CB 1 ATOM 5471 N N . ASP D 4 116 ? 34.757 -43.328 -44.742 1.00 84.21 ? 119 ASP D N 1 ATOM 5472 C CA . ASP D 4 116 ? 35.809 -44.092 -44.067 1.00 87.68 ? 119 ASP D CA 1 ATOM 5473 C C . ASP D 4 116 ? 35.381 -44.557 -42.675 1.00 85.76 ? 119 ASP D C 1 ATOM 5474 O O . ASP D 4 116 ? 34.752 -43.806 -41.924 1.00 83.38 ? 119 ASP D O 1 ATOM 5475 C CB . ASP D 4 116 ? 37.111 -43.282 -43.986 1.00 92.79 ? 119 ASP D CB 1 ATOM 5476 C CG . ASP D 4 116 ? 36.931 -41.949 -43.282 1.00 92.04 ? 119 ASP D CG 1 ATOM 5477 N N . LEU D 4 117 ? 35.738 -45.795 -42.341 1.00 73.76 ? 120 LEU D N 1 ATOM 5478 C CA . LEU D 4 117 ? 35.413 -46.384 -41.040 1.00 71.41 ? 120 LEU D CA 1 ATOM 5479 C C . LEU D 4 117 ? 36.391 -45.973 -39.935 1.00 71.19 ? 120 LEU D C 1 ATOM 5480 O O . LEU D 4 117 ? 36.181 -46.300 -38.766 1.00 69.55 ? 120 LEU D O 1 ATOM 5481 C CB . LEU D 4 117 ? 35.358 -47.914 -41.130 1.00 72.43 ? 120 LEU D CB 1 ATOM 5482 C CG . LEU D 4 117 ? 34.361 -48.619 -42.055 1.00 72.97 ? 120 LEU D CG 1 ATOM 5483 C CD1 . LEU D 4 117 ? 34.651 -50.108 -42.065 1.00 74.80 ? 120 LEU D CD1 1 ATOM 5484 C CD2 . LEU D 4 117 ? 32.917 -48.363 -41.650 1.00 70.58 ? 120 LEU D CD2 1 ATOM 5485 N N . LYS D 4 118 ? 37.450 -45.255 -40.307 1.00 73.24 ? 121 LYS D N 1 ATOM 5486 C CA . LYS D 4 118 ? 38.482 -44.827 -39.354 1.00 73.91 ? 121 LYS D CA 1 ATOM 5487 C C . LYS D 4 118 ? 38.008 -43.738 -38.383 1.00 71.55 ? 121 LYS D C 1 ATOM 5488 O O . LYS D 4 118 ? 38.752 -43.327 -37.489 1.00 72.14 ? 121 LYS D O 1 ATOM 5489 C CB . LYS D 4 118 ? 39.770 -44.406 -40.085 1.00 77.59 ? 121 LYS D CB 1 ATOM 5490 C CG . LYS D 4 118 ? 39.608 -43.287 -41.113 1.00 78.68 ? 121 LYS D CG 1 ATOM 5491 C CD . LYS D 4 118 ? 40.870 -43.120 -41.955 1.00 82.61 ? 121 LYS D CD 1 ATOM 5492 N N . ASN D 4 119 ? 36.766 -43.291 -38.558 1.00 69.27 ? 122 ASN D N 1 ATOM 5493 C CA . ASN D 4 119 ? 36.162 -42.281 -37.689 1.00 67.11 ? 122 ASN D CA 1 ATOM 5494 C C . ASN D 4 119 ? 35.088 -42.850 -36.752 1.00 63.97 ? 122 ASN D C 1 ATOM 5495 O O . ASN D 4 119 ? 34.446 -42.104 -36.006 1.00 62.13 ? 122 ASN D O 1 ATOM 5496 C CB . ASN D 4 119 ? 35.577 -41.140 -38.533 1.00 67.54 ? 122 ASN D CB 1 ATOM 5497 C CG . ASN D 4 119 ? 36.634 -40.393 -39.328 0.70 71.11 ? 122 ASN D CG 1 ATOM 5498 O OD1 . ASN D 4 119 ? 37.720 -40.097 -38.825 0.70 73.15 ? 122 ASN D OD1 1 ATOM 5499 N ND2 . ASN D 4 119 ? 36.314 -40.076 -40.577 0.70 72.81 ? 122 ASN D ND2 1 ATOM 5500 N N . VAL D 4 120 ? 34.905 -44.168 -36.790 1.00 63.63 ? 123 VAL D N 1 ATOM 5501 C CA . VAL D 4 120 ? 33.858 -44.837 -36.015 1.00 61.23 ? 123 VAL D CA 1 ATOM 5502 C C . VAL D 4 120 ? 34.310 -45.102 -34.574 1.00 60.59 ? 123 VAL D C 1 ATOM 5503 O O . VAL D 4 120 ? 35.292 -45.805 -34.339 1.00 62.34 ? 123 VAL D O 1 ATOM 5504 C CB . VAL D 4 120 ? 33.380 -46.149 -36.712 1.00 61.96 ? 123 VAL D CB 1 ATOM 5505 C CG1 . VAL D 4 120 ? 32.376 -46.906 -35.851 1.00 60.02 ? 123 VAL D CG1 1 ATOM 5506 C CG2 . VAL D 4 120 ? 32.776 -45.840 -38.073 1.00 62.41 ? 123 VAL D CG2 1 ATOM 5507 N N . PHE D 4 121 ? 33.586 -44.520 -33.621 1.00 58.48 ? 124 PHE D N 1 ATOM 5508 C CA . PHE D 4 121 ? 33.881 -44.676 -32.195 1.00 57.97 ? 124 PHE D CA 1 ATOM 5509 C C . PHE D 4 121 ? 32.660 -45.164 -31.412 1.00 55.77 ? 124 PHE D C 1 ATOM 5510 O O . PHE D 4 121 ? 31.542 -44.708 -31.659 1.00 54.07 ? 124 PHE D O 1 ATOM 5511 C CB . PHE D 4 121 ? 34.359 -43.350 -31.593 1.00 57.92 ? 124 PHE D CB 1 ATOM 5512 C CG . PHE D 4 121 ? 35.750 -42.956 -31.996 1.00 60.96 ? 124 PHE D CG 1 ATOM 5513 C CD1 . PHE D 4 121 ? 36.846 -43.357 -31.238 1.00 63.20 ? 124 PHE D CD1 1 ATOM 5514 C CD2 . PHE D 4 121 ? 35.966 -42.168 -33.123 1.00 62.51 ? 124 PHE D CD2 1 ATOM 5515 C CE1 . PHE D 4 121 ? 38.140 -42.987 -31.602 1.00 66.71 ? 124 PHE D CE1 1 ATOM 5516 C CE2 . PHE D 4 121 ? 37.256 -41.794 -33.499 1.00 65.92 ? 124 PHE D CE2 1 ATOM 5517 C CZ . PHE D 4 121 ? 38.346 -42.207 -32.738 1.00 67.98 ? 124 PHE D CZ 1 ATOM 5518 N N . PRO D 4 122 ? 32.871 -46.097 -30.465 1.00 56.20 ? 125 PRO D N 1 ATOM 5519 C CA . PRO D 4 122 ? 31.818 -46.443 -29.513 1.00 54.49 ? 125 PRO D CA 1 ATOM 5520 C C . PRO D 4 122 ? 31.694 -45.355 -28.438 1.00 53.12 ? 125 PRO D C 1 ATOM 5521 O O . PRO D 4 122 ? 32.649 -44.603 -28.218 1.00 54.01 ? 125 PRO D O 1 ATOM 5522 C CB . PRO D 4 122 ? 32.316 -47.757 -28.904 1.00 56.16 ? 125 PRO D CB 1 ATOM 5523 C CG . PRO D 4 122 ? 33.790 -47.707 -29.042 1.00 58.50 ? 125 PRO D CG 1 ATOM 5524 C CD . PRO D 4 122 ? 34.068 -46.944 -30.301 1.00 58.79 ? 125 PRO D CD 1 ATOM 5525 N N . PRO D 4 123 ? 30.528 -45.266 -27.772 1.00 51.30 ? 126 PRO D N 1 ATOM 5526 C CA . PRO D 4 123 ? 30.349 -44.232 -26.757 1.00 50.14 ? 126 PRO D CA 1 ATOM 5527 C C . PRO D 4 123 ? 30.975 -44.584 -25.408 1.00 50.98 ? 126 PRO D C 1 ATOM 5528 O O . PRO D 4 123 ? 31.078 -45.762 -25.058 1.00 52.01 ? 126 PRO D O 1 ATOM 5529 C CB . PRO D 4 123 ? 28.828 -44.145 -26.618 1.00 48.18 ? 126 PRO D CB 1 ATOM 5530 C CG . PRO D 4 123 ? 28.347 -45.510 -26.948 1.00 48.74 ? 126 PRO D CG 1 ATOM 5531 C CD . PRO D 4 123 ? 29.307 -46.076 -27.956 1.00 50.64 ? 126 PRO D CD 1 ATOM 5532 N N . GLU D 4 124 ? 31.404 -43.559 -24.674 1.00 51.05 ? 127 GLU D N 1 ATOM 5533 C CA . GLU D 4 124 ? 31.745 -43.708 -23.263 1.00 51.84 ? 127 GLU D CA 1 ATOM 5534 C C . GLU D 4 124 ? 30.494 -43.347 -22.468 1.00 49.46 ? 127 GLU D C 1 ATOM 5535 O O . GLU D 4 124 ? 29.817 -42.364 -22.778 1.00 48.11 ? 127 GLU D O 1 ATOM 5536 C CB . GLU D 4 124 ? 32.934 -42.821 -22.870 1.00 53.76 ? 127 GLU D CB 1 ATOM 5537 C CG . GLU D 4 124 ? 34.220 -43.118 -23.641 1.00 57.61 ? 127 GLU D CG 1 ATOM 5538 C CD . GLU D 4 124 ? 35.478 -42.614 -22.942 1.00 62.18 ? 127 GLU D CD 1 ATOM 5539 O OE1 . GLU D 4 124 ? 36.077 -41.631 -23.431 1.00 64.29 ? 127 GLU D OE1 1 ATOM 5540 O OE2 . GLU D 4 124 ? 35.876 -43.202 -21.909 1.00 63.94 ? 127 GLU D OE2 1 ATOM 5541 N N . VAL D 4 125 ? 30.173 -44.157 -21.464 1.00 49.40 ? 128 VAL D N 1 ATOM 5542 C CA . VAL D 4 125 ? 28.930 -43.989 -20.711 1.00 47.47 ? 128 VAL D CA 1 ATOM 5543 C C . VAL D 4 125 ? 29.207 -43.670 -19.240 1.00 47.89 ? 128 VAL D C 1 ATOM 5544 O O . VAL D 4 125 ? 30.051 -44.304 -18.604 1.00 49.91 ? 128 VAL D O 1 ATOM 5545 C CB . VAL D 4 125 ? 28.008 -45.233 -20.845 1.00 47.25 ? 128 VAL D CB 1 ATOM 5546 C CG1 . VAL D 4 125 ? 26.689 -45.015 -20.128 1.00 45.83 ? 128 VAL D CG1 1 ATOM 5547 C CG2 . VAL D 4 125 ? 27.746 -45.547 -22.308 1.00 47.13 ? 128 VAL D CG2 1 ATOM 5548 N N . ALA D 4 126 ? 28.499 -42.671 -18.719 1.00 46.35 ? 129 ALA D N 1 ATOM 5549 C CA . ALA D 4 126 ? 28.639 -42.248 -17.330 1.00 46.74 ? 129 ALA D CA 1 ATOM 5550 C C . ALA D 4 126 ? 27.278 -41.974 -16.703 1.00 44.99 ? 129 ALA D C 1 ATOM 5551 O O . ALA D 4 126 ? 26.393 -41.394 -17.344 1.00 43.66 ? 129 ALA D O 1 ATOM 5552 C CB . ALA D 4 126 ? 29.522 -41.018 -17.237 1.00 47.65 ? 129 ALA D CB 1 ATOM 5553 N N . VAL D 4 127 ? 27.114 -42.399 -15.454 1.00 45.51 ? 130 VAL D N 1 ATOM 5554 C CA . VAL D 4 127 ? 25.893 -42.121 -14.700 1.00 44.27 ? 130 VAL D CA 1 ATOM 5555 C C . VAL D 4 127 ? 26.177 -41.068 -13.633 1.00 44.67 ? 130 VAL D C 1 ATOM 5556 O O . VAL D 4 127 ? 27.185 -41.141 -12.928 1.00 46.59 ? 130 VAL D O 1 ATOM 5557 C CB . VAL D 4 127 ? 25.283 -43.412 -14.088 1.00 44.78 ? 130 VAL D CB 1 ATOM 5558 C CG1 . VAL D 4 127 ? 24.247 -43.093 -13.021 1.00 44.10 ? 130 VAL D CG1 1 ATOM 5559 C CG2 . VAL D 4 127 ? 24.648 -44.255 -15.174 1.00 44.48 ? 130 VAL D CG2 1 ATOM 5560 N N . PHE D 4 128 ? 25.286 -40.087 -13.530 1.00 43.31 ? 131 PHE D N 1 ATOM 5561 C CA . PHE D 4 128 ? 25.440 -39.007 -12.566 1.00 43.95 ? 131 PHE D CA 1 ATOM 5562 C C . PHE D 4 128 ? 24.374 -39.081 -11.482 1.00 43.64 ? 131 PHE D C 1 ATOM 5563 O O . PHE D 4 128 ? 23.176 -39.055 -11.769 1.00 42.34 ? 131 PHE D O 1 ATOM 5564 C CB . PHE D 4 128 ? 25.442 -37.654 -13.281 1.00 43.46 ? 131 PHE D CB 1 ATOM 5565 C CG . PHE D 4 128 ? 26.616 -37.470 -14.203 1.00 43.99 ? 131 PHE D CG 1 ATOM 5566 C CD1 . PHE D 4 128 ? 26.622 -38.046 -15.471 1.00 42.39 ? 131 PHE D CD1 1 ATOM 5567 C CD2 . PHE D 4 128 ? 27.728 -36.742 -13.796 1.00 45.43 ? 131 PHE D CD2 1 ATOM 5568 C CE1 . PHE D 4 128 ? 27.710 -37.889 -16.321 1.00 43.36 ? 131 PHE D CE1 1 ATOM 5569 C CE2 . PHE D 4 128 ? 28.823 -36.581 -14.642 1.00 46.34 ? 131 PHE D CE2 1 ATOM 5570 C CZ . PHE D 4 128 ? 28.813 -37.152 -15.904 1.00 45.45 ? 131 PHE D CZ 1 ATOM 5571 N N . GLU D 4 129 ? 24.832 -39.188 -10.238 1.00 45.42 ? 132 GLU D N 1 ATOM 5572 C CA . GLU D 4 129 ? 23.959 -39.412 -9.083 1.00 45.73 ? 132 GLU D CA 1 ATOM 5573 C C . GLU D 4 129 ? 23.221 -38.136 -8.670 1.00 45.00 ? 132 GLU D C 1 ATOM 5574 O O . GLU D 4 129 ? 23.737 -37.037 -8.874 1.00 45.65 ? 132 GLU D O 1 ATOM 5575 C CB . GLU D 4 129 ? 24.769 -39.977 -7.906 1.00 48.19 ? 132 GLU D CB 1 ATOM 5576 C CG . GLU D 4 129 ? 25.468 -41.304 -8.207 1.00 50.52 ? 132 GLU D CG 1 ATOM 5577 C CD . GLU D 4 129 ? 26.203 -41.879 -7.007 1.00 54.99 ? 132 GLU D CD 1 ATOM 5578 O OE1 . GLU D 4 129 ? 27.430 -42.098 -7.104 1.00 57.84 ? 132 GLU D OE1 1 ATOM 5579 O OE2 . GLU D 4 129 ? 25.557 -42.117 -5.965 1.00 56.31 ? 132 GLU D OE2 1 ATOM 5580 N N . PRO D 4 130 ? 22.010 -38.279 -8.093 1.00 44.26 ? 133 PRO D N 1 ATOM 5581 C CA . PRO D 4 130 ? 21.187 -37.143 -7.667 1.00 43.91 ? 133 PRO D CA 1 ATOM 5582 C C . PRO D 4 130 ? 21.862 -36.238 -6.636 1.00 45.59 ? 133 PRO D C 1 ATOM 5583 O O . PRO D 4 130 ? 22.652 -36.708 -5.811 1.00 47.19 ? 133 PRO D O 1 ATOM 5584 C CB . PRO D 4 130 ? 19.966 -37.817 -7.035 1.00 43.42 ? 133 PRO D CB 1 ATOM 5585 C CG . PRO D 4 130 ? 19.883 -39.130 -7.701 1.00 43.27 ? 133 PRO D CG 1 ATOM 5586 C CD . PRO D 4 130 ? 21.303 -39.557 -7.895 1.00 44.15 ? 133 PRO D CD 1 ATOM 5587 N N . SER D 4 131 ? 21.547 -34.947 -6.693 1.00 45.68 ? 134 SER D N 1 ATOM 5588 C CA . SER D 4 131 ? 22.049 -33.997 -5.711 1.00 47.82 ? 134 SER D CA 1 ATOM 5589 C C . SER D 4 131 ? 21.243 -34.089 -4.420 1.00 48.28 ? 134 SER D C 1 ATOM 5590 O O . SER D 4 131 ? 20.055 -34.433 -4.438 1.00 47.14 ? 134 SER D O 1 ATOM 5591 C CB . SER D 4 131 ? 22.006 -32.571 -6.261 1.00 48.39 ? 134 SER D CB 1 ATOM 5592 O OG . SER D 4 131 ? 20.677 -32.170 -6.534 1.00 47.66 ? 134 SER D OG 1 ATOM 5593 N N . GLU D 4 132 ? 21.900 -33.788 -3.303 1.00 50.33 ? 135 GLU D N 1 ATOM 5594 C CA . GLU D 4 132 ? 21.236 -33.745 -2.006 1.00 51.00 ? 135 GLU D CA 1 ATOM 5595 C C . GLU D 4 132 ? 20.232 -32.589 -1.967 1.00 50.63 ? 135 GLU D C 1 ATOM 5596 O O . GLU D 4 132 ? 19.182 -32.690 -1.328 1.00 50.44 ? 135 GLU D O 1 ATOM 5597 C CB . GLU D 4 132 ? 22.264 -33.620 -0.875 1.00 53.77 ? 135 GLU D CB 1 ATOM 5598 N N . ALA D 4 133 ? 20.560 -31.506 -2.669 1.00 50.87 ? 136 ALA D N 1 ATOM 5599 C CA . ALA D 4 133 ? 19.690 -30.335 -2.757 1.00 51.03 ? 136 ALA D CA 1 ATOM 5600 C C . ALA D 4 133 ? 18.338 -30.651 -3.408 1.00 48.92 ? 136 ALA D C 1 ATOM 5601 O O . ALA D 4 133 ? 17.310 -30.140 -2.963 1.00 49.42 ? 136 ALA D O 1 ATOM 5602 C CB . ALA D 4 133 ? 20.390 -29.199 -3.486 1.00 52.24 ? 136 ALA D CB 1 ATOM 5603 N N . GLU D 4 134 ? 18.339 -31.492 -4.443 1.00 46.85 ? 137 GLU D N 1 ATOM 5604 C CA . GLU D 4 134 ? 17.092 -31.904 -5.087 1.00 45.38 ? 137 GLU D CA 1 ATOM 5605 C C . GLU D 4 134 ? 16.287 -32.821 -4.176 1.00 44.99 ? 137 GLU D C 1 ATOM 5606 O O . GLU D 4 134 ? 15.077 -32.649 -4.025 1.00 45.20 ? 137 GLU D O 1 ATOM 5607 C CB . GLU D 4 134 ? 17.347 -32.595 -6.431 1.00 44.02 ? 137 GLU D CB 1 ATOM 5608 C CG . GLU D 4 134 ? 16.070 -32.826 -7.242 1.00 43.51 ? 137 GLU D CG 1 ATOM 5609 C CD . GLU D 4 134 ? 16.211 -33.870 -8.339 1.00 42.84 ? 137 GLU D CD 1 ATOM 5610 O OE1 . GLU D 4 134 ? 17.215 -34.615 -8.350 1.00 42.87 ? 137 GLU D OE1 1 ATOM 5611 O OE2 . GLU D 4 134 ? 15.299 -33.953 -9.189 1.00 42.43 ? 137 GLU D OE2 1 ATOM 5612 N N . ILE D 4 135 ? 16.971 -33.791 -3.574 1.00 44.88 ? 138 ILE D N 1 ATOM 5613 C CA . ILE D 4 135 ? 16.344 -34.739 -2.659 1.00 44.90 ? 138 ILE D CA 1 ATOM 5614 C C . ILE D 4 135 ? 15.632 -34.019 -1.504 1.00 46.23 ? 138 ILE D C 1 ATOM 5615 O O . ILE D 4 135 ? 14.473 -34.313 -1.210 1.00 46.30 ? 138 ILE D O 1 ATOM 5616 C CB . ILE D 4 135 ? 17.363 -35.789 -2.145 1.00 45.43 ? 138 ILE D CB 1 ATOM 5617 C CG1 . ILE D 4 135 ? 17.802 -36.695 -3.305 1.00 44.19 ? 138 ILE D CG1 1 ATOM 5618 C CG2 . ILE D 4 135 ? 16.771 -36.615 -0.995 1.00 46.09 ? 138 ILE D CG2 1 ATOM 5619 C CD1 . ILE D 4 135 ? 19.069 -37.507 -3.051 1.00 44.67 ? 138 ILE D CD1 1 ATOM 5620 N N . SER D 4 136 ? 16.317 -33.064 -0.879 1.00 47.43 ? 139 SER D N 1 ATOM 5621 C CA . SER D 4 136 ? 15.736 -32.297 0.220 1.00 49.02 ? 139 SER D CA 1 ATOM 5622 C C . SER D 4 136 ? 14.556 -31.446 -0.233 1.00 48.93 ? 139 SER D C 1 ATOM 5623 O O . SER D 4 136 ? 13.538 -31.373 0.458 1.00 49.91 ? 139 SER D O 1 ATOM 5624 C CB . SER D 4 136 ? 16.785 -31.393 0.870 1.00 50.91 ? 139 SER D CB 1 ATOM 5625 O OG . SER D 4 136 ? 17.881 -32.146 1.342 1.00 52.02 ? 139 SER D OG 1 ATOM 5626 N N . HIS D 4 137 ? 14.695 -30.815 -1.396 1.00 48.19 ? 140 HIS D N 1 ATOM 5627 C CA . HIS D 4 137 ? 13.749 -29.795 -1.841 1.00 48.83 ? 140 HIS D CA 1 ATOM 5628 C C . HIS D 4 137 ? 12.490 -30.361 -2.494 1.00 48.07 ? 140 HIS D C 1 ATOM 5629 O O . HIS D 4 137 ? 11.403 -29.807 -2.328 1.00 49.34 ? 140 HIS D O 1 ATOM 5630 C CB . HIS D 4 137 ? 14.453 -28.805 -2.774 1.00 49.23 ? 140 HIS D CB 1 ATOM 5631 C CG . HIS D 4 137 ? 13.568 -27.714 -3.288 1.00 50.35 ? 140 HIS D CG 1 ATOM 5632 N ND1 . HIS D 4 137 ? 12.891 -26.849 -2.457 1.00 52.29 ? 140 HIS D ND1 1 ATOM 5633 C CD2 . HIS D 4 137 ? 13.268 -27.335 -4.552 1.00 50.40 ? 140 HIS D CD2 1 ATOM 5634 C CE1 . HIS D 4 137 ? 12.199 -25.993 -3.187 1.00 53.78 ? 140 HIS D CE1 1 ATOM 5635 N NE2 . HIS D 4 137 ? 12.413 -26.265 -4.462 1.00 52.74 ? 140 HIS D NE2 1 ATOM 5636 N N . THR D 4 138 ? 12.637 -31.463 -3.223 1.00 46.48 ? 141 THR D N 1 ATOM 5637 C CA . THR D 4 138 ? 11.542 -32.007 -4.026 1.00 46.22 ? 141 THR D CA 1 ATOM 5638 C C . THR D 4 138 ? 11.087 -33.389 -3.566 1.00 46.01 ? 141 THR D C 1 ATOM 5639 O O . THR D 4 138 ? 10.040 -33.876 -3.999 1.00 46.33 ? 141 THR D O 1 ATOM 5640 C CB . THR D 4 138 ? 11.923 -32.098 -5.527 1.00 45.21 ? 141 THR D CB 1 ATOM 5641 O OG1 . THR D 4 138 ? 12.865 -33.163 -5.725 1.00 43.39 ? 141 THR D OG1 1 ATOM 5642 C CG2 . THR D 4 138 ? 12.508 -30.775 -6.031 1.00 45.64 ? 141 THR D CG2 1 ATOM 5643 N N . GLN D 4 139 ? 11.883 -34.013 -2.699 1.00 46.02 ? 142 GLN D N 1 ATOM 5644 C CA . GLN D 4 139 ? 11.673 -35.405 -2.282 1.00 46.33 ? 142 GLN D CA 1 ATOM 5645 C C . GLN D 4 139 ? 11.642 -36.355 -3.489 1.00 45.74 ? 142 GLN D C 1 ATOM 5646 O O . GLN D 4 139 ? 11.031 -37.428 -3.451 1.00 46.49 ? 142 GLN D O 1 ATOM 5647 C CB . GLN D 4 139 ? 10.430 -35.545 -1.388 1.00 47.67 ? 142 GLN D CB 1 ATOM 5648 C CG . GLN D 4 139 ? 10.515 -34.761 -0.071 1.00 48.73 ? 142 GLN D CG 1 ATOM 5649 C CD . GLN D 4 139 ? 11.666 -35.209 0.832 0.70 48.84 ? 142 GLN D CD 1 ATOM 5650 O OE1 . GLN D 4 139 ? 11.934 -36.404 0.981 0.70 48.57 ? 142 GLN D OE1 1 ATOM 5651 N NE2 . GLN D 4 139 ? 12.345 -34.243 1.442 0.70 49.35 ? 142 GLN D NE2 1 ATOM 5652 N N . LYS D 4 140 ? 12.316 -35.934 -4.556 1.00 44.98 ? 143 LYS D N 1 ATOM 5653 C CA . LYS D 4 140 ? 12.509 -36.743 -5.751 1.00 44.41 ? 143 LYS D CA 1 ATOM 5654 C C . LYS D 4 140 ? 13.998 -36.772 -6.082 1.00 43.65 ? 143 LYS D C 1 ATOM 5655 O O . LYS D 4 140 ? 14.758 -35.916 -5.625 1.00 43.89 ? 143 LYS D O 1 ATOM 5656 C CB . LYS D 4 140 ? 11.699 -36.180 -6.925 1.00 44.54 ? 143 LYS D CB 1 ATOM 5657 C CG . LYS D 4 140 ? 10.183 -36.331 -6.771 1.00 46.10 ? 143 LYS D CG 1 ATOM 5658 C CD . LYS D 4 140 ? 9.425 -35.721 -7.942 1.00 46.98 ? 143 LYS D CD 1 ATOM 5659 C CE . LYS D 4 140 ? 9.316 -34.205 -7.829 1.00 48.19 ? 143 LYS D CE 1 ATOM 5660 N NZ . LYS D 4 140 ? 8.242 -33.773 -6.891 1.00 49.87 ? 143 LYS D NZ 1 ATOM 5661 N N . ALA D 4 141 ? 14.409 -37.762 -6.868 1.00 43.33 ? 144 ALA D N 1 ATOM 5662 C CA . ALA D 4 141 ? 15.817 -37.953 -7.205 1.00 43.03 ? 144 ALA D CA 1 ATOM 5663 C C . ALA D 4 141 ? 15.996 -38.254 -8.692 1.00 42.43 ? 144 ALA D C 1 ATOM 5664 O O . ALA D 4 141 ? 15.464 -39.245 -9.204 1.00 42.55 ? 144 ALA D O 1 ATOM 5665 C CB . ALA D 4 141 ? 16.413 -39.067 -6.353 1.00 43.70 ? 144 ALA D CB 1 ATOM 5666 N N . THR D 4 142 ? 16.744 -37.391 -9.376 1.00 42.13 ? 145 THR D N 1 ATOM 5667 C CA . THR D 4 142 ? 16.984 -37.537 -10.810 1.00 41.85 ? 145 THR D CA 1 ATOM 5668 C C . THR D 4 142 ? 18.387 -38.061 -11.097 1.00 41.77 ? 145 THR D C 1 ATOM 5669 O O . THR D 4 142 ? 19.379 -37.477 -10.657 1.00 42.29 ? 145 THR D O 1 ATOM 5670 C CB . THR D 4 142 ? 16.795 -36.197 -11.557 1.00 42.06 ? 145 THR D CB 1 ATOM 5671 O OG1 . THR D 4 142 ? 15.560 -35.589 -11.160 1.00 43.01 ? 145 THR D OG1 1 ATOM 5672 C CG2 . THR D 4 142 ? 16.798 -36.412 -13.073 1.00 41.88 ? 145 THR D CG2 1 ATOM 5673 N N . LEU D 4 143 ? 18.456 -39.168 -11.832 1.00 41.66 ? 146 LEU D N 1 ATOM 5674 C CA . LEU D 4 143 ? 19.718 -39.683 -12.347 1.00 41.83 ? 146 LEU D CA 1 ATOM 5675 C C . LEU D 4 143 ? 19.880 -39.227 -13.789 1.00 41.49 ? 146 LEU D C 1 ATOM 5676 O O . LEU D 4 143 ? 18.919 -39.236 -14.559 1.00 41.48 ? 146 LEU D O 1 ATOM 5677 C CB . LEU D 4 143 ? 19.758 -41.211 -12.284 1.00 42.36 ? 146 LEU D CB 1 ATOM 5678 C CG . LEU D 4 143 ? 19.850 -41.883 -10.912 1.00 43.49 ? 146 LEU D CG 1 ATOM 5679 C CD1 . LEU D 4 143 ? 18.467 -42.181 -10.350 1.00 43.56 ? 146 LEU D CD1 1 ATOM 5680 C CD2 . LEU D 4 143 ? 20.657 -43.163 -11.018 1.00 44.41 ? 146 LEU D CD2 1 ATOM 5681 N N . VAL D 4 144 ? 21.091 -38.817 -14.147 1.00 41.78 ? 147 VAL D N 1 ATOM 5682 C CA . VAL D 4 144 ? 21.387 -38.389 -15.508 1.00 41.70 ? 147 VAL D CA 1 ATOM 5683 C C . VAL D 4 144 ? 22.409 -39.337 -16.115 1.00 42.32 ? 147 VAL D C 1 ATOM 5684 O O . VAL D 4 144 ? 23.456 -39.589 -15.522 1.00 43.24 ? 147 VAL D O 1 ATOM 5685 C CB . VAL D 4 144 ? 21.918 -36.935 -15.549 1.00 42.19 ? 147 VAL D CB 1 ATOM 5686 C CG1 . VAL D 4 144 ? 22.449 -36.578 -16.936 1.00 42.22 ? 147 VAL D CG1 1 ATOM 5687 C CG2 . VAL D 4 144 ? 20.832 -35.959 -15.122 1.00 41.98 ? 147 VAL D CG2 1 ATOM 5688 N N . CYS D 4 145 ? 22.092 -39.877 -17.287 1.00 42.45 ? 148 CYS D N 1 ATOM 5689 C CA . CYS D 4 145 ? 23.043 -40.701 -18.019 1.00 43.44 ? 148 CYS D CA 1 ATOM 5690 C C . CYS D 4 145 ? 23.604 -39.945 -19.207 1.00 43.71 ? 148 CYS D C 1 ATOM 5691 O O . CYS D 4 145 ? 22.855 -39.349 -19.987 1.00 43.41 ? 148 CYS D O 1 ATOM 5692 C CB . CYS D 4 145 ? 22.403 -41.999 -18.499 1.00 43.70 ? 148 CYS D CB 1 ATOM 5693 S SG . CYS D 4 145 ? 23.589 -43.119 -19.264 1.00 45.79 ? 148 CYS D SG 1 ATOM 5694 N N . LEU D 4 146 ? 24.924 -39.992 -19.346 1.00 44.65 ? 149 LEU D N 1 ATOM 5695 C CA . LEU D 4 146 ? 25.603 -39.301 -20.430 1.00 45.42 ? 149 LEU D CA 1 ATOM 5696 C C . LEU D 4 146 ? 26.345 -40.288 -21.330 1.00 46.20 ? 149 LEU D C 1 ATOM 5697 O O . LEU D 4 146 ? 27.222 -41.026 -20.867 1.00 47.25 ? 149 LEU D O 1 ATOM 5698 C CB . LEU D 4 146 ? 26.558 -38.251 -19.859 1.00 46.57 ? 149 LEU D CB 1 ATOM 5699 C CG . LEU D 4 146 ? 26.817 -36.972 -20.656 1.00 47.85 ? 149 LEU D CG 1 ATOM 5700 C CD1 . LEU D 4 146 ? 25.519 -36.239 -20.940 1.00 47.63 ? 149 LEU D CD1 1 ATOM 5701 C CD2 . LEU D 4 146 ? 27.777 -36.061 -19.905 1.00 49.40 ? 149 LEU D CD2 1 ATOM 5702 N N . ALA D 4 147 ? 25.965 -40.313 -22.608 1.00 45.99 ? 150 ALA D N 1 ATOM 5703 C CA . ALA D 4 147 ? 26.662 -41.106 -23.621 1.00 46.85 ? 150 ALA D CA 1 ATOM 5704 C C . ALA D 4 147 ? 27.446 -40.167 -24.536 1.00 47.89 ? 150 ALA D C 1 ATOM 5705 O O . ALA D 4 147 ? 26.861 -39.314 -25.209 1.00 47.89 ? 150 ALA D O 1 ATOM 5706 C CB . ALA D 4 147 ? 25.677 -41.945 -24.420 1.00 46.55 ? 150 ALA D CB 1 ATOM 5707 N N . THR D 4 148 ? 28.768 -40.329 -24.556 1.00 49.14 ? 151 THR D N 1 ATOM 5708 C CA . THR D 4 148 ? 29.663 -39.348 -25.177 1.00 50.45 ? 151 THR D CA 1 ATOM 5709 C C . THR D 4 148 ? 30.656 -39.928 -26.185 1.00 52.06 ? 151 THR D C 1 ATOM 5710 O O . THR D 4 148 ? 31.133 -41.053 -26.029 1.00 52.60 ? 151 THR D O 1 ATOM 5711 C CB . THR D 4 148 ? 30.468 -38.585 -24.104 1.00 51.51 ? 151 THR D CB 1 ATOM 5712 O OG1 . THR D 4 148 ? 30.935 -39.509 -23.113 1.00 51.56 ? 151 THR D OG1 1 ATOM 5713 C CG2 . THR D 4 148 ? 29.605 -37.525 -23.432 1.00 50.46 ? 151 THR D CG2 1 ATOM 5714 N N . GLY D 4 149 ? 30.959 -39.138 -27.214 1.00 53.15 ? 152 GLY D N 1 ATOM 5715 C CA . GLY D 4 149 ? 32.031 -39.439 -28.166 1.00 54.97 ? 152 GLY D CA 1 ATOM 5716 C C . GLY D 4 149 ? 31.802 -40.643 -29.058 1.00 54.71 ? 152 GLY D C 1 ATOM 5717 O O . GLY D 4 149 ? 32.691 -41.484 -29.214 1.00 56.28 ? 152 GLY D O 1 ATOM 5718 N N . PHE D 4 150 ? 30.616 -40.727 -29.651 1.00 53.21 ? 153 PHE D N 1 ATOM 5719 C CA . PHE D 4 150 ? 30.294 -41.826 -30.554 1.00 53.19 ? 153 PHE D CA 1 ATOM 5720 C C . PHE D 4 150 ? 30.039 -41.359 -31.981 1.00 54.11 ? 153 PHE D C 1 ATOM 5721 O O . PHE D 4 150 ? 29.578 -40.240 -32.212 1.00 53.88 ? 153 PHE D O 1 ATOM 5722 C CB . PHE D 4 150 ? 29.114 -42.656 -30.028 1.00 51.60 ? 153 PHE D CB 1 ATOM 5723 C CG . PHE D 4 150 ? 27.839 -41.872 -29.835 1.00 50.23 ? 153 PHE D CG 1 ATOM 5724 C CD1 . PHE D 4 150 ? 27.587 -41.207 -28.637 1.00 48.94 ? 153 PHE D CD1 1 ATOM 5725 C CD2 . PHE D 4 150 ? 26.873 -41.827 -30.839 1.00 50.71 ? 153 PHE D CD2 1 ATOM 5726 C CE1 . PHE D 4 150 ? 26.406 -40.494 -28.449 1.00 47.61 ? 153 PHE D CE1 1 ATOM 5727 C CE2 . PHE D 4 150 ? 25.688 -41.119 -30.660 1.00 49.67 ? 153 PHE D CE2 1 ATOM 5728 C CZ . PHE D 4 150 ? 25.455 -40.452 -29.461 1.00 48.33 ? 153 PHE D CZ 1 ATOM 5729 N N . TYR D 4 151 ? 30.353 -42.235 -32.931 1.00 55.35 ? 154 TYR D N 1 ATOM 5730 C CA . TYR D 4 151 ? 30.150 -41.967 -34.348 1.00 56.76 ? 154 TYR D CA 1 ATOM 5731 C C . TYR D 4 151 ? 29.937 -43.284 -35.084 1.00 57.57 ? 154 TYR D C 1 ATOM 5732 O O . TYR D 4 151 ? 30.727 -44.212 -34.913 1.00 58.34 ? 154 TYR D O 1 ATOM 5733 C CB . TYR D 4 151 ? 31.355 -41.225 -34.930 1.00 58.77 ? 154 TYR D CB 1 ATOM 5734 C CG . TYR D 4 151 ? 31.117 -40.639 -36.302 1.00 60.54 ? 154 TYR D CG 1 ATOM 5735 C CD1 . TYR D 4 151 ? 30.459 -39.420 -36.454 1.00 60.37 ? 154 TYR D CD1 1 ATOM 5736 C CD2 . TYR D 4 151 ? 31.557 -41.300 -37.450 1.00 62.52 ? 154 TYR D CD2 1 ATOM 5737 C CE1 . TYR D 4 151 ? 30.241 -38.873 -37.713 1.00 62.75 ? 154 TYR D CE1 1 ATOM 5738 C CE2 . TYR D 4 151 ? 31.343 -40.761 -38.715 1.00 64.27 ? 154 TYR D CE2 1 ATOM 5739 C CZ . TYR D 4 151 ? 30.686 -39.548 -38.837 1.00 64.50 ? 154 TYR D CZ 1 ATOM 5740 O OH . TYR D 4 151 ? 30.471 -39.008 -40.083 1.00 67.19 ? 154 TYR D OH 1 ATOM 5741 N N . PRO D 4 152 ? 28.865 -43.379 -35.895 1.00 57.92 ? 155 PRO D N 1 ATOM 5742 C CA . PRO D 4 152 ? 27.858 -42.349 -36.149 1.00 57.70 ? 155 PRO D CA 1 ATOM 5743 C C . PRO D 4 152 ? 26.776 -42.342 -35.071 1.00 55.85 ? 155 PRO D C 1 ATOM 5744 O O . PRO D 4 152 ? 26.896 -43.069 -34.086 1.00 54.63 ? 155 PRO D O 1 ATOM 5745 C CB . PRO D 4 152 ? 27.265 -42.762 -37.506 1.00 59.61 ? 155 PRO D CB 1 ATOM 5746 C CG . PRO D 4 152 ? 27.874 -44.107 -37.852 1.00 60.44 ? 155 PRO D CG 1 ATOM 5747 C CD . PRO D 4 152 ? 28.558 -44.616 -36.632 1.00 59.11 ? 155 PRO D CD 1 ATOM 5748 N N . ASP D 4 153 ? 25.735 -41.530 -35.253 1.00 56.11 ? 156 ASP D N 1 ATOM 5749 C CA . ASP D 4 153 ? 24.656 -41.435 -34.263 1.00 54.89 ? 156 ASP D CA 1 ATOM 5750 C C . ASP D 4 153 ? 23.681 -42.613 -34.333 1.00 55.07 ? 156 ASP D C 1 ATOM 5751 O O . ASP D 4 153 ? 22.520 -42.468 -34.719 1.00 56.15 ? 156 ASP D O 1 ATOM 5752 C CB . ASP D 4 153 ? 23.927 -40.080 -34.341 1.00 55.38 ? 156 ASP D CB 1 ATOM 5753 C CG . ASP D 4 153 ? 23.427 -39.753 -35.738 1.00 58.67 ? 156 ASP D CG 1 ATOM 5754 O OD1 . ASP D 4 153 ? 23.862 -40.412 -36.711 1.00 60.84 ? 156 ASP D OD1 1 ATOM 5755 O OD2 . ASP D 4 153 ? 22.594 -38.827 -35.860 1.00 60.17 ? 156 ASP D OD2 1 ATOM 5756 N N . HIS D 4 154 ? 24.177 -43.782 -33.941 1.00 54.67 ? 157 HIS D N 1 ATOM 5757 C CA . HIS D 4 154 ? 23.396 -45.010 -33.927 1.00 55.34 ? 157 HIS D CA 1 ATOM 5758 C C . HIS D 4 154 ? 23.384 -45.621 -32.529 1.00 53.70 ? 157 HIS D C 1 ATOM 5759 O O . HIS D 4 154 ? 24.028 -46.649 -32.285 1.00 54.15 ? 157 HIS D O 1 ATOM 5760 C CB . HIS D 4 154 ? 23.964 -46.010 -34.939 1.00 57.45 ? 157 HIS D CB 1 ATOM 5761 C CG . HIS D 4 154 ? 23.485 -45.789 -36.338 1.00 59.88 ? 157 HIS D CG 1 ATOM 5762 N ND1 . HIS D 4 154 ? 22.629 -46.661 -36.974 1.00 62.58 ? 157 HIS D ND1 1 ATOM 5763 C CD2 . HIS D 4 154 ? 23.734 -44.793 -37.220 1.00 60.94 ? 157 HIS D CD2 1 ATOM 5764 C CE1 . HIS D 4 154 ? 22.375 -46.214 -38.191 1.00 64.75 ? 157 HIS D CE1 1 ATOM 5765 N NE2 . HIS D 4 154 ? 23.032 -45.081 -38.364 1.00 63.72 ? 157 HIS D NE2 1 ATOM 5766 N N . VAL D 4 155 ? 22.657 -44.983 -31.616 1.00 51.99 ? 158 VAL D N 1 ATOM 5767 C CA . VAL D 4 155 ? 22.553 -45.473 -30.241 1.00 50.62 ? 158 VAL D CA 1 ATOM 5768 C C . VAL D 4 155 ? 21.111 -45.604 -29.747 1.00 50.59 ? 158 VAL D C 1 ATOM 5769 O O . VAL D 4 155 ? 20.254 -44.775 -30.064 1.00 50.79 ? 158 VAL D O 1 ATOM 5770 C CB . VAL D 4 155 ? 23.391 -44.626 -29.230 1.00 48.98 ? 158 VAL D CB 1 ATOM 5771 C CG1 . VAL D 4 155 ? 24.893 -44.784 -29.492 1.00 49.23 ? 158 VAL D CG1 1 ATOM 5772 C CG2 . VAL D 4 155 ? 22.975 -43.149 -29.244 1.00 48.13 ? 158 VAL D CG2 1 ATOM 5773 N N . GLU D 4 156 ? 20.863 -46.663 -28.978 1.00 50.76 ? 159 GLU D N 1 ATOM 5774 C CA . GLU D 4 156 ? 19.581 -46.886 -28.312 1.00 50.86 ? 159 GLU D CA 1 ATOM 5775 C C . GLU D 4 156 ? 19.808 -46.988 -26.805 1.00 49.19 ? 159 GLU D C 1 ATOM 5776 O O . GLU D 4 156 ? 20.403 -47.954 -26.321 1.00 49.64 ? 159 GLU D O 1 ATOM 5777 C CB . GLU D 4 156 ? 18.901 -48.150 -28.849 1.00 53.51 ? 159 GLU D CB 1 ATOM 5778 C CG . GLU D 4 156 ? 18.324 -47.998 -30.258 1.00 56.08 ? 159 GLU D CG 1 ATOM 5779 C CD . GLU D 4 156 ? 17.896 -49.324 -30.888 0.70 59.74 ? 159 GLU D CD 1 ATOM 5780 O OE1 . GLU D 4 156 ? 18.641 -50.325 -30.768 0.70 60.39 ? 159 GLU D OE1 1 ATOM 5781 O OE2 . GLU D 4 156 ? 16.816 -49.359 -31.520 0.70 61.90 ? 159 GLU D OE2 1 ATOM 5782 N N . LEU D 4 157 ? 19.339 -45.980 -26.074 1.00 47.50 ? 160 LEU D N 1 ATOM 5783 C CA . LEU D 4 157 ? 19.576 -45.882 -24.633 1.00 45.98 ? 160 LEU D CA 1 ATOM 5784 C C . LEU D 4 157 ? 18.399 -46.424 -23.822 1.00 46.39 ? 160 LEU D C 1 ATOM 5785 O O . LEU D 4 157 ? 17.245 -46.201 -24.179 1.00 47.37 ? 160 LEU D O 1 ATOM 5786 C CB . LEU D 4 157 ? 19.873 -44.427 -24.249 1.00 44.26 ? 160 LEU D CB 1 ATOM 5787 C CG . LEU D 4 157 ? 20.455 -44.127 -22.862 1.00 43.69 ? 160 LEU D CG 1 ATOM 5788 C CD1 . LEU D 4 157 ? 21.313 -42.869 -22.885 1.00 43.44 ? 160 LEU D CD1 1 ATOM 5789 C CD2 . LEU D 4 157 ? 19.364 -44.008 -21.809 1.00 43.78 ? 160 LEU D CD2 1 ATOM 5790 N N . SER D 4 158 ? 18.698 -47.125 -22.730 1.00 46.11 ? 161 SER D N 1 ATOM 5791 C CA . SER D 4 158 ? 17.659 -47.678 -21.855 1.00 46.82 ? 161 SER D CA 1 ATOM 5792 C C . SER D 4 158 ? 18.093 -47.765 -20.392 1.00 45.93 ? 161 SER D C 1 ATOM 5793 O O . SER D 4 158 ? 19.258 -48.021 -20.094 1.00 45.83 ? 161 SER D O 1 ATOM 5794 C CB . SER D 4 158 ? 17.201 -49.057 -22.353 1.00 49.59 ? 161 SER D CB 1 ATOM 5795 O OG . SER D 4 158 ? 18.261 -49.997 -22.320 1.00 50.29 ? 161 SER D OG 1 ATOM 5796 N N . TRP D 4 159 ? 17.136 -47.554 -19.490 1.00 45.75 ? 162 TRP D N 1 ATOM 5797 C CA . TRP D 4 159 ? 17.372 -47.618 -18.049 1.00 45.19 ? 162 TRP D CA 1 ATOM 5798 C C . TRP D 4 159 ? 16.924 -48.951 -17.466 1.00 47.83 ? 162 TRP D C 1 ATOM 5799 O O . TRP D 4 159 ? 15.845 -49.449 -17.787 1.00 49.59 ? 162 TRP D O 1 ATOM 5800 C CB . TRP D 4 159 ? 16.630 -46.489 -17.341 1.00 43.64 ? 162 TRP D CB 1 ATOM 5801 C CG . TRP D 4 159 ? 17.277 -45.158 -17.493 1.00 41.11 ? 162 TRP D CG 1 ATOM 5802 C CD1 . TRP D 4 159 ? 16.977 -44.198 -18.417 1.00 39.90 ? 162 TRP D CD1 1 ATOM 5803 C CD2 . TRP D 4 159 ? 18.337 -44.627 -16.691 1.00 39.15 ? 162 TRP D CD2 1 ATOM 5804 N NE1 . TRP D 4 159 ? 17.785 -43.102 -18.239 1.00 38.31 ? 162 TRP D NE1 1 ATOM 5805 C CE2 . TRP D 4 159 ? 18.630 -43.339 -17.186 1.00 37.86 ? 162 TRP D CE2 1 ATOM 5806 C CE3 . TRP D 4 159 ? 19.068 -45.116 -15.600 1.00 39.08 ? 162 TRP D CE3 1 ATOM 5807 C CZ2 . TRP D 4 159 ? 19.623 -42.530 -16.627 1.00 37.15 ? 162 TRP D CZ2 1 ATOM 5808 C CZ3 . TRP D 4 159 ? 20.056 -44.314 -15.046 1.00 38.15 ? 162 TRP D CZ3 1 ATOM 5809 C CH2 . TRP D 4 159 ? 20.325 -43.034 -15.564 1.00 37.46 ? 162 TRP D CH2 1 ATOM 5810 N N . TRP D 4 160 ? 17.755 -49.515 -16.596 1.00 48.65 ? 163 TRP D N 1 ATOM 5811 C CA . TRP D 4 160 ? 17.464 -50.797 -15.970 1.00 51.73 ? 163 TRP D CA 1 ATOM 5812 C C . TRP D 4 160 ? 17.546 -50.694 -14.452 1.00 52.06 ? 163 TRP D C 1 ATOM 5813 O O . TRP D 4 160 ? 18.614 -50.424 -13.896 1.00 51.48 ? 163 TRP D O 1 ATOM 5814 C CB . TRP D 4 160 ? 18.424 -51.872 -16.491 1.00 53.69 ? 163 TRP D CB 1 ATOM 5815 C CG . TRP D 4 160 ? 18.232 -52.193 -17.944 1.00 54.27 ? 163 TRP D CG 1 ATOM 5816 C CD1 . TRP D 4 160 ? 18.624 -51.436 -19.013 1.00 52.16 ? 163 TRP D CD1 1 ATOM 5817 C CD2 . TRP D 4 160 ? 17.603 -53.359 -18.489 1.00 57.31 ? 163 TRP D CD2 1 ATOM 5818 N NE1 . TRP D 4 160 ? 18.274 -52.057 -20.187 1.00 54.00 ? 163 TRP D NE1 1 ATOM 5819 C CE2 . TRP D 4 160 ? 17.649 -53.239 -19.895 1.00 56.85 ? 163 TRP D CE2 1 ATOM 5820 C CE3 . TRP D 4 160 ? 17.006 -54.494 -17.925 1.00 60.55 ? 163 TRP D CE3 1 ATOM 5821 C CZ2 . TRP D 4 160 ? 17.120 -54.210 -20.746 1.00 59.89 ? 163 TRP D CZ2 1 ATOM 5822 C CZ3 . TRP D 4 160 ? 16.477 -55.459 -18.772 1.00 63.89 ? 163 TRP D CZ3 1 ATOM 5823 C CH2 . TRP D 4 160 ? 16.538 -55.310 -20.168 1.00 63.62 ? 163 TRP D CH2 1 ATOM 5824 N N . VAL D 4 161 ? 16.413 -50.903 -13.787 1.00 53.48 ? 164 VAL D N 1 ATOM 5825 C CA . VAL D 4 161 ? 16.360 -50.870 -12.326 1.00 54.19 ? 164 VAL D CA 1 ATOM 5826 C C . VAL D 4 161 ? 16.174 -52.279 -11.770 1.00 58.22 ? 164 VAL D C 1 ATOM 5827 O O . VAL D 4 161 ? 15.178 -52.947 -12.062 1.00 60.34 ? 164 VAL D O 1 ATOM 5828 C CB . VAL D 4 161 ? 15.252 -49.919 -11.805 1.00 52.90 ? 164 VAL D CB 1 ATOM 5829 C CG1 . VAL D 4 161 ? 15.202 -49.929 -10.282 1.00 53.58 ? 164 VAL D CG1 1 ATOM 5830 C CG2 . VAL D 4 161 ? 15.478 -48.501 -12.320 1.00 49.52 ? 164 VAL D CG2 1 ATOM 5831 N N . ASN D 4 162 ? 17.156 -52.718 -10.982 1.00 59.80 ? 165 ASN D N 1 ATOM 5832 C CA . ASN D 4 162 ? 17.183 -54.050 -10.355 1.00 64.28 ? 165 ASN D CA 1 ATOM 5833 C C . ASN D 4 162 ? 17.112 -55.238 -11.327 1.00 67.35 ? 165 ASN D C 1 ATOM 5834 O O . ASN D 4 162 ? 16.760 -56.351 -10.929 1.00 71.40 ? 165 ASN D O 1 ATOM 5835 C CB . ASN D 4 162 ? 16.112 -54.169 -9.253 1.00 65.88 ? 165 ASN D CB 1 ATOM 5836 C CG . ASN D 4 162 ? 16.333 -53.189 -8.104 1.00 63.93 ? 165 ASN D CG 1 ATOM 5837 O OD1 . ASN D 4 162 ? 17.463 -52.960 -7.669 1.00 63.53 ? 165 ASN D OD1 1 ATOM 5838 N ND2 . ASN D 4 162 ? 15.247 -52.616 -7.602 1.00 63.05 ? 165 ASN D ND2 1 ATOM 5839 N N . GLY D 4 163 ? 17.462 -55.000 -12.590 1.00 65.90 ? 166 GLY D N 1 ATOM 5840 C CA . GLY D 4 163 ? 17.489 -56.057 -13.604 1.00 68.91 ? 166 GLY D CA 1 ATOM 5841 C C . GLY D 4 163 ? 16.349 -56.021 -14.608 1.00 69.18 ? 166 GLY D C 1 ATOM 5842 O O . GLY D 4 163 ? 16.349 -56.780 -15.579 1.00 71.27 ? 166 GLY D O 1 ATOM 5843 N N . LYS D 4 164 ? 15.374 -55.145 -14.371 1.00 67.53 ? 167 LYS D N 1 ATOM 5844 C CA . LYS D 4 164 ? 14.246 -54.954 -15.286 1.00 68.02 ? 167 LYS D CA 1 ATOM 5845 C C . LYS D 4 164 ? 14.255 -53.547 -15.885 1.00 64.15 ? 167 LYS D C 1 ATOM 5846 O O . LYS D 4 164 ? 14.514 -52.563 -15.183 1.00 61.31 ? 167 LYS D O 1 ATOM 5847 C CB . LYS D 4 164 ? 12.913 -55.222 -14.576 1.00 70.40 ? 167 LYS D CB 1 ATOM 5848 C CG . LYS D 4 164 ? 12.666 -56.683 -14.217 1.00 75.45 ? 167 LYS D CG 1 ATOM 5849 N N . GLU D 4 165 ? 13.967 -53.465 -17.183 1.00 64.58 ? 168 GLU D N 1 ATOM 5850 C CA . GLU D 4 165 ? 13.957 -52.195 -17.907 1.00 61.81 ? 168 GLU D CA 1 ATOM 5851 C C . GLU D 4 165 ? 12.725 -51.369 -17.544 1.00 61.53 ? 168 GLU D C 1 ATOM 5852 O O . GLU D 4 165 ? 11.600 -51.873 -17.577 1.00 64.53 ? 168 GLU D O 1 ATOM 5853 C CB . GLU D 4 165 ? 14.002 -52.433 -19.419 1.00 62.72 ? 168 GLU D CB 1 ATOM 5854 C CG . GLU D 4 165 ? 14.586 -51.270 -20.219 1.00 60.05 ? 168 GLU D CG 1 ATOM 5855 C CD . GLU D 4 165 ? 14.216 -51.316 -21.693 1.00 61.56 ? 168 GLU D CD 1 ATOM 5856 O OE1 . GLU D 4 165 ? 15.063 -51.735 -22.511 1.00 62.17 ? 168 GLU D OE1 1 ATOM 5857 O OE2 . GLU D 4 165 ? 13.077 -50.936 -22.035 1.00 62.53 ? 168 GLU D OE2 1 ATOM 5858 N N . VAL D 4 166 ? 12.950 -50.104 -17.199 1.00 58.56 ? 169 VAL D N 1 ATOM 5859 C CA . VAL D 4 166 ? 11.870 -49.188 -16.824 1.00 58.25 ? 169 VAL D CA 1 ATOM 5860 C C . VAL D 4 166 ? 11.590 -48.161 -17.920 1.00 57.35 ? 169 VAL D C 1 ATOM 5861 O O . VAL D 4 166 ? 12.478 -47.818 -18.704 1.00 55.84 ? 169 VAL D O 1 ATOM 5862 C CB . VAL D 4 166 ? 12.161 -48.444 -15.483 1.00 56.15 ? 169 VAL D CB 1 ATOM 5863 C CG1 . VAL D 4 166 ? 12.058 -49.397 -14.298 1.00 58.23 ? 169 VAL D CG1 1 ATOM 5864 C CG2 . VAL D 4 166 ? 13.519 -47.757 -15.511 1.00 52.88 ? 169 VAL D CG2 1 ATOM 5865 N N . HIS D 4 167 ? 10.351 -47.678 -17.965 1.00 58.81 ? 170 HIS D N 1 ATOM 5866 C CA . HIS D 4 167 ? 9.965 -46.607 -18.886 1.00 58.60 ? 170 HIS D CA 1 ATOM 5867 C C . HIS D 4 167 ? 9.406 -45.402 -18.133 1.00 57.62 ? 170 HIS D C 1 ATOM 5868 O O . HIS D 4 167 ? 9.538 -44.262 -18.583 1.00 56.47 ? 170 HIS D O 1 ATOM 5869 C CB . HIS D 4 167 ? 8.956 -47.110 -19.920 1.00 62.02 ? 170 HIS D CB 1 ATOM 5870 C CG . HIS D 4 167 ? 9.477 -48.221 -20.777 1.00 63.78 ? 170 HIS D CG 1 ATOM 5871 N ND1 . HIS D 4 167 ? 9.049 -49.525 -20.648 1.00 67.18 ? 170 HIS D ND1 1 ATOM 5872 C CD2 . HIS D 4 167 ? 10.402 -48.225 -21.767 1.00 62.88 ? 170 HIS D CD2 1 ATOM 5873 C CE1 . HIS D 4 167 ? 9.681 -50.283 -21.527 1.00 68.33 ? 170 HIS D CE1 1 ATOM 5874 N NE2 . HIS D 4 167 ? 10.508 -49.519 -22.218 1.00 65.86 ? 170 HIS D NE2 1 ATOM 5875 N N . SER D 4 168 ? 8.793 -45.667 -16.982 1.00 58.46 ? 171 SER D N 1 ATOM 5876 C CA . SER D 4 168 ? 8.237 -44.623 -16.133 1.00 57.74 ? 171 SER D CA 1 ATOM 5877 C C . SER D 4 168 ? 9.343 -43.724 -15.587 1.00 54.51 ? 171 SER D C 1 ATOM 5878 O O . SER D 4 168 ? 10.357 -44.209 -15.075 1.00 53.22 ? 171 SER D O 1 ATOM 5879 C CB . SER D 4 168 ? 7.439 -45.246 -14.984 1.00 59.56 ? 171 SER D CB 1 ATOM 5880 O OG . SER D 4 168 ? 6.661 -44.271 -14.316 1.00 59.64 ? 171 SER D OG 1 ATOM 5881 N N . GLY D 4 169 ? 9.144 -42.414 -15.717 1.00 53.71 ? 172 GLY D N 1 ATOM 5882 C CA . GLY D 4 169 ? 10.091 -41.423 -15.211 1.00 51.18 ? 172 GLY D CA 1 ATOM 5883 C C . GLY D 4 169 ? 11.336 -41.255 -16.061 1.00 49.63 ? 172 GLY D C 1 ATOM 5884 O O . GLY D 4 169 ? 12.325 -40.679 -15.609 1.00 47.95 ? 172 GLY D O 1 ATOM 5885 N N . VAL D 4 170 ? 11.289 -41.753 -17.294 1.00 50.62 ? 173 VAL D N 1 ATOM 5886 C CA . VAL D 4 170 ? 12.421 -41.642 -18.210 1.00 49.53 ? 173 VAL D CA 1 ATOM 5887 C C . VAL D 4 170 ? 12.148 -40.626 -19.320 1.00 50.29 ? 173 VAL D C 1 ATOM 5888 O O . VAL D 4 170 ? 11.064 -40.602 -19.904 1.00 52.15 ? 173 VAL D O 1 ATOM 5889 C CB . VAL D 4 170 ? 12.818 -43.023 -18.817 1.00 50.27 ? 173 VAL D CB 1 ATOM 5890 C CG1 . VAL D 4 170 ? 13.841 -42.868 -19.942 1.00 49.09 ? 173 VAL D CG1 1 ATOM 5891 C CG2 . VAL D 4 170 ? 13.363 -43.949 -17.736 1.00 49.81 ? 173 VAL D CG2 1 ATOM 5892 N N . CYS D 4 171 ? 13.133 -39.769 -19.571 1.00 49.18 ? 174 CYS D N 1 ATOM 5893 C CA . CYS D 4 171 ? 13.165 -38.961 -20.780 1.00 50.39 ? 174 CYS D CA 1 ATOM 5894 C C . CYS D 4 171 ? 14.551 -39.035 -21.390 1.00 49.27 ? 174 CYS D C 1 ATOM 5895 O O . CYS D 4 171 ? 15.549 -38.753 -20.724 1.00 48.10 ? 174 CYS D O 1 ATOM 5896 C CB . CYS D 4 171 ? 12.799 -37.501 -20.512 1.00 50.85 ? 174 CYS D CB 1 ATOM 5897 S SG . CYS D 4 171 ? 12.248 -36.648 -22.022 1.00 54.67 ? 174 CYS D SG 1 ATOM 5898 N N . THR D 4 172 ? 14.606 -39.427 -22.656 1.00 50.32 ? 175 THR D N 1 ATOM 5899 C CA . THR D 4 172 ? 15.852 -39.461 -23.400 1.00 49.77 ? 175 THR D CA 1 ATOM 5900 C C . THR D 4 172 ? 15.776 -38.382 -24.465 1.00 51.21 ? 175 THR D C 1 ATOM 5901 O O . THR D 4 172 ? 14.711 -38.156 -25.035 1.00 53.29 ? 175 THR D O 1 ATOM 5902 C CB . THR D 4 172 ? 16.068 -40.844 -24.055 1.00 50.26 ? 175 THR D CB 1 ATOM 5903 O OG1 . THR D 4 172 ? 15.912 -41.873 -23.070 1.00 49.74 ? 175 THR D OG1 1 ATOM 5904 C CG2 . THR D 4 172 ? 17.455 -40.953 -24.670 1.00 49.64 ? 175 THR D CG2 1 ATOM 5905 N N . ASP D 4 173 ? 16.892 -37.701 -24.714 1.00 50.99 ? 176 ASP D N 1 ATOM 5906 C CA . ASP D 4 173 ? 16.973 -36.723 -25.798 1.00 52.94 ? 176 ASP D CA 1 ATOM 5907 C C . ASP D 4 173 ? 16.596 -37.378 -27.125 1.00 54.73 ? 176 ASP D C 1 ATOM 5908 O O . ASP D 4 173 ? 17.145 -38.428 -27.473 1.00 54.28 ? 176 ASP D O 1 ATOM 5909 C CB . ASP D 4 173 ? 18.384 -36.142 -25.907 1.00 52.42 ? 176 ASP D CB 1 ATOM 5910 C CG . ASP D 4 173 ? 18.783 -35.326 -24.697 1.00 51.90 ? 176 ASP D CG 1 ATOM 5911 O OD1 . ASP D 4 173 ? 17.895 -34.783 -24.006 1.00 52.79 ? 176 ASP D OD1 1 ATOM 5912 O OD2 . ASP D 4 173 ? 20.001 -35.217 -24.446 1.00 51.67 ? 176 ASP D OD2 1 ATOM 5913 N N . PRO D 4 174 ? 15.643 -36.776 -27.861 1.00 57.25 ? 177 PRO D N 1 ATOM 5914 C CA . PRO D 4 174 ? 15.306 -37.310 -29.179 1.00 59.45 ? 177 PRO D CA 1 ATOM 5915 C C . PRO D 4 174 ? 16.475 -37.169 -30.152 1.00 59.79 ? 177 PRO D C 1 ATOM 5916 O O . PRO D 4 174 ? 16.711 -38.065 -30.963 1.00 60.49 ? 177 PRO D O 1 ATOM 5917 C CB . PRO D 4 174 ? 14.113 -36.451 -29.625 1.00 62.40 ? 177 PRO D CB 1 ATOM 5918 C CG . PRO D 4 174 ? 14.169 -35.226 -28.785 1.00 61.91 ? 177 PRO D CG 1 ATOM 5919 C CD . PRO D 4 174 ? 14.783 -35.639 -27.483 1.00 58.66 ? 177 PRO D CD 1 ATOM 5920 N N . GLN D 4 175 ? 17.207 -36.060 -30.049 1.00 59.74 ? 178 GLN D N 1 ATOM 5921 C CA . GLN D 4 175 ? 18.346 -35.788 -30.925 1.00 60.32 ? 178 GLN D CA 1 ATOM 5922 C C . GLN D 4 175 ? 19.653 -35.714 -30.135 1.00 58.13 ? 178 GLN D C 1 ATOM 5923 O O . GLN D 4 175 ? 19.672 -35.208 -29.012 1.00 56.99 ? 178 GLN D O 1 ATOM 5924 C CB . GLN D 4 175 ? 18.136 -34.479 -31.698 1.00 63.17 ? 178 GLN D CB 1 ATOM 5925 C CG . GLN D 4 175 ? 16.799 -34.364 -32.438 1.00 66.48 ? 178 GLN D CG 1 ATOM 5926 C CD . GLN D 4 175 ? 16.672 -35.305 -33.636 0.70 68.21 ? 178 GLN D CD 1 ATOM 5927 O OE1 . GLN D 4 175 ? 17.662 -35.846 -34.136 0.70 67.46 ? 178 GLN D OE1 1 ATOM 5928 N NE2 . GLN D 4 175 ? 15.443 -35.493 -34.104 0.70 70.62 ? 178 GLN D NE2 1 ATOM 5929 N N . PRO D 4 176 ? 20.753 -36.226 -30.718 1.00 57.90 ? 179 PRO D N 1 ATOM 5930 C CA . PRO D 4 176 ? 22.060 -36.032 -30.102 1.00 56.69 ? 179 PRO D CA 1 ATOM 5931 C C . PRO D 4 176 ? 22.647 -34.679 -30.509 1.00 58.49 ? 179 PRO D C 1 ATOM 5932 O O . PRO D 4 176 ? 22.176 -34.073 -31.476 1.00 60.70 ? 179 PRO D O 1 ATOM 5933 C CB . PRO D 4 176 ? 22.886 -37.175 -30.688 1.00 56.37 ? 179 PRO D CB 1 ATOM 5934 C CG . PRO D 4 176 ? 22.296 -37.405 -32.029 1.00 58.25 ? 179 PRO D CG 1 ATOM 5935 C CD . PRO D 4 176 ? 20.838 -37.050 -31.939 1.00 59.04 ? 179 PRO D CD 1 ATOM 5936 N N . LEU D 4 177 ? 23.650 -34.199 -29.781 1.00 57.95 ? 180 LEU D N 1 ATOM 5937 C CA . LEU D 4 177 ? 24.321 -32.969 -30.186 1.00 60.37 ? 180 LEU D CA 1 ATOM 5938 C C . LEU D 4 177 ? 25.752 -33.226 -30.647 1.00 61.00 ? 180 LEU D C 1 ATOM 5939 O O . LEU D 4 177 ? 26.415 -34.142 -30.159 1.00 59.53 ? 180 LEU D O 1 ATOM 5940 C CB . LEU D 4 177 ? 24.252 -31.893 -29.092 1.00 60.74 ? 180 LEU D CB 1 ATOM 5941 C CG . LEU D 4 177 ? 25.117 -31.937 -27.831 1.00 59.87 ? 180 LEU D CG 1 ATOM 5942 C CD1 . LEU D 4 177 ? 25.143 -30.556 -27.197 1.00 62.06 ? 180 LEU D CD1 1 ATOM 5943 C CD2 . LEU D 4 177 ? 24.612 -32.965 -26.835 1.00 57.63 ? 180 LEU D CD2 1 ATOM 5944 N N . LYS D 4 178 ? 26.204 -32.425 -31.609 1.00 63.63 ? 181 LYS D N 1 ATOM 5945 C CA . LYS D 4 178 ? 27.564 -32.522 -32.130 1.00 64.91 ? 181 LYS D CA 1 ATOM 5946 C C . LYS D 4 178 ? 28.548 -31.901 -31.146 1.00 65.50 ? 181 LYS D C 1 ATOM 5947 O O . LYS D 4 178 ? 28.430 -30.722 -30.798 1.00 67.26 ? 181 LYS D O 1 ATOM 5948 C CB . LYS D 4 178 ? 27.678 -31.841 -33.500 1.00 68.09 ? 181 LYS D CB 1 ATOM 5949 C CG . LYS D 4 178 ? 26.982 -32.583 -34.638 1.00 68.15 ? 181 LYS D CG 1 ATOM 5950 C CD . LYS D 4 178 ? 27.291 -31.955 -35.993 1.00 71.51 ? 181 LYS D CD 1 ATOM 5951 N N . GLU D 4 179 ? 29.513 -32.704 -30.700 1.00 64.53 ? 182 GLU D N 1 ATOM 5952 C CA . GLU D 4 179 ? 30.549 -32.246 -29.770 1.00 65.55 ? 182 GLU D CA 1 ATOM 5953 C C . GLU D 4 179 ? 31.440 -31.167 -30.389 1.00 69.37 ? 182 GLU D C 1 ATOM 5954 O O . GLU D 4 179 ? 31.978 -30.311 -29.682 1.00 71.21 ? 182 GLU D O 1 ATOM 5955 C CB . GLU D 4 179 ? 31.383 -33.425 -29.269 1.00 64.39 ? 182 GLU D CB 1 ATOM 5956 C CG . GLU D 4 179 ? 30.608 -34.369 -28.350 1.00 61.57 ? 182 GLU D CG 1 ATOM 5957 C CD . GLU D 4 179 ? 31.427 -35.557 -27.871 1.00 61.46 ? 182 GLU D CD 1 ATOM 5958 O OE1 . GLU D 4 179 ? 32.447 -35.890 -28.516 1.00 63.52 ? 182 GLU D OE1 1 ATOM 5959 O OE2 . GLU D 4 179 ? 31.040 -36.163 -26.847 1.00 59.38 ? 182 GLU D OE2 1 ATOM 5960 N N . GLN D 4 180 ? 31.586 -31.220 -31.711 1.00 70.84 ? 183 GLN D N 1 ATOM 5961 C CA . GLN D 4 180 ? 32.202 -30.146 -32.480 1.00 74.76 ? 183 GLN D CA 1 ATOM 5962 C C . GLN D 4 180 ? 31.323 -29.825 -33.693 1.00 75.61 ? 183 GLN D C 1 ATOM 5963 O O . GLN D 4 180 ? 31.485 -30.427 -34.755 1.00 75.94 ? 183 GLN D O 1 ATOM 5964 C CB . GLN D 4 180 ? 33.626 -30.522 -32.896 1.00 76.85 ? 183 GLN D CB 1 ATOM 5965 C CG . GLN D 4 180 ? 34.658 -30.355 -31.787 1.00 78.38 ? 183 GLN D CG 1 ATOM 5966 C CD . GLN D 4 180 ? 36.005 -30.955 -32.142 1.00 81.20 ? 183 GLN D CD 1 ATOM 5967 O OE1 . GLN D 4 180 ? 36.108 -32.147 -32.435 1.00 79.84 ? 183 GLN D OE1 1 ATOM 5968 N NE2 . GLN D 4 180 ? 37.049 -30.133 -32.108 1.00 85.71 ? 183 GLN D NE2 1 ATOM 5969 N N . PRO D 4 181 ? 30.378 -28.875 -33.529 1.00 76.30 ? 184 PRO D N 1 ATOM 5970 C CA . PRO D 4 181 ? 29.366 -28.537 -34.543 1.00 77.44 ? 184 PRO D CA 1 ATOM 5971 C C . PRO D 4 181 ? 29.929 -27.993 -35.857 1.00 81.37 ? 184 PRO D C 1 ATOM 5972 O O . PRO D 4 181 ? 29.233 -28.014 -36.876 1.00 82.50 ? 184 PRO D O 1 ATOM 5973 C CB . PRO D 4 181 ? 28.510 -27.469 -33.848 1.00 78.30 ? 184 PRO D CB 1 ATOM 5974 C CG . PRO D 4 181 ? 29.374 -26.921 -32.772 1.00 79.08 ? 184 PRO D CG 1 ATOM 5975 C CD . PRO D 4 181 ? 30.200 -28.075 -32.304 1.00 76.37 ? 184 PRO D CD 1 ATOM 5976 N N . ALA D 4 182 ? 31.171 -27.516 -35.830 1.00 83.69 ? 185 ALA D N 1 ATOM 5977 C CA . ALA D 4 182 ? 31.820 -26.972 -37.021 1.00 87.74 ? 185 ALA D CA 1 ATOM 5978 C C . ALA D 4 182 ? 32.462 -28.049 -37.908 1.00 86.98 ? 185 ALA D C 1 ATOM 5979 O O . ALA D 4 182 ? 32.952 -27.747 -39.000 1.00 90.42 ? 185 ALA D O 1 ATOM 5980 C CB . ALA D 4 182 ? 32.848 -25.915 -36.625 1.00 91.61 ? 185 ALA D CB 1 ATOM 5981 N N . LEU D 4 183 ? 32.451 -29.298 -37.441 1.00 82.63 ? 186 LEU D N 1 ATOM 5982 C CA . LEU D 4 183 ? 33.049 -30.414 -38.183 1.00 81.82 ? 186 LEU D CA 1 ATOM 5983 C C . LEU D 4 183 ? 32.012 -31.324 -38.841 1.00 79.43 ? 186 LEU D C 1 ATOM 5984 O O . LEU D 4 183 ? 30.967 -31.620 -38.254 1.00 76.65 ? 186 LEU D O 1 ATOM 5985 C CB . LEU D 4 183 ? 33.976 -31.237 -37.281 1.00 79.90 ? 186 LEU D CB 1 ATOM 5986 C CG . LEU D 4 183 ? 35.335 -30.640 -36.895 1.00 82.97 ? 186 LEU D CG 1 ATOM 5987 C CD1 . LEU D 4 183 ? 35.959 -31.448 -35.772 1.00 80.92 ? 186 LEU D CD1 1 ATOM 5988 C CD2 . LEU D 4 183 ? 36.287 -30.561 -38.090 1.00 86.87 ? 186 LEU D CD2 1 ATOM 5989 N N . ASN D 4 184 ? 32.320 -31.770 -40.058 0.70 80.77 ? 187 ASN D N 1 ATOM 5990 C CA . ASN D 4 184 ? 31.434 -32.646 -40.827 0.70 79.27 ? 187 ASN D CA 1 ATOM 5991 C C . ASN D 4 184 ? 31.293 -34.051 -40.243 0.70 75.17 ? 187 ASN D C 1 ATOM 5992 O O . ASN D 4 184 ? 30.222 -34.653 -40.326 0.70 73.48 ? 187 ASN D O 1 ATOM 5993 C CB . ASN D 4 184 ? 31.886 -32.727 -42.290 0.70 82.59 ? 187 ASN D CB 1 ATOM 5994 C CG . ASN D 4 184 ? 31.616 -31.443 -43.062 0.70 86.74 ? 187 ASN D CG 1 ATOM 5995 O OD1 . ASN D 4 184 ? 30.721 -30.667 -42.719 0.70 86.96 ? 187 ASN D OD1 1 ATOM 5996 N ND2 . ASN D 4 184 ? 32.390 -31.220 -44.119 0.70 90.25 ? 187 ASN D ND2 1 ATOM 5997 N N . ASP D 4 185 ? 32.373 -34.568 -39.660 1.00 73.96 ? 188 ASP D N 1 ATOM 5998 C CA . ASP D 4 185 ? 32.347 -35.888 -39.028 1.00 70.57 ? 188 ASP D CA 1 ATOM 5999 C C . ASP D 4 185 ? 32.592 -35.818 -37.515 1.00 68.20 ? 188 ASP D C 1 ATOM 6000 O O . ASP D 4 185 ? 33.409 -36.559 -36.960 1.00 67.66 ? 188 ASP D O 1 ATOM 6001 C CB . ASP D 4 185 ? 33.319 -36.860 -39.723 1.00 71.80 ? 188 ASP D CB 1 ATOM 6002 C CG . ASP D 4 185 ? 34.777 -36.428 -39.616 0.70 74.13 ? 188 ASP D CG 1 ATOM 6003 O OD1 . ASP D 4 185 ? 35.048 -35.224 -39.412 0.70 75.84 ? 188 ASP D OD1 1 ATOM 6004 O OD2 . ASP D 4 185 ? 35.654 -37.308 -39.743 0.70 74.51 ? 188 ASP D OD2 1 ATOM 6005 N N . SER D 4 186 ? 31.866 -34.918 -36.857 1.00 67.01 ? 189 SER D N 1 ATOM 6006 C CA . SER D 4 186 ? 31.944 -34.760 -35.410 1.00 64.72 ? 189 SER D CA 1 ATOM 6007 C C . SER D 4 186 ? 31.365 -35.966 -34.683 1.00 61.17 ? 189 SER D C 1 ATOM 6008 O O . SER D 4 186 ? 30.408 -36.582 -35.152 1.00 59.96 ? 189 SER D O 1 ATOM 6009 C CB . SER D 4 186 ? 31.194 -33.503 -34.974 1.00 65.06 ? 189 SER D CB 1 ATOM 6010 O OG . SER D 4 186 ? 31.075 -33.445 -33.563 1.00 62.77 ? 189 SER D OG 1 ATOM 6011 N N . ARG D 4 187 ? 31.950 -36.290 -33.534 1.00 59.78 ? 190 ARG D N 1 ATOM 6012 C CA . ARG D 4 187 ? 31.390 -37.304 -32.652 1.00 56.80 ? 190 ARG D CA 1 ATOM 6013 C C . ARG D 4 187 ? 30.164 -36.731 -31.940 1.00 54.82 ? 190 ARG D C 1 ATOM 6014 O O . ARG D 4 187 ? 29.989 -35.509 -31.860 1.00 55.77 ? 190 ARG D O 1 ATOM 6015 C CB . ARG D 4 187 ? 32.428 -37.790 -31.640 1.00 56.97 ? 190 ARG D CB 1 ATOM 6016 C CG . ARG D 4 187 ? 33.685 -38.398 -32.254 1.00 59.49 ? 190 ARG D CG 1 ATOM 6017 C CD . ARG D 4 187 ? 34.301 -39.413 -31.309 1.00 59.84 ? 190 ARG D CD 1 ATOM 6018 N NE . ARG D 4 187 ? 35.761 -39.356 -31.295 1.00 63.38 ? 190 ARG D NE 1 ATOM 6019 C CZ . ARG D 4 187 ? 36.527 -39.909 -30.357 1.00 64.52 ? 190 ARG D CZ 1 ATOM 6020 N NH1 . ARG D 4 187 ? 35.981 -40.572 -29.342 1.00 62.31 ? 190 ARG D NH1 1 ATOM 6021 N NH2 . ARG D 4 187 ? 37.847 -39.797 -30.431 1.00 68.12 ? 190 ARG D NH2 1 ATOM 6022 N N . TYR D 4 188 ? 29.317 -37.616 -31.427 1.00 52.26 ? 191 TYR D N 1 ATOM 6023 C CA . TYR D 4 188 ? 28.036 -37.206 -30.873 1.00 50.43 ? 191 TYR D CA 1 ATOM 6024 C C . TYR D 4 188 ? 27.945 -37.413 -29.368 1.00 48.57 ? 191 TYR D C 1 ATOM 6025 O O . TYR D 4 188 ? 28.766 -38.117 -28.775 1.00 48.28 ? 191 TYR D O 1 ATOM 6026 C CB . TYR D 4 188 ? 26.895 -37.939 -31.584 1.00 49.87 ? 191 TYR D CB 1 ATOM 6027 C CG . TYR D 4 188 ? 26.727 -37.548 -33.032 1.00 51.49 ? 191 TYR D CG 1 ATOM 6028 C CD1 . TYR D 4 188 ? 25.931 -36.462 -33.391 1.00 52.56 ? 191 TYR D CD1 1 ATOM 6029 C CD2 . TYR D 4 188 ? 27.363 -38.261 -34.044 1.00 52.46 ? 191 TYR D CD2 1 ATOM 6030 C CE1 . TYR D 4 188 ? 25.774 -36.097 -34.723 1.00 54.99 ? 191 TYR D CE1 1 ATOM 6031 C CE2 . TYR D 4 188 ? 27.212 -37.905 -35.378 1.00 54.75 ? 191 TYR D CE2 1 ATOM 6032 C CZ . TYR D 4 188 ? 26.417 -36.823 -35.709 1.00 55.75 ? 191 TYR D CZ 1 ATOM 6033 O OH . TYR D 4 188 ? 26.267 -36.467 -37.024 1.00 58.17 ? 191 TYR D OH 1 ATOM 6034 N N . ALA D 4 189 ? 26.944 -36.779 -28.763 1.00 47.57 ? 192 ALA D N 1 ATOM 6035 C CA . ALA D 4 189 ? 26.653 -36.941 -27.345 1.00 45.87 ? 192 ALA D CA 1 ATOM 6036 C C . ALA D 4 189 ? 25.148 -37.042 -27.128 1.00 44.60 ? 192 ALA D C 1 ATOM 6037 O O . ALA D 4 189 ? 24.377 -36.294 -27.728 1.00 45.34 ? 192 ALA D O 1 ATOM 6038 C CB . ALA D 4 189 ? 27.240 -35.789 -26.538 1.00 46.67 ? 192 ALA D CB 1 ATOM 6039 N N . LEU D 4 190 ? 24.742 -37.980 -26.276 1.00 43.12 ? 193 LEU D N 1 ATOM 6040 C CA . LEU D 4 190 ? 23.336 -38.178 -25.939 1.00 42.21 ? 193 LEU D CA 1 ATOM 6041 C C . LEU D 4 190 ? 23.156 -38.237 -24.430 1.00 40.97 ? 193 LEU D C 1 ATOM 6042 O O . LEU D 4 190 ? 23.955 -38.864 -23.731 1.00 40.65 ? 193 LEU D O 1 ATOM 6043 C CB . LEU D 4 190 ? 22.798 -39.464 -26.576 1.00 42.18 ? 193 LEU D CB 1 ATOM 6044 C CG . LEU D 4 190 ? 21.275 -39.665 -26.554 1.00 42.48 ? 193 LEU D CG 1 ATOM 6045 C CD1 . LEU D 4 190 ? 20.572 -38.821 -27.626 1.00 43.47 ? 193 LEU D CD1 1 ATOM 6046 C CD2 . LEU D 4 190 ? 20.911 -41.138 -26.703 1.00 42.53 ? 193 LEU D CD2 1 ATOM 6047 N N . SER D 4 191 ? 22.110 -37.579 -23.934 1.00 40.62 ? 194 SER D N 1 ATOM 6048 C CA . SER D 4 191 ? 21.790 -37.625 -22.512 1.00 39.66 ? 194 SER D CA 1 ATOM 6049 C C . SER D 4 191 ? 20.382 -38.166 -22.266 1.00 39.30 ? 194 SER D C 1 ATOM 6050 O O . SER D 4 191 ? 19.514 -38.090 -23.139 1.00 39.91 ? 194 SER D O 1 ATOM 6051 C CB . SER D 4 191 ? 21.979 -36.250 -21.857 1.00 40.03 ? 194 SER D CB 1 ATOM 6052 O OG . SER D 4 191 ? 20.853 -35.410 -22.049 1.00 40.86 ? 194 SER D OG 1 ATOM 6053 N N . SER D 4 192 ? 20.178 -38.722 -21.074 1.00 38.59 ? 195 SER D N 1 ATOM 6054 C CA . SER D 4 192 ? 18.896 -39.291 -20.669 1.00 38.67 ? 195 SER D CA 1 ATOM 6055 C C . SER D 4 192 ? 18.706 -39.170 -19.164 1.00 38.23 ? 195 SER D C 1 ATOM 6056 O O . SER D 4 192 ? 19.678 -39.050 -18.413 1.00 37.78 ? 195 SER D O 1 ATOM 6057 C CB . SER D 4 192 ? 18.799 -40.759 -21.085 1.00 39.06 ? 195 SER D CB 1 ATOM 6058 O OG . SER D 4 192 ? 17.695 -41.406 -20.472 1.00 38.95 ? 195 SER D OG 1 ATOM 6059 N N . ARG D 4 193 ? 17.447 -39.226 -18.736 1.00 38.63 ? 196 ARG D N 1 ATOM 6060 C CA . ARG D 4 193 ? 17.086 -39.016 -17.338 1.00 38.45 ? 196 ARG D CA 1 ATOM 6061 C C . ARG D 4 193 ? 16.175 -40.103 -16.790 1.00 38.76 ? 196 ARG D C 1 ATOM 6062 O O . ARG D 4 193 ? 15.261 -40.561 -17.480 1.00 39.86 ? 196 ARG D O 1 ATOM 6063 C CB . ARG D 4 193 ? 16.412 -37.657 -17.183 1.00 38.86 ? 196 ARG D CB 1 ATOM 6064 C CG . ARG D 4 193 ? 17.390 -36.521 -17.038 1.00 39.69 ? 196 ARG D CG 1 ATOM 6065 C CD . ARG D 4 193 ? 17.047 -35.393 -17.972 1.00 42.51 ? 196 ARG D CD 1 ATOM 6066 N NE . ARG D 4 193 ? 17.632 -35.591 -19.295 1.00 44.19 ? 196 ARG D NE 1 ATOM 6067 C CZ . ARG D 4 193 ? 17.503 -34.741 -20.310 1.00 46.27 ? 196 ARG D CZ 1 ATOM 6068 N NH1 . ARG D 4 193 ? 18.076 -35.012 -21.474 1.00 46.89 ? 196 ARG D NH1 1 ATOM 6069 N NH2 . ARG D 4 193 ? 16.805 -33.620 -20.166 1.00 47.78 ? 196 ARG D NH2 1 ATOM 6070 N N . LEU D 4 194 ? 16.443 -40.516 -15.553 1.00 38.24 ? 197 LEU D N 1 ATOM 6071 C CA . LEU D 4 194 ? 15.536 -41.368 -14.789 1.00 38.85 ? 197 LEU D CA 1 ATOM 6072 C C . LEU D 4 194 ? 15.253 -40.720 -13.438 1.00 38.73 ? 197 LEU D C 1 ATOM 6073 O O . LEU D 4 194 ? 16.162 -40.537 -12.622 1.00 38.29 ? 197 LEU D O 1 ATOM 6074 C CB . LEU D 4 194 ? 16.113 -42.777 -14.598 1.00 39.40 ? 197 LEU D CB 1 ATOM 6075 C CG . LEU D 4 194 ? 15.412 -43.706 -13.588 1.00 40.48 ? 197 LEU D CG 1 ATOM 6076 C CD1 . LEU D 4 194 ? 14.070 -44.227 -14.096 1.00 41.12 ? 197 LEU D CD1 1 ATOM 6077 C CD2 . LEU D 4 194 ? 16.316 -44.862 -13.196 1.00 41.01 ? 197 LEU D CD2 1 ATOM 6078 N N . ARG D 4 195 ? 13.991 -40.371 -13.207 1.00 39.41 ? 198 ARG D N 1 ATOM 6079 C CA . ARG D 4 195 ? 13.594 -39.741 -11.953 1.00 39.47 ? 198 ARG D CA 1 ATOM 6080 C C . ARG D 4 195 ? 12.765 -40.685 -11.089 1.00 40.71 ? 198 ARG D C 1 ATOM 6081 O O . ARG D 4 195 ? 11.750 -41.235 -11.534 1.00 41.91 ? 198 ARG D O 1 ATOM 6082 C CB . ARG D 4 195 ? 12.832 -38.442 -12.216 1.00 39.81 ? 198 ARG D CB 1 ATOM 6083 C CG . ARG D 4 195 ? 12.792 -37.503 -11.028 1.00 39.62 ? 198 ARG D CG 1 ATOM 6084 C CD . ARG D 4 195 ? 12.170 -36.170 -11.396 1.00 40.17 ? 198 ARG D CD 1 ATOM 6085 N NE . ARG D 4 195 ? 12.549 -35.123 -10.449 1.00 40.80 ? 198 ARG D NE 1 ATOM 6086 C CZ . ARG D 4 195 ? 12.137 -33.860 -10.515 1.00 41.89 ? 198 ARG D CZ 1 ATOM 6087 N NH1 . ARG D 4 195 ? 12.541 -32.980 -9.608 1.00 41.87 ? 198 ARG D NH1 1 ATOM 6088 N NH2 . ARG D 4 195 ? 11.322 -33.474 -11.487 1.00 43.25 ? 198 ARG D NH2 1 ATOM 6089 N N . VAL D 4 196 ? 13.218 -40.869 -9.852 1.00 40.69 ? 199 VAL D N 1 ATOM 6090 C CA . VAL D 4 196 ? 12.526 -41.706 -8.873 1.00 42.06 ? 199 VAL D CA 1 ATOM 6091 C C . VAL D 4 196 ? 12.178 -40.885 -7.631 1.00 42.29 ? 199 VAL D C 1 ATOM 6092 O O . VAL D 4 196 ? 12.580 -39.725 -7.515 1.00 41.37 ? 199 VAL D O 1 ATOM 6093 C CB . VAL D 4 196 ? 13.377 -42.942 -8.472 1.00 42.72 ? 199 VAL D CB 1 ATOM 6094 C CG1 . VAL D 4 196 ? 13.495 -43.918 -9.638 1.00 43.12 ? 199 VAL D CG1 1 ATOM 6095 C CG2 . VAL D 4 196 ? 14.763 -42.523 -7.968 1.00 41.71 ? 199 VAL D CG2 1 ATOM 6096 N N . SER D 4 197 ? 11.428 -41.482 -6.710 1.00 43.87 ? 200 SER D N 1 ATOM 6097 C CA . SER D 4 197 ? 11.185 -40.857 -5.416 1.00 44.46 ? 200 SER D CA 1 ATOM 6098 C C . SER D 4 197 ? 12.452 -40.932 -4.568 1.00 44.39 ? 200 SER D C 1 ATOM 6099 O O . SER D 4 197 ? 13.263 -41.852 -4.728 1.00 44.56 ? 200 SER D O 1 ATOM 6100 C CB . SER D 4 197 ? 10.013 -41.527 -4.694 1.00 46.52 ? 200 SER D CB 1 ATOM 6101 O OG . SER D 4 197 ? 10.382 -42.789 -4.165 1.00 47.74 ? 200 SER D OG 1 ATOM 6102 N N . ALA D 4 198 ? 12.615 -39.962 -3.670 1.00 44.63 ? 201 ALA D N 1 ATOM 6103 C CA . ALA D 4 198 ? 13.786 -39.889 -2.796 1.00 45.12 ? 201 ALA D CA 1 ATOM 6104 C C . ALA D 4 198 ? 14.017 -41.175 -2.004 1.00 46.99 ? 201 ALA D C 1 ATOM 6105 O O . ALA D 4 198 ? 15.149 -41.652 -1.914 1.00 47.35 ? 201 ALA D O 1 ATOM 6106 C CB . ALA D 4 198 ? 13.672 -38.701 -1.858 1.00 45.49 ? 201 ALA D CB 1 ATOM 6107 N N . THR D 4 199 ? 12.940 -41.731 -1.445 1.00 48.68 ? 202 THR D N 1 ATOM 6108 C CA . THR D 4 199 ? 13.009 -42.959 -0.643 1.00 51.22 ? 202 THR D CA 1 ATOM 6109 C C . THR D 4 199 ? 13.502 -44.155 -1.457 1.00 51.65 ? 202 THR D C 1 ATOM 6110 O O . THR D 4 199 ? 14.239 -44.997 -0.944 1.00 53.48 ? 202 THR D O 1 ATOM 6111 C CB . THR D 4 199 ? 11.648 -43.316 -0.014 1.00 53.04 ? 202 THR D CB 1 ATOM 6112 O OG1 . THR D 4 199 ? 10.680 -43.510 -1.052 1.00 53.26 ? 202 THR D OG1 1 ATOM 6113 C CG2 . THR D 4 199 ? 11.176 -42.212 0.921 1.00 53.22 ? 202 THR D CG2 1 ATOM 6114 N N . PHE D 4 200 ? 13.088 -44.218 -2.721 1.00 50.49 ? 203 PHE D N 1 ATOM 6115 C CA . PHE D 4 200 ? 13.546 -45.253 -3.642 1.00 50.87 ? 203 PHE D CA 1 ATOM 6116 C C . PHE D 4 200 ? 15.054 -45.165 -3.867 1.00 50.03 ? 203 PHE D C 1 ATOM 6117 O O . PHE D 4 200 ? 15.744 -46.183 -3.851 1.00 51.77 ? 203 PHE D O 1 ATOM 6118 C CB . PHE D 4 200 ? 12.802 -45.154 -4.976 1.00 49.91 ? 203 PHE D CB 1 ATOM 6119 C CG . PHE D 4 200 ? 12.926 -46.382 -5.835 1.00 51.13 ? 203 PHE D CG 1 ATOM 6120 C CD1 . PHE D 4 200 ? 13.875 -46.443 -6.852 1.00 49.77 ? 203 PHE D CD1 1 ATOM 6121 C CD2 . PHE D 4 200 ? 12.087 -47.475 -5.632 1.00 53.86 ? 203 PHE D CD2 1 ATOM 6122 C CE1 . PHE D 4 200 ? 13.991 -47.576 -7.651 1.00 51.11 ? 203 PHE D CE1 1 ATOM 6123 C CE2 . PHE D 4 200 ? 12.194 -48.616 -6.427 1.00 55.50 ? 203 PHE D CE2 1 ATOM 6124 C CZ . PHE D 4 200 ? 13.149 -48.666 -7.437 1.00 54.01 ? 203 PHE D CZ 1 ATOM 6125 N N . TRP D 4 201 ? 15.557 -43.948 -4.067 1.00 48.01 ? 204 TRP D N 1 ATOM 6126 C CA . TRP D 4 201 ? 16.994 -43.719 -4.218 1.00 47.38 ? 204 TRP D CA 1 ATOM 6127 C C . TRP D 4 201 ? 17.766 -44.012 -2.932 1.00 49.49 ? 204 TRP D C 1 ATOM 6128 O O . TRP D 4 201 ? 18.877 -44.543 -2.981 1.00 50.63 ? 204 TRP D O 1 ATOM 6129 C CB . TRP D 4 201 ? 17.284 -42.289 -4.689 1.00 45.32 ? 204 TRP D CB 1 ATOM 6130 C CG . TRP D 4 201 ? 18.732 -41.927 -4.560 1.00 45.30 ? 204 TRP D CG 1 ATOM 6131 C CD1 . TRP D 4 201 ? 19.292 -41.124 -3.612 1.00 46.13 ? 204 TRP D CD1 1 ATOM 6132 C CD2 . TRP D 4 201 ? 19.812 -42.394 -5.379 1.00 45.43 ? 204 TRP D CD2 1 ATOM 6133 N NE1 . TRP D 4 201 ? 20.651 -41.047 -3.796 1.00 46.84 ? 204 TRP D NE1 1 ATOM 6134 C CE2 . TRP D 4 201 ? 20.998 -41.819 -4.873 1.00 46.34 ? 204 TRP D CE2 1 ATOM 6135 C CE3 . TRP D 4 201 ? 19.892 -43.240 -6.495 1.00 45.00 ? 204 TRP D CE3 1 ATOM 6136 C CZ2 . TRP D 4 201 ? 22.253 -42.057 -5.446 1.00 46.91 ? 204 TRP D CZ2 1 ATOM 6137 C CZ3 . TRP D 4 201 ? 21.140 -43.477 -7.063 1.00 45.35 ? 204 TRP D CZ3 1 ATOM 6138 C CH2 . TRP D 4 201 ? 22.303 -42.884 -6.538 1.00 46.34 ? 204 TRP D CH2 1 ATOM 6139 N N . GLN D 4 202 ? 17.173 -43.666 -1.791 1.00 50.39 ? 205 GLN D N 1 ATOM 6140 C CA . GLN D 4 202 ? 17.825 -43.817 -0.483 1.00 52.68 ? 205 GLN D CA 1 ATOM 6141 C C . GLN D 4 202 ? 17.944 -45.271 -0.016 1.00 55.54 ? 205 GLN D C 1 ATOM 6142 O O . GLN D 4 202 ? 18.460 -45.544 1.067 1.00 58.20 ? 205 GLN D O 1 ATOM 6143 C CB . GLN D 4 202 ? 17.125 -42.947 0.573 1.00 52.83 ? 205 GLN D CB 1 ATOM 6144 C CG . GLN D 4 202 ? 17.466 -41.457 0.456 1.00 51.44 ? 205 GLN D CG 1 ATOM 6145 C CD . GLN D 4 202 ? 16.466 -40.535 1.148 1.00 51.60 ? 205 GLN D CD 1 ATOM 6146 O OE1 . GLN D 4 202 ? 15.358 -40.942 1.509 1.00 52.45 ? 205 GLN D OE1 1 ATOM 6147 N NE2 . GLN D 4 202 ? 16.858 -39.275 1.326 1.00 50.69 ? 205 GLN D NE2 1 ATOM 6148 N N . ASN D 4 203 ? 17.474 -46.195 -0.850 1.00 55.56 ? 206 ASN D N 1 ATOM 6149 C CA . ASN D 4 203 ? 17.549 -47.624 -0.574 1.00 58.67 ? 206 ASN D CA 1 ATOM 6150 C C . ASN D 4 203 ? 18.796 -48.239 -1.226 1.00 59.52 ? 206 ASN D C 1 ATOM 6151 O O . ASN D 4 203 ? 18.860 -48.353 -2.450 1.00 57.85 ? 206 ASN D O 1 ATOM 6152 C CB . ASN D 4 203 ? 16.269 -48.302 -1.078 1.00 58.99 ? 206 ASN D CB 1 ATOM 6153 C CG . ASN D 4 203 ? 16.144 -49.756 -0.643 1.00 62.70 ? 206 ASN D CG 1 ATOM 6154 O OD1 . ASN D 4 203 ? 17.081 -50.359 -0.119 1.00 65.35 ? 206 ASN D OD1 1 ATOM 6155 N ND2 . ASN D 4 203 ? 14.969 -50.327 -0.869 1.00 63.44 ? 206 ASN D ND2 1 ATOM 6156 N N . PRO D 4 204 ? 19.791 -48.638 -0.406 1.00 62.49 ? 207 PRO D N 1 ATOM 6157 C CA . PRO D 4 204 ? 21.060 -49.189 -0.908 1.00 64.09 ? 207 PRO D CA 1 ATOM 6158 C C . PRO D 4 204 ? 20.924 -50.520 -1.656 1.00 65.96 ? 207 PRO D C 1 ATOM 6159 O O . PRO D 4 204 ? 21.839 -50.908 -2.386 1.00 66.48 ? 207 PRO D O 1 ATOM 6160 C CB . PRO D 4 204 ? 21.893 -49.377 0.366 1.00 67.70 ? 207 PRO D CB 1 ATOM 6161 C CG . PRO D 4 204 ? 20.899 -49.470 1.465 1.00 68.91 ? 207 PRO D CG 1 ATOM 6162 C CD . PRO D 4 204 ? 19.773 -48.569 1.067 1.00 64.97 ? 207 PRO D CD 1 ATOM 6163 N N . ARG D 4 205 ? 19.796 -51.202 -1.470 1.00 67.38 ? 208 ARG D N 1 ATOM 6164 C CA . ARG D 4 205 ? 19.508 -52.453 -2.175 1.00 69.70 ? 208 ARG D CA 1 ATOM 6165 C C . ARG D 4 205 ? 19.106 -52.220 -3.638 1.00 66.79 ? 208 ARG D C 1 ATOM 6166 O O . ARG D 4 205 ? 19.124 -53.151 -4.449 1.00 68.16 ? 208 ARG D O 1 ATOM 6167 C CB . ARG D 4 205 ? 18.415 -53.241 -1.445 1.00 72.66 ? 208 ARG D CB 1 ATOM 6168 C CG . ARG D 4 205 ? 18.842 -53.817 -0.100 1.00 77.09 ? 208 ARG D CG 1 ATOM 6169 N N . ASN D 4 206 ? 18.750 -50.976 -3.964 1.00 63.16 ? 209 ASN D N 1 ATOM 6170 C CA . ASN D 4 206 ? 18.331 -50.606 -5.317 1.00 60.62 ? 209 ASN D CA 1 ATOM 6171 C C . ASN D 4 206 ? 19.494 -50.330 -6.273 1.00 59.45 ? 209 ASN D C 1 ATOM 6172 O O . ASN D 4 206 ? 20.365 -49.499 -5.996 1.00 58.31 ? 209 ASN D O 1 ATOM 6173 C CB . ASN D 4 206 ? 17.357 -49.421 -5.283 1.00 57.72 ? 209 ASN D CB 1 ATOM 6174 C CG . ASN D 4 206 ? 15.949 -49.831 -4.869 1.00 59.13 ? 209 ASN D CG 1 ATOM 6175 O OD1 . ASN D 4 206 ? 15.521 -50.965 -5.107 1.00 61.78 ? 209 ASN D OD1 1 ATOM 6176 N ND2 . ASN D 4 206 ? 15.218 -48.903 -4.257 1.00 57.09 ? 209 ASN D ND2 1 ATOM 6177 N N . HIS D 4 207 ? 19.483 -51.036 -7.401 1.00 60.13 ? 210 HIS D N 1 ATOM 6178 C CA . HIS D 4 207 ? 20.539 -50.954 -8.407 1.00 59.53 ? 210 HIS D CA 1 ATOM 6179 C C . HIS D 4 207 ? 20.030 -50.288 -9.686 1.00 56.55 ? 210 HIS D C 1 ATOM 6180 O O . HIS D 4 207 ? 18.977 -50.654 -10.211 1.00 56.74 ? 210 HIS D O 1 ATOM 6181 C CB . HIS D 4 207 ? 21.080 -52.357 -8.700 1.00 63.05 ? 210 HIS D CB 1 ATOM 6182 C CG . HIS D 4 207 ? 22.086 -52.404 -9.806 1.00 63.22 ? 210 HIS D CG 1 ATOM 6183 N ND1 . HIS D 4 207 ? 23.399 -52.023 -9.635 1.00 64.20 ? 210 HIS D ND1 1 ATOM 6184 C CD2 . HIS D 4 207 ? 21.975 -52.804 -11.095 1.00 63.60 ? 210 HIS D CD2 1 ATOM 6185 C CE1 . HIS D 4 207 ? 24.053 -52.178 -10.773 1.00 64.30 ? 210 HIS D CE1 1 ATOM 6186 N NE2 . HIS D 4 207 ? 23.211 -52.651 -11.675 1.00 63.94 ? 210 HIS D NE2 1 ATOM 6187 N N . PHE D 4 208 ? 20.785 -49.309 -10.174 1.00 54.40 ? 211 PHE D N 1 ATOM 6188 C CA . PHE D 4 208 ? 20.411 -48.548 -11.364 1.00 51.92 ? 211 PHE D CA 1 ATOM 6189 C C . PHE D 4 208 ? 21.468 -48.712 -12.446 1.00 52.15 ? 211 PHE D C 1 ATOM 6190 O O . PHE D 4 208 ? 22.662 -48.593 -12.173 1.00 52.91 ? 211 PHE D O 1 ATOM 6191 C CB . PHE D 4 208 ? 20.253 -47.064 -11.026 1.00 49.40 ? 211 PHE D CB 1 ATOM 6192 C CG . PHE D 4 208 ? 19.233 -46.785 -9.958 1.00 49.03 ? 211 PHE D CG 1 ATOM 6193 C CD1 . PHE D 4 208 ? 19.595 -46.781 -8.616 1.00 50.04 ? 211 PHE D CD1 1 ATOM 6194 C CD2 . PHE D 4 208 ? 17.915 -46.509 -10.296 1.00 48.08 ? 211 PHE D CD2 1 ATOM 6195 C CE1 . PHE D 4 208 ? 18.655 -46.520 -7.623 1.00 50.35 ? 211 PHE D CE1 1 ATOM 6196 C CE2 . PHE D 4 208 ? 16.967 -46.243 -9.312 1.00 48.62 ? 211 PHE D CE2 1 ATOM 6197 C CZ . PHE D 4 208 ? 17.339 -46.250 -7.971 1.00 49.56 ? 211 PHE D CZ 1 ATOM 6198 N N . ARG D 4 209 ? 21.027 -48.988 -13.670 1.00 52.00 ? 212 ARG D N 1 ATOM 6199 C CA . ARG D 4 209 ? 21.943 -49.189 -14.789 1.00 52.37 ? 212 ARG D CA 1 ATOM 6200 C C . ARG D 4 209 ? 21.469 -48.468 -16.046 1.00 50.54 ? 212 ARG D C 1 ATOM 6201 O O . ARG D 4 209 ? 20.289 -48.514 -16.401 1.00 50.29 ? 212 ARG D O 1 ATOM 6202 C CB . ARG D 4 209 ? 22.146 -50.682 -15.066 1.00 55.36 ? 212 ARG D CB 1 ATOM 6203 C CG . ARG D 4 209 ? 23.190 -50.990 -16.134 1.00 56.48 ? 212 ARG D CG 1 ATOM 6204 C CD . ARG D 4 209 ? 23.564 -52.467 -16.157 1.00 61.35 ? 212 ARG D CD 1 ATOM 6205 N NE . ARG D 4 209 ? 22.458 -53.328 -16.584 1.00 63.88 ? 212 ARG D NE 1 ATOM 6206 C CZ . ARG D 4 209 ? 22.197 -53.657 -17.848 1.00 64.73 ? 212 ARG D CZ 1 ATOM 6207 N NH1 . ARG D 4 209 ? 21.169 -54.448 -18.128 1.00 66.68 ? 212 ARG D NH1 1 ATOM 6208 N NH2 . ARG D 4 209 ? 22.957 -53.198 -18.835 1.00 63.63 ? 212 ARG D NH2 1 ATOM 6209 N N . CYS D 4 210 ? 22.408 -47.794 -16.703 1.00 49.79 ? 213 CYS D N 1 ATOM 6210 C CA . CYS D 4 210 ? 22.154 -47.125 -17.970 1.00 48.62 ? 213 CYS D CA 1 ATOM 6211 C C . CYS D 4 210 ? 22.793 -47.938 -19.088 1.00 49.64 ? 213 CYS D C 1 ATOM 6212 O O . CYS D 4 210 ? 24.010 -48.129 -19.107 1.00 50.50 ? 213 CYS D O 1 ATOM 6213 C CB . CYS D 4 210 ? 22.725 -45.707 -17.948 1.00 46.98 ? 213 CYS D CB 1 ATOM 6214 S SG . CYS D 4 210 ? 22.520 -44.831 -19.504 1.00 47.88 ? 213 CYS D SG 1 ATOM 6215 N N . GLN D 4 211 ? 21.967 -48.421 -20.010 1.00 49.93 ? 214 GLN D N 1 ATOM 6216 C CA . GLN D 4 211 ? 22.437 -49.290 -21.084 1.00 51.41 ? 214 GLN D CA 1 ATOM 6217 C C . GLN D 4 211 ? 22.393 -48.583 -22.434 1.00 50.33 ? 214 GLN D C 1 ATOM 6218 O O . GLN D 4 211 ? 21.349 -48.064 -22.835 1.00 49.86 ? 214 GLN D O 1 ATOM 6219 C CB . GLN D 4 211 ? 21.600 -50.568 -21.138 1.00 53.74 ? 214 GLN D CB 1 ATOM 6220 C CG . GLN D 4 211 ? 22.317 -51.741 -21.774 1.00 56.41 ? 214 GLN D CG 1 ATOM 6221 C CD . GLN D 4 211 ? 21.410 -52.930 -22.001 1.00 59.37 ? 214 GLN D CD 1 ATOM 6222 O OE1 . GLN D 4 211 ? 21.328 -53.832 -21.165 1.00 61.77 ? 214 GLN D OE1 1 ATOM 6223 N NE2 . GLN D 4 211 ? 20.714 -52.935 -23.135 1.00 59.48 ? 214 GLN D NE2 1 ATOM 6224 N N . VAL D 4 212 ? 23.529 -48.563 -23.126 1.00 50.28 ? 215 VAL D N 1 ATOM 6225 C CA . VAL D 4 212 ? 23.615 -47.947 -24.451 1.00 49.31 ? 215 VAL D CA 1 ATOM 6226 C C . VAL D 4 212 ? 24.060 -48.956 -25.513 1.00 51.15 ? 215 VAL D C 1 ATOM 6227 O O . VAL D 4 212 ? 25.211 -49.407 -25.527 1.00 52.19 ? 215 VAL D O 1 ATOM 6228 C CB . VAL D 4 212 ? 24.531 -46.699 -24.456 1.00 47.98 ? 215 VAL D CB 1 ATOM 6229 C CG1 . VAL D 4 212 ? 24.660 -46.129 -25.865 1.00 47.72 ? 215 VAL D CG1 1 ATOM 6230 C CG2 . VAL D 4 212 ? 23.996 -45.636 -23.497 1.00 46.14 ? 215 VAL D CG2 1 ATOM 6231 N N . GLN D 4 213 ? 23.124 -49.311 -26.388 1.00 51.67 ? 216 GLN D N 1 ATOM 6232 C CA . GLN D 4 213 ? 23.409 -50.155 -27.534 1.00 53.43 ? 216 GLN D CA 1 ATOM 6233 C C . GLN D 4 213 ? 23.979 -49.284 -28.645 1.00 52.73 ? 216 GLN D C 1 ATOM 6234 O O . GLN D 4 213 ? 23.351 -48.320 -29.070 1.00 51.69 ? 216 GLN D O 1 ATOM 6235 C CB . GLN D 4 213 ? 22.135 -50.867 -27.998 1.00 55.11 ? 216 GLN D CB 1 ATOM 6236 C CG . GLN D 4 213 ? 22.273 -51.661 -29.294 1.00 57.40 ? 216 GLN D CG 1 ATOM 6237 C CD . GLN D 4 213 ? 23.009 -52.976 -29.122 1.00 59.54 ? 216 GLN D CD 1 ATOM 6238 O OE1 . GLN D 4 213 ? 24.098 -53.164 -29.665 1.00 60.25 ? 216 GLN D OE1 1 ATOM 6239 N NE2 . GLN D 4 213 ? 22.414 -53.897 -28.368 1.00 60.91 ? 216 GLN D NE2 1 ATOM 6240 N N . PHE D 4 214 ? 25.180 -49.626 -29.097 1.00 53.69 ? 217 PHE D N 1 ATOM 6241 C CA . PHE D 4 214 ? 25.833 -48.917 -30.188 1.00 53.57 ? 217 PHE D CA 1 ATOM 6242 C C . PHE D 4 214 ? 25.882 -49.805 -31.421 1.00 56.12 ? 217 PHE D C 1 ATOM 6243 O O . PHE D 4 214 ? 26.071 -51.016 -31.309 1.00 58.01 ? 217 PHE D O 1 ATOM 6244 C CB . PHE D 4 214 ? 27.244 -48.498 -29.769 1.00 53.20 ? 217 PHE D CB 1 ATOM 6245 C CG . PHE D 4 214 ? 28.089 -47.954 -30.892 1.00 53.36 ? 217 PHE D CG 1 ATOM 6246 C CD1 . PHE D 4 214 ? 27.777 -46.738 -31.495 1.00 51.80 ? 217 PHE D CD1 1 ATOM 6247 C CD2 . PHE D 4 214 ? 29.210 -48.650 -31.331 1.00 54.85 ? 217 PHE D CD2 1 ATOM 6248 C CE1 . PHE D 4 214 ? 28.560 -46.232 -32.527 1.00 52.57 ? 217 PHE D CE1 1 ATOM 6249 C CE2 . PHE D 4 214 ? 29.999 -48.151 -32.360 1.00 55.61 ? 217 PHE D CE2 1 ATOM 6250 C CZ . PHE D 4 214 ? 29.673 -46.939 -32.960 1.00 54.48 ? 217 PHE D CZ 1 ATOM 6251 N N . TYR D 4 215 ? 25.697 -49.199 -32.591 1.00 56.60 ? 218 TYR D N 1 ATOM 6252 C CA . TYR D 4 215 ? 25.824 -49.911 -33.860 1.00 59.19 ? 218 TYR D CA 1 ATOM 6253 C C . TYR D 4 215 ? 27.002 -49.369 -34.649 1.00 59.79 ? 218 TYR D C 1 ATOM 6254 O O . TYR D 4 215 ? 27.082 -48.170 -34.924 1.00 58.73 ? 218 TYR D O 1 ATOM 6255 C CB . TYR D 4 215 ? 24.531 -49.826 -34.677 1.00 60.03 ? 218 TYR D CB 1 ATOM 6256 C CG . TYR D 4 215 ? 23.366 -50.514 -34.009 1.00 60.41 ? 218 TYR D CG 1 ATOM 6257 C CD1 . TYR D 4 215 ? 22.499 -49.805 -33.178 1.00 58.48 ? 218 TYR D CD1 1 ATOM 6258 C CD2 . TYR D 4 215 ? 23.142 -51.878 -34.190 1.00 62.91 ? 218 TYR D CD2 1 ATOM 6259 C CE1 . TYR D 4 215 ? 21.433 -50.436 -32.551 1.00 59.42 ? 218 TYR D CE1 1 ATOM 6260 C CE2 . TYR D 4 215 ? 22.078 -52.520 -33.568 1.00 63.93 ? 218 TYR D CE2 1 ATOM 6261 C CZ . TYR D 4 215 ? 21.229 -51.793 -32.750 1.00 62.27 ? 218 TYR D CZ 1 ATOM 6262 O OH . TYR D 4 215 ? 20.174 -52.420 -32.131 1.00 64.04 ? 218 TYR D OH 1 ATOM 6263 N N . GLY D 4 216 ? 27.923 -50.262 -34.990 1.00 62.05 ? 219 GLY D N 1 ATOM 6264 C CA . GLY D 4 216 ? 29.109 -49.901 -35.748 1.00 63.36 ? 219 GLY D CA 1 ATOM 6265 C C . GLY D 4 216 ? 29.506 -51.004 -36.703 1.00 66.62 ? 219 GLY D C 1 ATOM 6266 O O . GLY D 4 216 ? 28.689 -51.473 -37.496 1.00 67.97 ? 219 GLY D O 1 ATOM 6267 N N . LEU D 4 217 ? 30.764 -51.421 -36.609 1.00 68.32 ? 220 LEU D N 1 ATOM 6268 C CA . LEU D 4 217 ? 31.337 -52.416 -37.505 1.00 71.83 ? 220 LEU D CA 1 ATOM 6269 C C . LEU D 4 217 ? 30.823 -53.826 -37.223 1.00 74.04 ? 220 LEU D C 1 ATOM 6270 O O . LEU D 4 217 ? 30.397 -54.133 -36.106 1.00 73.18 ? 220 LEU D O 1 ATOM 6271 C CB . LEU D 4 217 ? 32.867 -52.378 -37.425 1.00 73.16 ? 220 LEU D CB 1 ATOM 6272 C CG . LEU D 4 217 ? 33.609 -51.363 -38.303 1.00 73.29 ? 220 LEU D CG 1 ATOM 6273 C CD1 . LEU D 4 217 ? 33.512 -49.949 -37.766 1.00 70.40 ? 220 LEU D CD1 1 ATOM 6274 C CD2 . LEU D 4 217 ? 35.065 -51.765 -38.436 1.00 76.39 ? 220 LEU D CD2 1 ATOM 6275 N N . SER D 4 218 ? 30.861 -54.668 -38.255 1.00 77.37 ? 221 SER D N 1 ATOM 6276 C CA . SER D 4 218 ? 30.448 -56.068 -38.158 1.00 80.52 ? 221 SER D CA 1 ATOM 6277 C C . SER D 4 218 ? 31.657 -57.005 -38.231 1.00 83.99 ? 221 SER D C 1 ATOM 6278 O O . SER D 4 218 ? 32.780 -56.560 -38.476 1.00 84.21 ? 221 SER D O 1 ATOM 6279 C CB . SER D 4 218 ? 29.439 -56.402 -39.260 1.00 82.23 ? 221 SER D CB 1 ATOM 6280 O OG . SER D 4 218 ? 28.266 -55.617 -39.126 1.00 80.03 ? 221 SER D OG 1 ATOM 6281 N N . GLU D 4 219 ? 31.419 -58.298 -38.020 1.00 87.28 ? 222 GLU D N 1 ATOM 6282 C CA . GLU D 4 219 ? 32.487 -59.301 -37.976 1.00 91.35 ? 222 GLU D CA 1 ATOM 6283 C C . GLU D 4 219 ? 33.359 -59.346 -39.240 1.00 93.84 ? 222 GLU D C 1 ATOM 6284 O O . GLU D 4 219 ? 34.570 -59.561 -39.154 1.00 95.74 ? 222 GLU D O 1 ATOM 6285 C CB . GLU D 4 219 ? 31.906 -60.689 -37.683 1.00 94.82 ? 222 GLU D CB 1 ATOM 6286 N N . ASN D 4 220 ? 32.739 -59.134 -40.401 1.00 94.24 ? 223 ASN D N 1 ATOM 6287 C CA . ASN D 4 220 ? 33.437 -59.205 -41.690 1.00 96.88 ? 223 ASN D CA 1 ATOM 6288 C C . ASN D 4 220 ? 34.098 -57.892 -42.134 1.00 94.68 ? 223 ASN D C 1 ATOM 6289 O O . ASN D 4 220 ? 34.776 -57.854 -43.166 1.00 96.74 ? 223 ASN D O 1 ATOM 6290 C CB . ASN D 4 220 ? 32.496 -59.729 -42.782 1.00 99.08 ? 223 ASN D CB 1 ATOM 6291 N N . ASP D 4 221 ? 33.901 -56.827 -41.355 1.00 90.89 ? 224 ASP D N 1 ATOM 6292 C CA . ASP D 4 221 ? 34.523 -55.528 -41.634 1.00 89.09 ? 224 ASP D CA 1 ATOM 6293 C C . ASP D 4 221 ? 36.000 -55.526 -41.242 1.00 90.57 ? 224 ASP D C 1 ATOM 6294 O O . ASP D 4 221 ? 36.359 -55.956 -40.144 1.00 90.76 ? 224 ASP D O 1 ATOM 6295 C CB . ASP D 4 221 ? 33.782 -54.396 -40.908 1.00 84.94 ? 224 ASP D CB 1 ATOM 6296 C CG . ASP D 4 221 ? 32.421 -54.085 -41.521 1.00 83.87 ? 224 ASP D CG 1 ATOM 6297 O OD1 . ASP D 4 221 ? 32.187 -54.432 -42.699 1.00 86.26 ? 224 ASP D OD1 1 ATOM 6298 O OD2 . ASP D 4 221 ? 31.583 -53.480 -40.819 1.00 80.82 ? 224 ASP D OD2 1 ATOM 6299 N N . GLU D 4 222 ? 36.847 -55.037 -42.146 1.00 92.10 ? 225 GLU D N 1 ATOM 6300 C CA . GLU D 4 222 ? 38.297 -55.028 -41.939 1.00 94.40 ? 225 GLU D CA 1 ATOM 6301 C C . GLU D 4 222 ? 38.753 -53.861 -41.064 1.00 92.10 ? 225 GLU D C 1 ATOM 6302 O O . GLU D 4 222 ? 38.354 -52.713 -41.281 1.00 89.56 ? 225 GLU D O 1 ATOM 6303 C CB . GLU D 4 222 ? 39.034 -55.010 -43.282 1.00 97.33 ? 225 GLU D CB 1 ATOM 6304 N N . TRP D 4 223 ? 39.593 -54.172 -40.078 1.00 93.54 ? 226 TRP D N 1 ATOM 6305 C CA . TRP D 4 223 ? 40.124 -53.178 -39.145 1.00 92.20 ? 226 TRP D CA 1 ATOM 6306 C C . TRP D 4 223 ? 41.627 -53.367 -38.938 1.00 96.08 ? 226 TRP D C 1 ATOM 6307 O O . TRP D 4 223 ? 42.102 -54.490 -38.750 1.00 99.25 ? 226 TRP D O 1 ATOM 6308 C CB . TRP D 4 223 ? 39.385 -53.253 -37.807 1.00 89.58 ? 226 TRP D CB 1 ATOM 6309 C CG . TRP D 4 223 ? 39.739 -52.149 -36.861 1.00 87.92 ? 226 TRP D CG 1 ATOM 6310 C CD1 . TRP D 4 223 ? 40.561 -52.233 -35.774 1.00 89.39 ? 226 TRP D CD1 1 ATOM 6311 C CD2 . TRP D 4 223 ? 39.285 -50.791 -36.918 1.00 84.92 ? 226 TRP D CD2 1 ATOM 6312 N NE1 . TRP D 4 223 ? 40.646 -51.012 -35.149 1.00 87.60 ? 226 TRP D NE1 1 ATOM 6313 C CE2 . TRP D 4 223 ? 39.873 -50.109 -35.830 1.00 84.76 ? 226 TRP D CE2 1 ATOM 6314 C CE3 . TRP D 4 223 ? 38.438 -50.084 -37.783 1.00 82.66 ? 226 TRP D CE3 1 ATOM 6315 C CZ2 . TRP D 4 223 ? 39.642 -48.751 -35.582 1.00 82.48 ? 226 TRP D CZ2 1 ATOM 6316 C CZ3 . TRP D 4 223 ? 38.209 -48.735 -37.538 1.00 80.49 ? 226 TRP D CZ3 1 ATOM 6317 C CH2 . TRP D 4 223 ? 38.809 -48.084 -36.445 1.00 80.46 ? 226 TRP D CH2 1 ATOM 6318 N N . THR D 4 224 ? 42.365 -52.259 -38.966 1.00 96.32 ? 227 THR D N 1 ATOM 6319 C CA . THR D 4 224 ? 43.829 -52.298 -38.927 1.00 100.64 ? 227 THR D CA 1 ATOM 6320 C C . THR D 4 224 ? 44.447 -51.428 -37.834 1.00 100.62 ? 227 THR D C 1 ATOM 6321 O O . THR D 4 224 ? 45.572 -51.684 -37.398 1.00 104.42 ? 227 THR D O 1 ATOM 6322 C CB . THR D 4 224 ? 44.443 -51.882 -40.287 1.00 102.88 ? 227 THR D CB 1 ATOM 6323 O OG1 . THR D 4 224 ? 43.834 -50.665 -40.741 1.00 99.88 ? 227 THR D OG1 1 ATOM 6324 C CG2 . THR D 4 224 ? 44.243 -52.974 -41.335 1.00 104.84 ? 227 THR D CG2 1 ATOM 6325 N N . GLN D 4 225 ? 43.710 -50.408 -37.395 1.00 96.86 ? 228 GLN D N 1 ATOM 6326 C CA . GLN D 4 225 ? 44.231 -49.399 -36.465 1.00 96.90 ? 228 GLN D CA 1 ATOM 6327 C C . GLN D 4 225 ? 44.630 -49.963 -35.099 1.00 98.26 ? 228 GLN D C 1 ATOM 6328 O O . GLN D 4 225 ? 44.125 -51.006 -34.675 1.00 97.81 ? 228 GLN D O 1 ATOM 6329 C CB . GLN D 4 225 ? 43.233 -48.241 -36.301 1.00 92.62 ? 228 GLN D CB 1 ATOM 6330 C CG . GLN D 4 225 ? 42.797 -47.566 -37.611 1.00 91.94 ? 228 GLN D CG 1 ATOM 6331 C CD . GLN D 4 225 ? 43.904 -46.757 -38.284 1.00 95.66 ? 228 GLN D CD 1 ATOM 6332 O OE1 . GLN D 4 225 ? 44.934 -47.299 -38.698 1.00 99.39 ? 228 GLN D OE1 1 ATOM 6333 N NE2 . GLN D 4 225 ? 43.682 -45.454 -38.412 1.00 94.77 ? 228 GLN D NE2 1 ATOM 6334 N N . ASP D 4 226 ? 45.538 -49.258 -34.425 1.00 100.37 ? 229 ASP D N 1 ATOM 6335 C CA . ASP D 4 226 ? 46.115 -49.703 -33.152 1.00 102.79 ? 229 ASP D CA 1 ATOM 6336 C C . ASP D 4 226 ? 45.104 -49.868 -32.014 1.00 99.24 ? 229 ASP D C 1 ATOM 6337 O O . ASP D 4 226 ? 45.237 -50.780 -31.196 1.00 101.01 ? 229 ASP D O 1 ATOM 6338 C CB . ASP D 4 226 ? 47.251 -48.766 -32.720 1.00 106.07 ? 229 ASP D CB 1 ATOM 6339 C CG . ASP D 4 226 ? 48.505 -48.920 -33.578 1.00 111.49 ? 229 ASP D CG 1 ATOM 6340 O OD1 . ASP D 4 226 ? 48.790 -50.044 -34.052 1.00 113.91 ? 229 ASP D OD1 1 ATOM 6341 O OD2 . ASP D 4 226 ? 49.217 -47.912 -33.772 1.00 113.67 ? 229 ASP D OD2 1 ATOM 6342 N N . ARG D 4 227 ? 44.103 -48.992 -31.966 1.00 94.64 ? 230 ARG D N 1 ATOM 6343 C CA . ARG D 4 227 ? 43.082 -49.045 -30.917 1.00 91.22 ? 230 ARG D CA 1 ATOM 6344 C C . ARG D 4 227 ? 42.065 -50.171 -31.150 1.00 89.35 ? 230 ARG D C 1 ATOM 6345 O O . ARG D 4 227 ? 42.064 -50.807 -32.208 1.00 90.41 ? 230 ARG D O 1 ATOM 6346 C CB . ARG D 4 227 ? 42.378 -47.687 -30.766 1.00 87.60 ? 230 ARG D CB 1 ATOM 6347 C CG . ARG D 4 227 ? 41.332 -47.384 -31.829 1.00 84.37 ? 230 ARG D CG 1 ATOM 6348 C CD . ARG D 4 227 ? 40.690 -46.028 -31.601 1.00 81.53 ? 230 ARG D CD 1 ATOM 6349 N NE . ARG D 4 227 ? 39.406 -45.910 -32.291 1.00 78.58 ? 230 ARG D NE 1 ATOM 6350 C CZ . ARG D 4 227 ? 39.258 -45.544 -33.562 1.00 78.60 ? 230 ARG D CZ 1 ATOM 6351 N NH1 . ARG D 4 227 ? 40.320 -45.258 -34.307 1.00 81.88 ? 230 ARG D NH1 1 ATOM 6352 N NH2 . ARG D 4 227 ? 38.045 -45.464 -34.091 1.00 75.59 ? 230 ARG D NH2 1 ATOM 6353 N N . ALA D 4 228 ? 41.207 -50.402 -30.156 1.00 86.84 ? 231 ALA D N 1 ATOM 6354 C CA . ALA D 4 228 ? 40.213 -51.476 -30.195 1.00 85.43 ? 231 ALA D CA 1 ATOM 6355 C C . ALA D 4 228 ? 39.236 -51.326 -31.360 1.00 82.59 ? 231 ALA D C 1 ATOM 6356 O O . ALA D 4 228 ? 38.896 -50.208 -31.753 1.00 80.28 ? 231 ALA D O 1 ATOM 6357 C CB . ALA D 4 228 ? 39.460 -51.547 -28.874 1.00 83.45 ? 231 ALA D CB 1 ATOM 6358 N N . LYS D 4 229 ? 38.800 -52.462 -31.906 1.00 83.31 ? 232 LYS D N 1 ATOM 6359 C CA . LYS D 4 229 ? 37.854 -52.497 -33.021 1.00 81.22 ? 232 LYS D CA 1 ATOM 6360 C C . LYS D 4 229 ? 36.480 -52.007 -32.560 1.00 77.08 ? 232 LYS D C 1 ATOM 6361 O O . LYS D 4 229 ? 35.917 -52.553 -31.607 1.00 76.63 ? 232 LYS D O 1 ATOM 6362 C CB . LYS D 4 229 ? 37.761 -53.917 -33.592 1.00 84.02 ? 232 LYS D CB 1 ATOM 6363 C CG . LYS D 4 229 ? 37.056 -54.023 -34.939 1.00 83.44 ? 232 LYS D CG 1 ATOM 6364 N N . PRO D 4 230 ? 35.940 -50.970 -33.231 1.00 74.41 ? 233 PRO D N 1 ATOM 6365 C CA . PRO D 4 230 ? 34.688 -50.326 -32.818 1.00 70.71 ? 233 PRO D CA 1 ATOM 6366 C C . PRO D 4 230 ? 33.435 -51.070 -33.290 1.00 69.94 ? 233 PRO D C 1 ATOM 6367 O O . PRO D 4 230 ? 32.635 -50.526 -34.056 1.00 68.52 ? 233 PRO D O 1 ATOM 6368 C CB . PRO D 4 230 ? 34.781 -48.943 -33.463 1.00 69.51 ? 233 PRO D CB 1 ATOM 6369 C CG . PRO D 4 230 ? 35.645 -49.137 -34.670 1.00 72.23 ? 233 PRO D CG 1 ATOM 6370 C CD . PRO D 4 230 ? 36.503 -50.355 -34.448 1.00 75.31 ? 233 PRO D CD 1 ATOM 6371 N N . VAL D 4 231 ? 33.271 -52.300 -32.809 1.00 71.23 ? 234 VAL D N 1 ATOM 6372 C CA . VAL D 4 231 ? 32.159 -53.169 -33.203 1.00 71.42 ? 234 VAL D CA 1 ATOM 6373 C C . VAL D 4 231 ? 30.834 -52.773 -32.551 1.00 68.54 ? 234 VAL D C 1 ATOM 6374 O O . VAL D 4 231 ? 30.795 -51.902 -31.679 1.00 66.22 ? 234 VAL D O 1 ATOM 6375 C CB . VAL D 4 231 ? 32.456 -54.663 -32.885 1.00 74.79 ? 234 VAL D CB 1 ATOM 6376 C CG1 . VAL D 4 231 ? 33.485 -55.233 -33.857 1.00 78.10 ? 234 VAL D CG1 1 ATOM 6377 C CG2 . VAL D 4 231 ? 32.908 -54.841 -31.433 1.00 74.99 ? 234 VAL D CG2 1 ATOM 6378 N N . THR D 4 232 ? 29.756 -53.418 -32.995 1.00 68.99 ? 235 THR D N 1 ATOM 6379 C CA . THR D 4 232 ? 28.442 -53.293 -32.370 1.00 67.03 ? 235 THR D CA 1 ATOM 6380 C C . THR D 4 232 ? 28.504 -53.909 -30.975 1.00 67.20 ? 235 THR D C 1 ATOM 6381 O O . THR D 4 232 ? 28.821 -55.090 -30.816 1.00 70.08 ? 235 THR D O 1 ATOM 6382 C CB . THR D 4 232 ? 27.352 -53.975 -33.222 1.00 68.72 ? 235 THR D CB 1 ATOM 6383 O OG1 . THR D 4 232 ? 27.290 -53.342 -34.506 1.00 68.71 ? 235 THR D OG1 1 ATOM 6384 C CG2 . THR D 4 232 ? 25.984 -53.882 -32.552 1.00 67.51 ? 235 THR D CG2 1 ATOM 6385 N N . GLN D 4 233 ? 28.211 -53.093 -29.969 1.00 64.42 ? 236 GLN D N 1 ATOM 6386 C CA . GLN D 4 233 ? 28.424 -53.471 -28.576 1.00 64.44 ? 236 GLN D CA 1 ATOM 6387 C C . GLN D 4 233 ? 27.467 -52.758 -27.627 1.00 61.80 ? 236 GLN D C 1 ATOM 6388 O O . GLN D 4 233 ? 26.860 -51.745 -27.978 1.00 59.48 ? 236 GLN D O 1 ATOM 6389 C CB . GLN D 4 233 ? 29.871 -53.166 -28.168 1.00 64.79 ? 236 GLN D CB 1 ATOM 6390 C CG . GLN D 4 233 ? 30.257 -51.699 -28.320 1.00 61.82 ? 236 GLN D CG 1 ATOM 6391 C CD . GLN D 4 233 ? 31.703 -51.427 -27.973 1.00 62.60 ? 236 GLN D CD 1 ATOM 6392 O OE1 . GLN D 4 233 ? 32.536 -51.242 -28.858 1.00 64.00 ? 236 GLN D OE1 1 ATOM 6393 N NE2 . GLN D 4 233 ? 32.012 -51.401 -26.681 1.00 62.32 ? 236 GLN D NE2 1 ATOM 6394 N N . ILE D 4 234 ? 27.345 -53.303 -26.421 1.00 62.52 ? 237 ILE D N 1 ATOM 6395 C CA . ILE D 4 234 ? 26.618 -52.653 -25.342 1.00 60.30 ? 237 ILE D CA 1 ATOM 6396 C C . ILE D 4 234 ? 27.621 -52.072 -24.343 1.00 59.69 ? 237 ILE D C 1 ATOM 6397 O O . ILE D 4 234 ? 28.508 -52.778 -23.854 1.00 61.81 ? 237 ILE D O 1 ATOM 6398 C CB . ILE D 4 234 ? 25.650 -53.635 -24.636 1.00 61.84 ? 237 ILE D CB 1 ATOM 6399 C CG1 . ILE D 4 234 ? 24.512 -54.036 -25.580 1.00 62.48 ? 237 ILE D CG1 1 ATOM 6400 C CG2 . ILE D 4 234 ? 25.091 -53.021 -23.357 1.00 59.96 ? 237 ILE D CG2 1 ATOM 6401 C CD1 . ILE D 4 234 ? 23.785 -55.314 -25.174 1.00 65.53 ? 237 ILE D CD1 1 ATOM 6402 N N . VAL D 4 235 ? 27.479 -50.776 -24.070 1.00 57.17 ? 238 VAL D N 1 ATOM 6403 C CA . VAL D 4 235 ? 28.285 -50.080 -23.066 1.00 56.76 ? 238 VAL D CA 1 ATOM 6404 C C . VAL D 4 235 ? 27.361 -49.597 -21.950 1.00 55.28 ? 238 VAL D C 1 ATOM 6405 O O . VAL D 4 235 ? 26.319 -48.992 -22.219 1.00 53.35 ? 238 VAL D O 1 ATOM 6406 C CB . VAL D 4 235 ? 29.064 -48.880 -23.667 1.00 55.59 ? 238 VAL D CB 1 ATOM 6407 C CG1 . VAL D 4 235 ? 30.121 -48.387 -22.692 1.00 56.17 ? 238 VAL D CG1 1 ATOM 6408 C CG2 . VAL D 4 235 ? 29.712 -49.253 -24.998 1.00 56.86 ? 238 VAL D CG2 1 ATOM 6409 N N . SER D 4 236 ? 27.743 -49.867 -20.702 1.00 56.72 ? 239 SER D N 1 ATOM 6410 C CA . SER D 4 236 ? 26.894 -49.565 -19.546 1.00 55.90 ? 239 SER D CA 1 ATOM 6411 C C . SER D 4 236 ? 27.610 -48.849 -18.409 1.00 56.12 ? 239 SER D C 1 ATOM 6412 O O . SER D 4 236 ? 28.772 -49.134 -18.109 1.00 58.42 ? 239 SER D O 1 ATOM 6413 C CB . SER D 4 236 ? 26.259 -50.846 -19.000 1.00 57.74 ? 239 SER D CB 1 ATOM 6414 O OG . SER D 4 236 ? 25.402 -51.438 -19.956 1.00 58.51 ? 239 SER D OG 1 ATOM 6415 N N . ALA D 4 237 ? 26.895 -47.920 -17.780 1.00 54.37 ? 240 ALA D N 1 ATOM 6416 C CA . ALA D 4 237 ? 27.320 -47.316 -16.524 1.00 54.90 ? 240 ALA D CA 1 ATOM 6417 C C . ALA D 4 237 ? 26.250 -47.571 -15.465 1.00 54.94 ? 240 ALA D C 1 ATOM 6418 O O . ALA D 4 237 ? 25.060 -47.636 -15.781 1.00 53.59 ? 240 ALA D O 1 ATOM 6419 C CB . ALA D 4 237 ? 27.563 -45.837 -16.700 1.00 53.16 ? 240 ALA D CB 1 ATOM 6420 N N . GLU D 4 238 ? 26.677 -47.722 -14.213 1.00 57.11 ? 241 GLU D N 1 ATOM 6421 C CA . GLU D 4 238 ? 25.770 -48.094 -13.124 1.00 57.86 ? 241 GLU D CA 1 ATOM 6422 C C . GLU D 4 238 ? 26.017 -47.334 -11.818 1.00 58.31 ? 241 GLU D C 1 ATOM 6423 O O . GLU D 4 238 ? 27.110 -46.814 -11.584 1.00 59.27 ? 241 GLU D O 1 ATOM 6424 C CB . GLU D 4 238 ? 25.806 -49.612 -12.882 1.00 60.83 ? 241 GLU D CB 1 ATOM 6425 C CG . GLU D 4 238 ? 27.203 -50.202 -12.674 1.00 64.46 ? 241 GLU D CG 1 ATOM 6426 C CD . GLU D 4 238 ? 27.202 -51.722 -12.533 1.00 68.59 ? 241 GLU D CD 1 ATOM 6427 O OE1 . GLU D 4 238 ? 26.277 -52.389 -13.054 1.00 68.41 ? 241 GLU D OE1 1 ATOM 6428 O OE2 . GLU D 4 238 ? 28.142 -52.253 -11.904 1.00 72.03 ? 241 GLU D OE2 1 ATOM 6429 N N . ALA D 4 239 ? 24.979 -47.272 -10.986 1.00 58.12 ? 242 ALA D N 1 ATOM 6430 C CA . ALA D 4 239 ? 25.028 -46.617 -9.681 1.00 58.81 ? 242 ALA D CA 1 ATOM 6431 C C . ALA D 4 239 ? 24.134 -47.333 -8.672 1.00 60.31 ? 242 ALA D C 1 ATOM 6432 O O . ALA D 4 239 ? 23.061 -47.835 -9.018 1.00 59.67 ? 242 ALA D O 1 ATOM 6433 C CB . ALA D 4 239 ? 24.621 -45.157 -9.800 1.00 56.15 ? 242 ALA D CB 1 ATOM 6434 N N . TRP D 4 240 ? 24.588 -47.373 -7.423 1.00 62.86 ? 243 TRP D N 1 ATOM 6435 C CA . TRP D 4 240 ? 23.832 -47.983 -6.336 1.00 64.85 ? 243 TRP D CA 1 ATOM 6436 C C . TRP D 4 240 ? 23.178 -46.932 -5.441 1.00 63.69 ? 243 TRP D C 1 ATOM 6437 O O . TRP D 4 240 ? 23.660 -45.800 -5.340 1.00 62.58 ? 243 TRP D O 1 ATOM 6438 C CB . TRP D 4 240 ? 24.742 -48.890 -5.508 1.00 69.00 ? 243 TRP D CB 1 ATOM 6439 C CG . TRP D 4 240 ? 25.147 -50.140 -6.228 1.00 71.48 ? 243 TRP D CG 1 ATOM 6440 C CD1 . TRP D 4 240 ? 26.174 -50.278 -7.117 1.00 72.17 ? 243 TRP D CD1 1 ATOM 6441 C CD2 . TRP D 4 240 ? 24.530 -51.429 -6.122 1.00 73.98 ? 243 TRP D CD2 1 ATOM 6442 N NE1 . TRP D 4 240 ? 26.237 -51.574 -7.571 1.00 74.75 ? 243 TRP D NE1 1 ATOM 6443 C CE2 . TRP D 4 240 ? 25.240 -52.302 -6.977 1.00 76.02 ? 243 TRP D CE2 1 ATOM 6444 C CE3 . TRP D 4 240 ? 23.446 -51.931 -5.388 1.00 75.19 ? 243 TRP D CE3 1 ATOM 6445 C CZ2 . TRP D 4 240 ? 24.901 -53.653 -7.119 1.00 79.29 ? 243 TRP D CZ2 1 ATOM 6446 C CZ3 . TRP D 4 240 ? 23.109 -53.275 -5.528 1.00 78.59 ? 243 TRP D CZ3 1 ATOM 6447 C CH2 . TRP D 4 240 ? 23.837 -54.120 -6.388 1.00 80.63 ? 243 TRP D CH2 1 ATOM 6448 N N . GLY D 4 241 ? 22.077 -47.318 -4.801 1.00 64.48 ? 244 GLY D N 1 ATOM 6449 C CA . GLY D 4 241 ? 21.367 -46.454 -3.860 1.00 64.15 ? 244 GLY D CA 1 ATOM 6450 C C . GLY D 4 241 ? 22.205 -46.092 -2.649 1.00 66.66 ? 244 GLY D C 1 ATOM 6451 O O . GLY D 4 241 ? 23.095 -46.847 -2.251 1.00 69.65 ? 244 GLY D O 1 ATOM 6452 N N . ARG D 4 242 ? 21.911 -44.933 -2.064 1.00 65.97 ? 245 ARG D N 1 ATOM 6453 C CA . ARG D 4 242 ? 22.710 -44.377 -0.972 1.00 68.46 ? 245 ARG D CA 1 ATOM 6454 C C . ARG D 4 242 ? 21.854 -43.829 0.164 1.00 68.89 ? 245 ARG D C 1 ATOM 6455 O O . ARG D 4 242 ? 21.003 -42.963 -0.053 1.00 66.63 ? 245 ARG D O 1 ATOM 6456 C CB . ARG D 4 242 ? 23.610 -43.258 -1.502 1.00 67.40 ? 245 ARG D CB 1 ATOM 6457 C CG . ARG D 4 242 ? 25.089 -43.601 -1.606 1.00 70.40 ? 245 ARG D CG 1 ATOM 6458 C CD . ARG D 4 242 ? 25.827 -42.614 -2.513 1.00 69.84 ? 245 ARG D CD 1 ATOM 6459 N NE . ARG D 4 242 ? 25.067 -41.382 -2.744 1.00 67.52 ? 245 ARG D NE 1 ATOM 6460 C CZ . ARG D 4 242 ? 25.475 -40.370 -3.507 1.00 66.67 ? 245 ARG D CZ 1 ATOM 6461 N NH1 . ARG D 4 242 ? 26.653 -40.422 -4.118 1.00 68.09 ? 245 ARG D NH1 1 ATOM 6462 N NH2 . ARG D 4 242 ? 24.703 -39.301 -3.659 1.00 64.57 ? 245 ARG D NH2 1 ATOM 6463 N N . ALA D 4 243 ? 22.097 -44.330 1.372 1.00 72.43 ? 246 ALA D N 1 ATOM 6464 C CA . ALA D 4 243 ? 21.456 -43.807 2.575 1.00 73.54 ? 246 ALA D CA 1 ATOM 6465 C C . ALA D 4 243 ? 22.152 -42.523 3.026 1.00 74.06 ? 246 ALA D C 1 ATOM 6466 O O . ALA D 4 243 ? 21.538 -41.453 3.048 1.00 72.20 ? 246 ALA D O 1 ATOM 6467 C CB . ALA D 4 243 ? 21.473 -44.851 3.685 1.00 77.32 ? 246 ALA D CB 1 ATOM 6468 N N . ASP D 4 244 ? 23.438 -42.651 3.367 1.00 77.27 ? 247 ASP D N 1 ATOM 6469 C CA . ASP D 4 244 ? 24.299 -41.543 3.821 1.00 78.90 ? 247 ASP D CA 1 ATOM 6470 C C . ASP D 4 244 ? 23.805 -40.827 5.078 1.00 80.21 ? 247 ASP D C 1 ATOM 6471 O O . ASP D 4 244 ? 24.567 -40.632 6.028 1.00 83.78 ? 247 ASP D O 1 ATOM 6472 C CB . ASP D 4 244 ? 24.561 -40.539 2.689 1.00 76.22 ? 247 ASP D CB 1 ATOM 6473 C CG . ASP D 4 244 ? 25.488 -41.095 1.619 1.00 76.55 ? 247 ASP D CG 1 ATOM 6474 O OD1 . ASP D 4 244 ? 26.509 -41.728 1.971 1.00 79.94 ? 247 ASP D OD1 1 ATOM 6475 O OD2 . ASP D 4 244 ? 25.197 -40.892 0.422 1.00 74.12 ? 247 ASP D OD2 1 HETATM 6476 C C1 . NAG E 5 . ? 9.427 -48.964 -78.180 1.00 85.61 ? 400 NAG A C1 1 HETATM 6477 C C2 . NAG E 5 . ? 10.903 -48.792 -78.533 1.00 91.65 ? 400 NAG A C2 1 HETATM 6478 C C3 . NAG E 5 . ? 11.159 -47.406 -79.129 1.00 93.43 ? 400 NAG A C3 1 HETATM 6479 C C4 . NAG E 5 . ? 10.144 -46.996 -80.211 1.00 91.36 ? 400 NAG A C4 1 HETATM 6480 C C5 . NAG E 5 . ? 8.712 -47.450 -79.858 1.00 86.15 ? 400 NAG A C5 1 HETATM 6481 C C6 . NAG E 5 . ? 7.745 -47.356 -81.038 1.00 84.03 ? 400 NAG A C6 1 HETATM 6482 C C7 . NAG E 5 . ? 12.273 -50.195 -77.054 1.00 95.91 ? 400 NAG A C7 1 HETATM 6483 C C8 . NAG E 5 . ? 13.128 -50.232 -75.820 1.00 98.39 ? 400 NAG A C8 1 HETATM 6484 N N2 . NAG E 5 . ? 11.751 -49.007 -77.371 1.00 94.16 ? 400 NAG A N2 1 HETATM 6485 O O3 . NAG E 5 . ? 12.468 -47.371 -79.656 1.00 97.98 ? 400 NAG A O3 1 HETATM 6486 O O4 . NAG E 5 . ? 10.205 -45.580 -80.353 1.00 93.03 ? 400 NAG A O4 1 HETATM 6487 O O5 . NAG E 5 . ? 8.681 -48.782 -79.366 1.00 84.96 ? 400 NAG A O5 1 HETATM 6488 O O6 . NAG E 5 . ? 7.787 -48.542 -81.800 1.00 84.16 ? 400 NAG A O6 1 HETATM 6489 O O7 . NAG E 5 . ? 12.086 -51.225 -77.706 1.00 95.61 ? 400 NAG A O7 1 HETATM 6490 C C1 . NAG F 5 . ? 10.516 -45.088 -81.688 1.00 95.66 ? 401 NAG A C1 1 HETATM 6491 C C2 . NAG F 5 . ? 11.984 -45.308 -82.083 1.00 100.79 ? 401 NAG A C2 1 HETATM 6492 C C3 . NAG F 5 . ? 12.279 -44.857 -83.517 1.00 103.67 ? 401 NAG A C3 1 HETATM 6493 C C4 . NAG F 5 . ? 11.186 -45.281 -84.502 1.00 100.78 ? 401 NAG A C4 1 HETATM 6494 C C5 . NAG F 5 . ? 9.804 -44.932 -83.951 1.00 95.96 ? 401 NAG A C5 1 HETATM 6495 C C6 . NAG F 5 . ? 8.682 -45.379 -84.882 1.00 93.43 ? 401 NAG A C6 1 HETATM 6496 N N2 . NAG F 5 . ? 12.850 -44.609 -81.154 1.00 103.38 ? 401 NAG A N2 1 HETATM 6497 O O3 . NAG F 5 . ? 13.522 -45.382 -83.932 1.00 108.01 ? 401 NAG A O3 1 HETATM 6498 O O4 . NAG F 5 . ? 11.396 -44.643 -85.742 1.00 103.40 ? 401 NAG A O4 1 HETATM 6499 O O5 . NAG F 5 . ? 9.640 -45.564 -82.697 1.00 93.83 ? 401 NAG A O5 1 HETATM 6500 O O6 . NAG F 5 . ? 7.455 -45.325 -84.187 1.00 89.09 ? 401 NAG A O6 1 HETATM 6501 C C1 . NAG G 5 . ? -0.033 -40.274 -76.600 1.00 64.10 ? 314 NAG A C1 1 HETATM 6502 C C2 . NAG G 5 . ? 1.425 -40.088 -77.049 1.00 67.52 ? 314 NAG A C2 1 HETATM 6503 C C3 . NAG G 5 . ? 2.372 -39.800 -75.883 1.00 69.94 ? 314 NAG A C3 1 HETATM 6504 C C4 . NAG G 5 . ? 1.777 -38.603 -75.143 1.00 70.44 ? 314 NAG A C4 1 HETATM 6505 C C5 . NAG G 5 . ? 0.447 -39.044 -74.518 1.00 67.14 ? 314 NAG A C5 1 HETATM 6506 C C6 . NAG G 5 . ? -0.210 -37.954 -73.675 1.00 67.61 ? 314 NAG A C6 1 HETATM 6507 C C7 . NAG G 5 . ? 2.401 -41.190 -79.031 1.00 68.61 ? 314 NAG A C7 1 HETATM 6508 C C8 . NAG G 5 . ? 2.539 -39.852 -79.702 1.00 70.41 ? 314 NAG A C8 1 HETATM 6509 N N2 . NAG G 5 . ? 1.878 -41.246 -77.801 1.00 67.23 ? 314 NAG A N2 1 HETATM 6510 O O3 . NAG G 5 . ? 3.665 -39.499 -76.357 1.00 73.21 ? 314 NAG A O3 1 HETATM 6511 O O4 . NAG G 5 . ? 2.666 -37.862 -74.301 1.00 73.80 ? 314 NAG A O4 1 HETATM 6512 O O5 . NAG G 5 . ? -0.450 -39.384 -75.564 1.00 64.74 ? 314 NAG A O5 1 HETATM 6513 O O6 . NAG G 5 . ? -0.589 -36.869 -74.497 1.00 69.16 ? 314 NAG A O6 1 HETATM 6514 O O7 . NAG G 5 . ? 2.770 -42.202 -79.624 1.00 68.74 ? 314 NAG A O7 1 HETATM 6515 C C1 . NAG H 5 . ? 3.402 -38.528 -73.254 1.00 74.80 ? 315 NAG A C1 1 HETATM 6516 C C2 . NAG H 5 . ? 4.660 -37.677 -73.046 1.00 79.09 ? 315 NAG A C2 1 HETATM 6517 C C3 . NAG H 5 . ? 5.373 -37.943 -71.719 1.00 80.77 ? 315 NAG A C3 1 HETATM 6518 C C4 . NAG H 5 . ? 4.397 -38.041 -70.551 1.00 78.35 ? 315 NAG A C4 1 HETATM 6519 C C5 . NAG H 5 . ? 3.258 -39.005 -70.886 1.00 74.33 ? 315 NAG A C5 1 HETATM 6520 C C6 . NAG H 5 . ? 2.228 -39.070 -69.758 1.00 71.97 ? 315 NAG A C6 1 HETATM 6521 N N2 . NAG H 5 . ? 5.590 -37.877 -74.143 1.00 81.08 ? 315 NAG A N2 1 HETATM 6522 O O4 . NAG H 5 . ? 5.101 -38.487 -69.413 1.00 79.77 ? 315 NAG A O4 1 HETATM 6523 O O5 . NAG H 5 . ? 2.615 -38.599 -72.081 1.00 73.52 ? 315 NAG A O5 1 HETATM 6524 O O6 . NAG H 5 . ? 0.960 -38.637 -70.203 1.00 68.88 ? 315 NAG A O6 1 HETATM 6525 C C1 . NAG I 5 . ? -26.905 -51.339 -63.884 1.00 71.45 ? 501 NAG A C1 1 HETATM 6526 C C2 . NAG I 5 . ? -27.220 -51.316 -62.381 1.00 74.24 ? 501 NAG A C2 1 HETATM 6527 C C3 . NAG I 5 . ? -27.056 -52.712 -61.787 1.00 75.89 ? 501 NAG A C3 1 HETATM 6528 C C4 . NAG I 5 . ? -28.024 -53.601 -62.567 1.00 78.65 ? 501 NAG A C4 1 HETATM 6529 C C5 . NAG I 5 . ? -27.571 -53.654 -64.033 1.00 75.41 ? 501 NAG A C5 1 HETATM 6530 C C6 . NAG I 5 . ? -28.431 -54.559 -64.909 1.00 77.48 ? 501 NAG A C6 1 HETATM 6531 C C7 . NAG I 5 . ? -26.913 -49.133 -61.330 1.00 73.44 ? 501 NAG A C7 1 HETATM 6532 C C8 . NAG I 5 . ? -26.000 -48.218 -60.572 1.00 72.15 ? 501 NAG A C8 1 HETATM 6533 N N2 . NAG I 5 . ? -26.431 -50.336 -61.650 1.00 72.70 ? 501 NAG A N2 1 HETATM 6534 O O3 . NAG I 5 . ? -27.373 -52.701 -60.415 1.00 78.41 ? 501 NAG A O3 1 HETATM 6535 O O4 . NAG I 5 . ? -28.363 -54.841 -61.938 1.00 82.91 ? 501 NAG A O4 1 HETATM 6536 O O5 . NAG I 5 . ? -27.659 -52.338 -64.557 1.00 73.45 ? 501 NAG A O5 1 HETATM 6537 O O6 . NAG I 5 . ? -27.823 -54.672 -66.177 1.00 75.14 ? 501 NAG A O6 1 HETATM 6538 O O7 . NAG I 5 . ? -28.043 -48.754 -61.633 1.00 75.48 ? 501 NAG A O7 1 HETATM 6539 C C1 . NAG J 5 . ? -27.334 -55.827 -61.701 1.00 82.65 ? 502 NAG A C1 1 HETATM 6540 C C2 . NAG J 5 . ? -27.676 -56.473 -60.350 1.00 86.13 ? 502 NAG A C2 1 HETATM 6541 C C3 . NAG J 5 . ? -27.064 -57.860 -60.136 1.00 86.66 ? 502 NAG A C3 1 HETATM 6542 C C4 . NAG J 5 . ? -27.145 -58.726 -61.389 1.00 86.34 ? 502 NAG A C4 1 HETATM 6543 C C5 . NAG J 5 . ? -26.585 -57.957 -62.583 1.00 82.76 ? 502 NAG A C5 1 HETATM 6544 C C6 . NAG J 5 . ? -26.662 -58.780 -63.864 1.00 82.42 ? 502 NAG A C6 1 HETATM 6545 N N2 . NAG J 5 . ? -27.279 -55.598 -59.262 1.00 85.74 ? 502 NAG A N2 1 HETATM 6546 O O3 . NAG J 5 . ? -27.734 -58.509 -59.077 1.00 90.54 ? 502 NAG A O3 1 HETATM 6547 O O4 . NAG J 5 . ? -26.411 -59.911 -61.180 1.00 86.72 ? 502 NAG A O4 1 HETATM 6548 O O5 . NAG J 5 . ? -27.315 -56.760 -62.771 1.00 82.86 ? 502 NAG A O5 1 HETATM 6549 O O6 . NAG J 5 . ? -25.465 -59.508 -64.017 1.00 80.73 ? 502 NAG A O6 1 HETATM 6550 C C1 . PEG K 6 . ? -23.365 -34.724 -97.713 1.00 69.00 ? 303 PEG A C1 1 HETATM 6551 O O1 . PEG K 6 . ? -23.964 -33.433 -97.881 1.00 69.27 ? 303 PEG A O1 1 HETATM 6552 C C2 . PEG K 6 . ? -24.451 -35.774 -97.495 1.00 68.69 ? 303 PEG A C2 1 HETATM 6553 O O2 . PEG K 6 . ? -24.164 -36.544 -96.327 1.00 68.66 ? 303 PEG A O2 1 HETATM 6554 C C3 . PEG K 6 . ? -25.253 -36.552 -95.402 1.00 68.60 ? 303 PEG A C3 1 HETATM 6555 C C4 . PEG K 6 . ? -24.735 -36.719 -93.976 1.00 68.41 ? 303 PEG A C4 1 HETATM 6556 O O4 . PEG K 6 . ? -24.454 -35.439 -93.394 1.00 68.28 ? 303 PEG A O4 1 HETATM 6557 C C1 . NAG L 5 . ? -37.473 -42.238 -70.500 1.00 99.96 ? 551 NAG A C1 1 HETATM 6558 C C2 . NAG L 5 . ? -38.619 -41.234 -70.325 1.00 105.00 ? 551 NAG A C2 1 HETATM 6559 C C3 . NAG L 5 . ? -38.357 -40.241 -69.189 1.00 105.43 ? 551 NAG A C3 1 HETATM 6560 C C4 . NAG L 5 . ? -37.764 -40.902 -67.943 1.00 104.18 ? 551 NAG A C4 1 HETATM 6561 C C5 . NAG L 5 . ? -36.609 -41.844 -68.302 1.00 99.57 ? 551 NAG A C5 1 HETATM 6562 C C6 . NAG L 5 . ? -36.075 -42.558 -67.058 1.00 98.71 ? 551 NAG A C6 1 HETATM 6563 C C7 . NAG L 5 . ? -40.027 -40.131 -72.028 1.00 109.82 ? 551 NAG A C7 1 HETATM 6564 C C8 . NAG L 5 . ? -40.028 -39.412 -73.346 1.00 109.42 ? 551 NAG A C8 1 HETATM 6565 N N2 . NAG L 5 . ? -38.831 -40.521 -71.577 1.00 105.36 ? 551 NAG A N2 1 HETATM 6566 O O3 . NAG L 5 . ? -39.568 -39.606 -68.845 1.00 110.44 ? 551 NAG A O3 1 HETATM 6567 O O4 . NAG L 5 . ? -37.322 -39.899 -67.053 1.00 104.02 ? 551 NAG A O4 1 HETATM 6568 O O5 . NAG L 5 . ? -37.044 -42.792 -69.265 1.00 99.70 ? 551 NAG A O5 1 HETATM 6569 O O6 . NAG L 5 . ? -35.631 -43.861 -67.366 1.00 96.31 ? 551 NAG A O6 1 HETATM 6570 O O7 . NAG L 5 . ? -41.087 -40.325 -71.431 1.00 113.97 ? 551 NAG A O7 1 HETATM 6571 N N2 . FEE M 7 . ? -11.191 -45.496 -63.731 1.00 47.38 ? 601 FEE A N2 1 HETATM 6572 C C3 . FEE M 7 . ? -9.179 -46.847 -63.547 1.00 46.61 ? 601 FEE A C3 1 HETATM 6573 C C4 . FEE M 7 . ? -9.752 -47.964 -64.430 1.00 46.06 ? 601 FEE A C4 1 HETATM 6574 C C5 . FEE M 7 . ? -9.637 -47.702 -65.936 1.00 45.91 ? 601 FEE A C5 1 HETATM 6575 C C6 . FEE M 7 . ? -9.823 -48.965 -66.780 1.00 45.86 ? 601 FEE A C6 1 HETATM 6576 C C7 . FEE M 7 . ? -11.296 -49.304 -67.017 1.00 46.53 ? 601 FEE A C7 1 HETATM 6577 C C8 . FEE M 7 . ? -11.606 -49.560 -68.491 1.00 46.43 ? 601 FEE A C8 1 HETATM 6578 C C9 . FEE M 7 . ? -11.066 -50.893 -68.977 1.00 46.73 ? 601 FEE A C9 1 HETATM 6579 C C1 . FEE M 7 . ? -9.306 -44.495 -62.671 1.00 47.41 ? 601 FEE A C1 1 HETATM 6580 C CAX . FEE M 7 . ? -20.010 -44.966 -72.824 1.00 48.34 ? 601 FEE A CAX 1 HETATM 6581 C CAW . FEE M 7 . ? -21.075 -43.996 -73.328 1.00 50.54 ? 601 FEE A CAW 1 HETATM 6582 C CAV . FEE M 7 . ? -20.868 -42.584 -72.781 1.00 50.96 ? 601 FEE A CAV 1 HETATM 6583 C CAU . FEE M 7 . ? -21.693 -41.556 -73.551 1.00 52.24 ? 601 FEE A CAU 1 HETATM 6584 C CAT . FEE M 7 . ? -20.931 -40.248 -73.743 1.00 52.53 ? 601 FEE A CAT 1 HETATM 6585 C CAS . FEE M 7 . ? -20.439 -40.081 -75.179 1.00 52.38 ? 601 FEE A CAS 1 HETATM 6586 C CAR . FEE M 7 . ? -19.178 -39.222 -75.251 1.00 52.09 ? 601 FEE A CAR 1 HETATM 6587 C CAQ . FEE M 7 . ? -18.124 -39.842 -76.164 1.00 50.89 ? 601 FEE A CAQ 1 HETATM 6588 C CAP . FEE M 7 . ? -16.719 -39.641 -75.603 1.00 50.73 ? 601 FEE A CAP 1 HETATM 6589 C CAO . FEE M 7 . ? -15.664 -40.416 -76.390 1.00 50.20 ? 601 FEE A CAO 1 HETATM 6590 C CAN . FEE M 7 . ? -14.840 -41.332 -75.487 1.00 50.03 ? 601 FEE A CAN 1 HETATM 6591 C CAM . FEE M 7 . ? -14.754 -42.742 -76.069 1.00 50.01 ? 601 FEE A CAM 1 HETATM 6592 C CAL . FEE M 7 . ? -13.971 -43.695 -75.167 1.00 49.40 ? 601 FEE A CAL 1 HETATM 6593 C CAK . FEE M 7 . ? -14.723 -45.009 -74.970 1.00 48.84 ? 601 FEE A CAK 1 HETATM 6594 C CAJ . FEE M 7 . ? -14.292 -45.714 -73.686 1.00 47.94 ? 601 FEE A CAJ 1 HETATM 6595 C CAI . FEE M 7 . ? -15.451 -45.843 -72.704 1.00 47.89 ? 601 FEE A CAI 1 HETATM 6596 C CAH . FEE M 7 . ? -14.992 -46.418 -71.367 1.00 47.44 ? 601 FEE A CAH 1 HETATM 6597 C CAG . FEE M 7 . ? -15.293 -45.450 -70.226 1.00 47.67 ? 601 FEE A CAG 1 HETATM 6598 C CAF . FEE M 7 . ? -14.955 -46.047 -68.862 1.00 47.15 ? 601 FEE A CAF 1 HETATM 6599 C CAE . FEE M 7 . ? -14.778 -44.941 -67.825 1.00 47.41 ? 601 FEE A CAE 1 HETATM 6600 C CAD . FEE M 7 . ? -14.195 -45.480 -66.524 1.00 47.05 ? 601 FEE A CAD 1 HETATM 6601 C CAC . FEE M 7 . ? -14.265 -44.425 -65.425 1.00 48.07 ? 601 FEE A CAC 1 HETATM 6602 C CAB . FEE M 7 . ? -13.475 -44.838 -64.185 1.00 48.30 ? 601 FEE A CAB 1 HETATM 6603 C CAA . FEE M 7 . ? -11.984 -44.634 -64.373 1.00 47.76 ? 601 FEE A CAA 1 HETATM 6604 O OAA . FEE M 7 . ? -11.560 -43.725 -65.075 1.00 47.93 ? 601 FEE A OAA 1 HETATM 6605 C C2 . FEE M 7 . ? -9.729 -45.437 -63.801 1.00 46.83 ? 601 FEE A C2 1 HETATM 6606 O O3 . FEE M 7 . ? -7.753 -46.826 -63.687 1.00 46.67 ? 601 FEE A O3 1 HETATM 6607 O O4 . FEE M 7 . ? -9.080 -49.186 -64.101 1.00 45.95 ? 601 FEE A O4 1 HETATM 6608 O O1A . FEE M 7 . ? -9.952 -44.900 -61.471 1.00 46.93 ? 601 FEE A O1A 1 HETATM 6609 C C1A . FEE M 7 . ? -9.499 -44.228 -60.304 1.00 48.61 ? 601 FEE A C1A 1 HETATM 6610 O O6A . FEE M 7 . ? -10.023 -42.891 -60.223 1.00 49.55 ? 601 FEE A O6A 1 HETATM 6611 C C5M . FEE M 7 . ? -11.450 -42.757 -60.100 1.00 49.78 ? 601 FEE A C5M 1 HETATM 6612 C C6A . FEE M 7 . ? -11.813 -41.277 -59.985 1.00 51.43 ? 601 FEE A C6A 1 HETATM 6613 O O5A . FEE M 7 . ? -11.731 -40.649 -61.272 1.00 50.60 ? 601 FEE A O5A 1 HETATM 6614 C C4A . FEE M 7 . ? -11.984 -43.566 -58.914 1.00 50.69 ? 601 FEE A C4A 1 HETATM 6615 O O4A . FEE M 7 . ? -11.607 -42.943 -57.675 1.00 52.87 ? 601 FEE A O4A 1 HETATM 6616 C C3A . FEE M 7 . ? -11.469 -45.006 -58.968 1.00 49.25 ? 601 FEE A C3A 1 HETATM 6617 O O3A . FEE M 7 . ? -11.853 -45.729 -57.797 1.00 50.40 ? 601 FEE A O3A 1 HETATM 6618 C C2A . FEE M 7 . ? -9.950 -45.034 -59.089 1.00 49.39 ? 601 FEE A C2A 1 HETATM 6619 O O2A . FEE M 7 . ? -9.509 -46.387 -59.209 1.00 48.75 ? 601 FEE A O2A 1 HETATM 6620 C C1 . D12 N 8 . ? -8.626 -55.704 -69.859 1.00 50.12 ? 611 D12 A C1 1 HETATM 6621 C C2 . D12 N 8 . ? -7.919 -56.997 -70.216 1.00 51.06 ? 611 D12 A C2 1 HETATM 6622 C C3 . D12 N 8 . ? -6.534 -56.742 -70.803 1.00 51.25 ? 611 D12 A C3 1 HETATM 6623 C C4 . D12 N 8 . ? -5.427 -57.213 -69.863 1.00 52.27 ? 611 D12 A C4 1 HETATM 6624 C C5 . D12 N 8 . ? -4.051 -56.807 -70.380 1.00 52.96 ? 611 D12 A C5 1 HETATM 6625 C C6 . D12 N 8 . ? -2.960 -57.721 -69.832 1.00 55.30 ? 611 D12 A C6 1 HETATM 6626 C C7 . D12 N 8 . ? -1.854 -57.969 -70.855 1.00 56.86 ? 611 D12 A C7 1 HETATM 6627 C C8 . D12 N 8 . ? -0.811 -58.945 -70.313 1.00 59.32 ? 611 D12 A C8 1 HETATM 6628 C C9 . D12 N 8 . ? -0.318 -59.908 -71.391 1.00 60.98 ? 611 D12 A C9 1 HETATM 6629 C C10 . D12 N 8 . ? 0.210 -61.203 -70.781 1.00 63.07 ? 611 D12 A C10 1 HETATM 6630 C C11 . D12 N 8 . ? 0.118 -62.377 -71.751 1.00 64.71 ? 611 D12 A C11 1 HETATM 6631 C C12 . D12 N 8 . ? 0.524 -63.686 -71.081 1.00 66.84 ? 611 D12 A C12 1 HETATM 6632 C C1 . PEG O 6 . ? -18.726 -51.326 -85.225 1.00 72.93 ? 100 PEG B C1 1 HETATM 6633 O O1 . PEG O 6 . ? -19.295 -52.212 -86.197 1.00 72.77 ? 100 PEG B O1 1 HETATM 6634 C C2 . PEG O 6 . ? -17.559 -52.000 -84.505 1.00 72.78 ? 100 PEG B C2 1 HETATM 6635 O O2 . PEG O 6 . ? -18.020 -52.730 -83.369 1.00 72.49 ? 100 PEG B O2 1 HETATM 6636 C C3 . PEG O 6 . ? -17.057 -53.692 -82.938 1.00 72.43 ? 100 PEG B C3 1 HETATM 6637 C C4 . PEG O 6 . ? -17.669 -54.593 -81.870 1.00 72.56 ? 100 PEG B C4 1 HETATM 6638 O O4 . PEG O 6 . ? -17.486 -55.966 -82.237 1.00 72.59 ? 100 PEG B O4 1 HETATM 6639 O O . HOH P 9 . ? -7.436 -55.945 -79.885 1.00 48.25 ? 304 HOH A O 1 HETATM 6640 O O . HOH P 9 . ? -27.725 -35.089 -75.136 1.00 60.45 ? 305 HOH A O 1 HETATM 6641 O O . HOH P 9 . ? -16.653 -37.220 -101.470 1.00 33.06 ? 306 HOH A O 1 HETATM 6642 O O . HOH P 9 . ? -19.791 -39.973 -91.075 1.00 56.46 ? 307 HOH A O 1 HETATM 6643 O O . HOH P 9 . ? -6.982 -54.799 -57.137 1.00 56.82 ? 308 HOH A O 1 HETATM 6644 O O . HOH P 9 . ? -5.505 -51.815 -80.758 1.00 46.65 ? 309 HOH A O 1 HETATM 6645 O O . HOH P 9 . ? -12.879 -41.373 -65.089 1.00 50.90 ? 310 HOH A O 1 HETATM 6646 O O . HOH P 9 . ? -7.792 -40.574 -77.381 1.00 46.60 ? 311 HOH A O 1 HETATM 6647 O O . HOH P 9 . ? -26.364 -28.670 -76.177 1.00 56.11 ? 312 HOH A O 1 HETATM 6648 O O . HOH P 9 . ? -6.473 -37.116 -71.086 1.00 44.35 ? 313 HOH A O 1 HETATM 6649 O O . HOH P 9 . ? 1.652 -52.223 -80.244 1.00 62.15 ? 316 HOH A O 1 HETATM 6650 O O . HOH P 9 . ? -13.625 -62.021 -81.369 1.00 37.69 ? 317 HOH A O 1 HETATM 6651 O O . HOH P 9 . ? -20.867 -61.144 -111.087 1.00 35.97 ? 318 HOH A O 1 HETATM 6652 O O . HOH P 9 . ? -20.492 -47.396 -88.114 1.00 46.73 ? 319 HOH A O 1 HETATM 6653 O O . HOH P 9 . ? -27.212 -54.568 -68.634 1.00 55.17 ? 320 HOH A O 1 HETATM 6654 O O . HOH P 9 . ? -35.066 -33.191 -104.878 1.00 45.49 ? 321 HOH A O 1 HETATM 6655 O O . HOH P 9 . ? -36.522 -37.381 -107.798 1.00 55.38 ? 322 HOH A O 1 HETATM 6656 O O . HOH P 9 . ? -29.953 -52.148 -98.402 1.00 48.27 ? 323 HOH A O 1 HETATM 6657 O O . HOH P 9 . ? -18.246 -43.048 -117.350 1.00 48.06 ? 324 HOH A O 1 HETATM 6658 O O . HOH P 9 . ? -30.012 -55.455 -104.231 1.00 54.97 ? 325 HOH A O 1 HETATM 6659 O O . HOH Q 9 . ? -8.698 -46.281 -114.626 1.00 42.82 ? 101 HOH B O 1 HETATM 6660 O O . HOH Q 9 . ? -11.761 -54.098 -91.598 1.00 38.09 ? 102 HOH B O 1 HETATM 6661 O O . HOH Q 9 . ? -4.574 -62.382 -93.224 1.00 61.77 ? 103 HOH B O 1 HETATM 6662 O O . HOH Q 9 . ? -10.736 -52.576 -98.843 1.00 35.68 ? 104 HOH B O 1 HETATM 6663 O O . HOH Q 9 . ? 1.077 -44.038 -109.937 1.00 47.18 ? 105 HOH B O 1 HETATM 6664 O O . HOH Q 9 . ? -6.899 -37.757 -121.594 1.00 47.69 ? 106 HOH B O 1 HETATM 6665 O O . HOH Q 9 . ? -7.092 -61.197 -85.635 1.00 53.63 ? 107 HOH B O 1 HETATM 6666 O O . HOH Q 9 . ? -4.531 -35.131 -110.741 1.00 58.48 ? 108 HOH B O 1 HETATM 6667 O O . HOH Q 9 . ? -1.346 -32.906 -104.737 1.00 82.71 ? 109 HOH B O 1 HETATM 6668 O O . HOH Q 9 . ? -9.353 -59.379 -86.623 1.00 54.26 ? 110 HOH B O 1 HETATM 6669 O O . HOH R 9 . ? 14.956 -32.016 -29.067 1.00 53.20 ? 211 HOH C O 1 HETATM 6670 O O . HOH R 9 . ? 29.488 -43.812 -13.736 1.00 49.27 ? 212 HOH C O 1 HETATM 6671 O O . HOH R 9 . ? 22.003 -21.677 -22.242 1.00 44.78 ? 213 HOH C O 1 HETATM 6672 O O . HOH R 9 . ? 8.675 -28.751 -15.586 1.00 42.75 ? 214 HOH C O 1 HETATM 6673 O O . HOH R 9 . ? 30.029 -30.061 -15.959 1.00 43.42 ? 215 HOH C O 1 HETATM 6674 O O . HOH R 9 . ? 4.432 -31.880 -47.505 1.00 51.68 ? 216 HOH C O 1 HETATM 6675 O O . HOH R 9 . ? 22.320 -19.047 -15.982 1.00 45.96 ? 217 HOH C O 1 HETATM 6676 O O . HOH R 9 . ? -1.899 -43.229 -12.397 1.00 52.95 ? 218 HOH C O 1 HETATM 6677 O O . HOH R 9 . ? 7.937 -31.129 -40.472 1.00 47.90 ? 219 HOH C O 1 HETATM 6678 O O . HOH R 9 . ? -15.067 -43.646 -45.405 1.00 53.61 ? 220 HOH C O 1 HETATM 6679 O O . HOH R 9 . ? 29.087 -21.110 -15.777 1.00 52.62 ? 221 HOH C O 1 HETATM 6680 O O . HOH R 9 . ? 25.111 -15.048 -21.470 1.00 48.46 ? 222 HOH C O 1 HETATM 6681 O O . HOH R 9 . ? -12.279 -39.352 -56.818 1.00 47.78 ? 223 HOH C O 1 HETATM 6682 O O . HOH R 9 . ? 3.728 -24.916 -18.244 1.00 51.27 ? 224 HOH C O 1 HETATM 6683 O O . HOH R 9 . ? 6.285 -24.627 -38.917 1.00 63.23 ? 225 HOH C O 1 HETATM 6684 O O . HOH R 9 . ? 19.638 -32.324 -27.031 1.00 43.09 ? 226 HOH C O 1 HETATM 6685 O O . HOH R 9 . ? -13.965 -36.806 -57.742 1.00 54.87 ? 227 HOH C O 1 HETATM 6686 O O . HOH R 9 . ? -15.305 -40.072 -54.388 1.00 58.80 ? 228 HOH C O 1 HETATM 6687 O O . HOH R 9 . ? 4.940 -24.035 -41.571 1.00 47.82 ? 229 HOH C O 1 HETATM 6688 O O . HOH R 9 . ? -11.881 -30.855 -45.344 1.00 50.10 ? 230 HOH C O 1 HETATM 6689 O O . HOH R 9 . ? 5.083 -38.710 -52.618 1.00 37.89 ? 231 HOH C O 1 HETATM 6690 O O . HOH R 9 . ? 36.752 -40.707 -8.138 1.00 68.21 ? 232 HOH C O 1 HETATM 6691 O O . HOH R 9 . ? 8.895 -21.430 -28.034 1.00 77.69 ? 233 HOH C O 1 HETATM 6692 O O . HOH R 9 . ? 23.603 -16.684 -16.042 1.00 44.73 ? 234 HOH C O 1 HETATM 6693 O O . HOH S 9 . ? 5.137 -44.704 -12.231 1.00 60.02 ? 248 HOH D O 1 HETATM 6694 O O . HOH S 9 . ? 21.176 -34.569 -26.856 1.00 39.49 ? 249 HOH D O 1 HETATM 6695 O O . HOH S 9 . ? 19.478 -52.936 -13.095 1.00 50.95 ? 250 HOH D O 1 HETATM 6696 O O . HOH S 9 . ? 6.046 -39.656 -45.616 1.00 45.51 ? 251 HOH D O 1 HETATM 6697 O O . HOH S 9 . ? -2.267 -59.855 -52.291 1.00 66.82 ? 252 HOH D O 1 HETATM 6698 O O . HOH S 9 . ? 25.774 -39.992 -38.591 1.00 52.29 ? 253 HOH D O 1 HETATM 6699 O O . HOH S 9 . ? 21.227 -42.636 -32.063 1.00 45.00 ? 254 HOH D O 1 HETATM 6700 O O . HOH S 9 . ? 12.083 -39.556 -48.922 1.00 43.29 ? 255 HOH D O 1 HETATM 6701 O O . HOH S 9 . ? 19.738 -50.069 -24.461 1.00 45.64 ? 256 HOH D O 1 HETATM 6702 O O . HOH S 9 . ? 8.554 -48.748 -16.176 1.00 46.31 ? 257 HOH D O 1 HETATM 6703 O O . HOH S 9 . ? 19.582 -34.665 -9.232 1.00 57.49 ? 258 HOH D O 1 HETATM 6704 O O . HOH S 9 . ? 24.005 -31.367 -3.527 1.00 41.15 ? 259 HOH D O 1 HETATM 6705 O O . HOH S 9 . ? 18.913 -41.432 -30.852 1.00 56.11 ? 260 HOH D O 1 HETATM 6706 O O . HOH S 9 . ? 1.485 -62.721 -58.553 1.00 62.70 ? 261 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 . LYS A 6 ? 0.8464 1.4091 1.2760 0.0753 -0.4043 -0.2203 6 LYS A N 2 C CA . LYS A 6 ? 0.8229 1.4194 1.2658 0.1115 -0.3767 -0.2144 6 LYS A CA 3 C C . LYS A 6 ? 0.7887 1.3605 1.2123 0.1092 -0.3304 -0.2086 6 LYS A C 4 O O . LYS A 6 ? 0.7768 1.3582 1.1961 0.1381 -0.3056 -0.2053 6 LYS A O 5 C CB . LYS A 6 ? 0.8104 1.5142 1.3448 0.1152 -0.3837 -0.2071 6 LYS A CB 6 C CG . LYS A 6 ? 0.8465 1.5842 1.4052 0.1237 -0.4317 -0.2125 6 LYS A CG 7 C CD . LYS A 6 ? 0.8331 1.6882 1.4910 0.1280 -0.4360 -0.2036 6 LYS A CD 8 N N . ASN A 7 ? 0.7791 1.3153 1.1874 0.0761 -0.3212 -0.2080 7 ASN A N 9 C CA . ASN A 7 ? 0.7484 1.2607 1.1388 0.0702 -0.2813 -0.2024 7 ASN A CA 10 C C . ASN A 7 ? 0.7533 1.1859 1.0645 0.0908 -0.2681 -0.2077 7 ASN A C 11 O O . ASN A 7 ? 0.7828 1.1618 1.0443 0.0945 -0.2880 -0.2154 7 ASN A O 12 C CB . ASN A 7 ? 0.7429 1.2476 1.1475 0.0280 -0.2783 -0.1987 7 ASN A CB 13 C CG . ASN A 7 ? 0.7458 1.3257 1.2288 -0.0002 -0.2936 -0.1917 7 ASN A CG 14 O OD1 . ASN A 7 ? 0.7474 1.3966 1.2826 0.0125 -0.3039 -0.1889 7 ASN A OD1 15 N ND2 . ASN A 7 ? 0.7523 1.3188 1.2442 -0.0390 -0.2955 -0.1879 7 ASN A ND2 16 N N . TYR A 8 ? 0.7276 1.1528 1.0263 0.1032 -0.2347 -0.2032 8 TYR A N 17 C CA . TYR A 8 ? 0.7298 1.0853 0.9604 0.1180 -0.2199 -0.2060 8 TYR A CA 18 C C . TYR A 8 ? 0.7023 1.0341 0.9200 0.0995 -0.1918 -0.2019 8 TYR A C 19 O O . TYR A 8 ? 0.6797 1.0472 0.9299 0.0943 -0.1707 -0.1956 8 TYR A O 20 C CB . TYR A 8 ? 0.7390 1.0929 0.9530 0.1540 -0.2109 -0.2057 8 TYR A CB 21 C CG . TYR A 8 ? 0.7780 1.1247 0.9752 0.1784 -0.2392 -0.2105 8 TYR A CG 22 C CD1 . TYR A 8 ? 0.8115 1.0909 0.9434 0.1865 -0.2495 -0.2146 8 TYR A CD1 23 C CD2 . TYR A 8 ? 0.7871 1.1965 1.0333 0.1949 -0.2550 -0.2100 8 TYR A CD2 24 C CE1 . TYR A 8 ? 0.8543 1.1222 0.9640 0.2102 -0.2761 -0.2182 8 TYR A CE1 25 C CE2 . TYR A 8 ? 0.8264 1.2284 1.0550 0.2197 -0.2836 -0.2142 8 TYR A CE2 26 C CZ . TYR A 8 ? 0.8611 1.1889 1.0185 0.2271 -0.2945 -0.2184 8 TYR A CZ 27 O OH . TYR A 8 ? 0.9014 1.2170 1.0349 0.2525 -0.3233 -0.2218 8 TYR A OH 28 N N . THR A 9 ? 0.7058 0.9787 0.8749 0.0917 -0.1917 -0.2052 9 THR A N 29 C CA . THR A 9 ? 0.6816 0.9297 0.8353 0.0766 -0.1685 -0.2017 9 THR A CA 30 C C . THR A 9 ? 0.6781 0.8878 0.7883 0.0939 -0.1493 -0.2010 9 THR A C 31 O O . THR A 9 ? 0.6998 0.8706 0.7679 0.1075 -0.1561 -0.2041 9 THR A O 32 C CB . THR A 9 ? 0.6942 0.9062 0.8267 0.0562 -0.1792 -0.2050 9 THR A CB 33 O OG1 . THR A 9 ? 0.7061 0.9454 0.8735 0.0386 -0.2028 -0.2067 9 THR A OG1 34 C CG2 . THR A 9 ? 0.6735 0.8711 0.8011 0.0406 -0.1571 -0.2002 9 THR A CG2 35 N N . PHE A 10 ? 0.6530 0.8730 0.7722 0.0920 -0.1259 -0.1962 10 PHE A N 36 C CA . PHE A 10 ? 0.6503 0.8354 0.7324 0.1031 -0.1087 -0.1951 10 PHE A CA 37 C C . PHE A 10 ? 0.6386 0.8000 0.7060 0.0849 -0.0957 -0.1926 10 PHE A C 38 O O . PHE A 10 ? 0.6230 0.8052 0.7152 0.0691 -0.0883 -0.1892 10 PHE A O 39 C CB . PHE A 10 ? 0.6423 0.8524 0.7398 0.1174 -0.0944 -0.1930 10 PHE A CB 40 C CG . PHE A 10 ? 0.6402 0.8119 0.6998 0.1252 -0.0787 -0.1924 10 PHE A CG 41 C CD1 . PHE A 10 ? 0.6579 0.7944 0.6812 0.1442 -0.0829 -0.1942 10 PHE A CD1 42 C CD2 . PHE A 10 ? 0.6179 0.7864 0.6764 0.1126 -0.0614 -0.1894 10 PHE A CD2 43 C CE1 . PHE A 10 ? 0.6661 0.7642 0.6546 0.1472 -0.0706 -0.1931 10 PHE A CE1 44 C CE2 . PHE A 10 ? 0.6246 0.7576 0.6490 0.1172 -0.0506 -0.1894 10 PHE A CE2 45 C CZ . PHE A 10 ? 0.6502 0.7479 0.6407 0.1331 -0.0554 -0.1912 10 PHE A CZ 46 N N . ARG A 11 ? 0.6497 0.7693 0.6774 0.0874 -0.0928 -0.1930 11 ARG A N 47 C CA . ARG A 11 ? 0.6416 0.7433 0.6578 0.0732 -0.0821 -0.1905 11 ARG A CA 48 C C . ARG A 11 ? 0.6444 0.7175 0.6303 0.0767 -0.0689 -0.1875 11 ARG A C 49 O O . ARG A 11 ? 0.6658 0.7139 0.6234 0.0864 -0.0712 -0.1874 11 ARG A O 50 C CB . ARG A 11 ? 0.6527 0.7395 0.6600 0.0651 -0.0940 -0.1934 11 ARG A CB 51 C CG . ARG A 11 ? 0.6909 0.7501 0.6649 0.0774 -0.1059 -0.1972 11 ARG A CG 52 C CD . ARG A 11 ? 0.7297 0.7881 0.7069 0.0731 -0.1279 -0.2033 11 ARG A CD 53 N NE . ARG A 11 ? 0.7322 0.7980 0.7296 0.0545 -0.1290 -0.2033 11 ARG A NE 54 C CZ . ARG A 11 ? 0.7600 0.8267 0.7674 0.0440 -0.1489 -0.2078 11 ARG A CZ 55 N NH1 . ARG A 11 ? 0.7808 0.8455 0.7821 0.0507 -0.1711 -0.2137 11 ARG A NH1 56 N NH2 . ARG A 11 ? 0.7661 0.8324 0.7873 0.0259 -0.1483 -0.2062 11 ARG A NH2 57 N N . CYS A 12 ? 0.6271 0.7043 0.6192 0.0674 -0.0558 -0.1843 12 CYS A N 58 C CA . CYS A 12 ? 0.6285 0.6837 0.5986 0.0646 -0.0455 -0.1809 12 CYS A CA 59 C C . CYS A 12 ? 0.6186 0.6684 0.5859 0.0550 -0.0432 -0.1788 12 CYS A C 60 O O . CYS A 12 ? 0.6040 0.6661 0.5875 0.0464 -0.0422 -0.1783 12 CYS A O 61 C CB . CYS A 12 ? 0.6212 0.6825 0.5963 0.0623 -0.0357 -0.1795 12 CYS A CB 62 S SG . CYS A 12 ? 0.6492 0.7167 0.6251 0.0794 -0.0362 -0.1829 12 CYS A SG 63 N N . LEU A 13 ? 0.6287 0.6593 0.5735 0.0581 -0.0415 -0.1770 13 LEU A N 64 C CA . LEU A 13 ? 0.6257 0.6519 0.5648 0.0549 -0.0382 -0.1753 13 LEU A CA 65 C C . LEU A 13 ? 0.6227 0.6476 0.5567 0.0499 -0.0262 -0.1687 13 LEU A C 66 O O . LEU A 13 ? 0.6395 0.6524 0.5571 0.0514 -0.0218 -0.1647 13 LEU A O 67 C CB . LEU A 13 ? 0.6470 0.6566 0.5643 0.0644 -0.0450 -0.1783 13 LEU A CB 68 C CG . LEU A 13 ? 0.6529 0.6630 0.5747 0.0675 -0.0618 -0.1854 13 LEU A CG 69 C CD1 . LEU A 13 ? 0.6842 0.6705 0.5744 0.0783 -0.0696 -0.1889 13 LEU A CD1 70 C CD2 . LEU A 13 ? 0.6356 0.6580 0.5804 0.0570 -0.0665 -0.1876 13 LEU A CD2 71 N N . GLN A 14 ? 0.6061 0.6433 0.5542 0.0429 -0.0222 -0.1668 14 GLN A N 72 C CA . GLN A 14 ? 0.5997 0.6434 0.5502 0.0366 -0.0138 -0.1604 14 GLN A CA 73 C C . GLN A 14 ? 0.5989 0.6497 0.5505 0.0410 -0.0094 -0.1579 14 GLN A C 74 O O . GLN A 14 ? 0.5950 0.6456 0.5501 0.0447 -0.0136 -0.1612 14 GLN A O 75 C CB . GLN A 14 ? 0.5874 0.6401 0.5509 0.0279 -0.0144 -0.1601 14 GLN A CB 76 C CG . GLN A 14 ? 0.5905 0.6525 0.5597 0.0194 -0.0105 -0.1542 14 GLN A CG 77 C CD . GLN A 14 ? 0.5944 0.6621 0.5707 0.0131 -0.0136 -0.1549 14 GLN A CD 78 O OE1 . GLN A 14 ? 0.5994 0.6595 0.5705 0.0129 -0.0154 -0.1586 14 GLN A OE1 79 N NE2 . GLN A 14 ? 0.5930 0.6746 0.5792 0.0104 -0.0140 -0.1510 14 GLN A NE2 80 N N . MET A 15 ? 0.6049 0.6614 0.5526 0.0410 -0.0004 -0.1513 15 MET A N 81 C CA . MET A 15 ? 0.6072 0.6775 0.5585 0.0484 0.0067 -0.1477 15 MET A CA 82 C C . MET A 15 ? 0.5964 0.6927 0.5679 0.0386 0.0131 -0.1389 15 MET A C 83 O O . MET A 15 ? 0.6024 0.7020 0.5744 0.0283 0.0182 -0.1323 15 MET A O 84 C CB . MET A 15 ? 0.6314 0.6905 0.5594 0.0616 0.0133 -0.1473 15 MET A CB 85 C CG . MET A 15 ? 0.6517 0.7061 0.5675 0.0568 0.0214 -0.1400 15 MET A CG 86 S SD . MET A 15 ? 0.7009 0.7219 0.5782 0.0703 0.0173 -0.1451 15 MET A SD 87 C CE . MET A 15 ? 0.6839 0.6905 0.5647 0.0623 0.0020 -0.1511 15 MET A CE 88 N N . SER A 16 ? 0.5840 0.6971 0.5715 0.0408 0.0109 -0.1384 16 SER A N 89 C CA . SER A 16 ? 0.5755 0.7178 0.5861 0.0318 0.0127 -0.1307 16 SER A CA 90 C C . SER A 16 ? 0.5798 0.7492 0.6027 0.0460 0.0206 -0.1257 16 SER A C 91 O O . SER A 16 ? 0.5836 0.7453 0.5993 0.0622 0.0182 -0.1305 16 SER A O 92 C CB . SER A 16 ? 0.5640 0.7052 0.5826 0.0229 0.0013 -0.1334 16 SER A CB 93 O OG . SER A 16 ? 0.5633 0.6851 0.5719 0.0110 -0.0033 -0.1367 16 SER A OG 94 N N . SER A 17 ? 0.5823 0.7833 0.6237 0.0401 0.0300 -0.1156 17 SER A N 95 C CA . SER A 17 ? 0.5896 0.8268 0.6483 0.0555 0.0402 -0.1092 17 SER A CA 96 C C . SER A 17 ? 0.5786 0.8574 0.6741 0.0458 0.0343 -0.1019 17 SER A C 97 O O . SER A 17 ? 0.5744 0.8651 0.6856 0.0220 0.0301 -0.0963 17 SER A O 98 C CB . SER A 17 ? 0.6064 0.8567 0.6607 0.0591 0.0591 -0.1010 17 SER A CB 99 O OG . SER A 17 ? 0.6253 0.8351 0.6415 0.0695 0.0619 -0.1081 17 SER A OG 100 N N . PHE A 18 ? 0.5802 0.8774 0.6864 0.0648 0.0319 -0.1025 18 PHE A N 101 C CA . PHE A 18 ? 0.5738 0.9159 0.7164 0.0609 0.0246 -0.0954 18 PHE A CA 102 C C . PHE A 18 ? 0.5863 0.9706 0.7477 0.0868 0.0380 -0.0890 18 PHE A C 103 O O . PHE A 18 ? 0.5979 0.9675 0.7428 0.1142 0.0376 -0.0947 18 PHE A O 104 C CB . PHE A 18 ? 0.5674 0.8889 0.7020 0.0624 0.0056 -0.1020 18 PHE A CB 105 C CG . PHE A 18 ? 0.5611 0.8433 0.6753 0.0417 -0.0048 -0.1085 18 PHE A CG 106 C CD1 . PHE A 18 ? 0.5643 0.8013 0.6466 0.0459 -0.0037 -0.1172 18 PHE A CD1 107 C CD2 . PHE A 18 ? 0.5575 0.8487 0.6841 0.0188 -0.0166 -0.1061 18 PHE A CD2 108 C CE1 . PHE A 18 ? 0.5567 0.7641 0.6233 0.0302 -0.0111 -0.1225 18 PHE A CE1 109 C CE2 . PHE A 18 ? 0.5572 0.8105 0.6605 0.0043 -0.0246 -0.1128 18 PHE A CE2 110 C CZ . PHE A 18 ? 0.5590 0.7733 0.6340 0.0114 -0.0203 -0.1206 18 PHE A CZ 111 N N . ALA A 19 ? 0.5905 1.0255 0.7845 0.0784 0.0508 -0.0766 19 ALA A N 112 C CA . ALA A 19 ? 0.6069 1.0909 0.8220 0.1047 0.0684 -0.0687 19 ALA A CA 113 C C . ALA A 19 ? 0.6048 1.1381 0.8587 0.1156 0.0573 -0.0643 19 ALA A C 114 O O . ALA A 19 ? 0.6191 1.1730 0.8764 0.1500 0.0649 -0.0640 19 ALA A O 115 C CB . ALA A 19 ? 0.6128 1.1362 0.8493 0.0907 0.0896 -0.0547 19 ALA A CB 116 N N . ASN A 20 ? 0.5942 1.1436 0.8740 0.0879 0.0381 -0.0612 20 ASN A N 117 C CA . ASN A 20 ? 0.5953 1.1886 0.9104 0.0943 0.0214 -0.0574 20 ASN A CA 118 C C . ASN A 20 ? 0.5842 1.1578 0.8988 0.0641 -0.0051 -0.0609 20 ASN A C 119 O O . ASN A 20 ? 0.5834 1.0994 0.8616 0.0476 -0.0100 -0.0692 20 ASN A O 120 C CB . ASN A 20 ? 0.5990 1.2805 0.9734 0.0970 0.0332 -0.0417 20 ASN A CB 121 C CG . ASN A 20 ? 0.6120 1.3188 1.0097 0.0610 0.0450 -0.0303 20 ASN A CG 122 O OD1 . ASN A 20 ? 0.6113 1.2956 1.0065 0.0246 0.0296 -0.0311 20 ASN A OD1 123 N ND2 . ASN A 20 ? 0.6451 1.3957 1.0618 0.0721 0.0731 -0.0191 20 ASN A ND2 124 N N . ARG A 21 ? 0.5803 1.2021 0.9336 0.0588 -0.0226 -0.0548 21 ARG A N 125 C CA . ARG A 21 ? 0.5772 1.1771 0.9232 0.0350 -0.0504 -0.0593 21 ARG A CA 126 C C . ARG A 21 ? 0.5721 1.1613 0.9209 -0.0070 -0.0551 -0.0574 21 ARG A C 127 O O . ARG A 21 ? 0.5773 1.1209 0.8973 -0.0245 -0.0729 -0.0655 21 ARG A O 128 C CB . ARG A 21 ? 0.5837 1.2368 0.9674 0.0432 -0.0714 -0.0538 21 ARG A CB 129 C CG . ARG A 21 ? 0.5999 1.2510 0.9719 0.0866 -0.0716 -0.0565 21 ARG A CG 130 C CD . ARG A 21 ? 0.6235 1.2756 0.9945 0.0912 -0.1020 -0.0579 21 ARG A CD 131 N NE . ARG A 21 ? 0.6460 1.2865 0.9989 0.1335 -0.1031 -0.0598 21 ARG A NE 132 C CZ . ARG A 21 ? 0.6587 1.2271 0.9557 0.1494 -0.0999 -0.0685 21 ARG A CZ 133 N NH1 . ARG A 21 ? 0.6500 1.1586 0.9082 0.1281 -0.0944 -0.0762 21 ARG A NH1 134 N NH2 . ARG A 21 ? 0.6816 1.2377 0.9619 0.1868 -0.1027 -0.0689 21 ARG A NH2 135 N N . SER A 22 ? 0.5658 1.1927 0.9445 -0.0217 -0.0382 -0.0465 22 SER A N 136 C CA . SER A 22 ? 0.5686 1.1867 0.9522 -0.0632 -0.0431 -0.0421 22 SER A CA 137 C C . SER A 22 ? 0.5677 1.1571 0.9289 -0.0704 -0.0182 -0.0395 22 SER A C 138 O O . SER A 22 ? 0.5801 1.1794 0.9562 -0.1016 -0.0148 -0.0298 22 SER A O 139 C CB . SER A 22 ? 0.5737 1.2685 1.0207 -0.0861 -0.0525 -0.0275 22 SER A CB 140 O OG . SER A 22 ? 0.5659 1.3300 1.0556 -0.0673 -0.0287 -0.0145 22 SER A OG 141 N N . TRP A 23 ? 0.5552 1.1064 0.8787 -0.0425 -0.0026 -0.0476 23 TRP A N 142 C CA . TRP A 23 ? 0.5563 1.0750 0.8518 -0.0452 0.0182 -0.0466 23 TRP A CA 143 C C . TRP A 23 ? 0.5508 1.0001 0.7923 -0.0287 0.0175 -0.0620 23 TRP A C 144 O O . TRP A 23 ? 0.5437 0.9831 0.7721 -0.0013 0.0162 -0.0699 23 TRP A O 145 C CB . TRP A 23 ? 0.5594 1.1249 0.8754 -0.0264 0.0460 -0.0353 23 TRP A CB 146 C CG . TRP A 23 ? 0.5691 1.1097 0.8609 -0.0358 0.0667 -0.0297 23 TRP A CG 147 C CD1 . TRP A 23 ? 0.5821 1.1472 0.8947 -0.0647 0.0774 -0.0138 23 TRP A CD1 148 C CD2 . TRP A 23 ? 0.5721 1.0566 0.8123 -0.0170 0.0776 -0.0390 23 TRP A CD2 149 N NE1 . TRP A 23 ? 0.5958 1.1206 0.8691 -0.0629 0.0953 -0.0124 23 TRP A NE1 150 C CE2 . TRP A 23 ? 0.5912 1.0677 0.8204 -0.0331 0.0946 -0.0283 23 TRP A CE2 151 C CE3 . TRP A 23 ? 0.5628 1.0024 0.7650 0.0100 0.0732 -0.0547 23 TRP A CE3 152 C CZ2 . TRP A 23 ? 0.6044 1.0302 0.7845 -0.0200 0.1059 -0.0337 23 TRP A CZ2 153 C CZ3 . TRP A 23 ? 0.5722 0.9650 0.7304 0.0203 0.0835 -0.0603 23 TRP A CZ3 154 C CH2 . TRP A 23 ? 0.5927 0.9792 0.7394 0.0067 0.0990 -0.0503 23 TRP A CH2 155 N N . SER A 24 ? 0.5562 0.9580 0.7673 -0.0460 0.0176 -0.0653 24 SER A N 156 C CA . SER A 24 ? 0.5514 0.8934 0.7170 -0.0340 0.0160 -0.0787 24 SER A CA 157 C C . SER A 24 ? 0.5648 0.8676 0.7031 -0.0488 0.0220 -0.0781 24 SER A C 158 O O . SER A 24 ? 0.5791 0.8831 0.7254 -0.0753 0.0189 -0.0704 24 SER A O 159 C CB . SER A 24 ? 0.5458 0.8618 0.6990 -0.0366 -0.0050 -0.0892 24 SER A CB 160 N N . ARG A 25 ? 0.5643 0.8303 0.6692 -0.0318 0.0287 -0.0859 25 ARG A N 161 C CA . ARG A 25 ? 0.5802 0.8014 0.6532 -0.0406 0.0299 -0.0881 25 ARG A CA 162 C C . ARG A 25 ? 0.5730 0.7544 0.6159 -0.0240 0.0240 -0.1020 25 ARG A C 163 O O . ARG A 25 ? 0.5629 0.7483 0.6038 -0.0038 0.0259 -0.1076 25 ARG A O 164 C CB . ARG A 25 ? 0.6000 0.8265 0.6665 -0.0409 0.0490 -0.0769 25 ARG A CB 165 C CG . ARG A 25 ? 0.6042 0.8372 0.6591 -0.0124 0.0635 -0.0787 25 ARG A CG 166 C CD . ARG A 25 ? 0.6409 0.8702 0.6785 -0.0124 0.0827 -0.0678 25 ARG A CD 167 N NE . ARG A 25 ? 0.6658 0.8450 0.6690 -0.0226 0.0777 -0.0695 25 ARG A NE 168 C CZ . ARG A 25 ? 0.6939 0.8630 0.6918 -0.0451 0.0826 -0.0572 25 ARG A CZ 169 N NH1 . ARG A 25 ? 0.6996 0.9103 0.7291 -0.0636 0.0936 -0.0412 25 ARG A NH1 170 N NH2 . ARG A 25 ? 0.7179 0.8354 0.6793 -0.0490 0.0762 -0.0602 25 ARG A NH2 171 N N . THR A 26 ? 0.5829 0.7262 0.6032 -0.0327 0.0161 -0.1073 26 THR A N 172 C CA . THR A 26 ? 0.5791 0.6913 0.5763 -0.0191 0.0109 -0.1189 26 THR A CA 173 C C . THR A 26 ? 0.6003 0.6790 0.5699 -0.0189 0.0136 -0.1188 26 THR A C 174 O O . THR A 26 ? 0.6196 0.6795 0.5794 -0.0338 0.0109 -0.1149 26 THR A O 175 C CB . THR A 26 ? 0.5717 0.6733 0.5684 -0.0236 -0.0023 -0.1268 26 THR A CB 176 O OG1 . THR A 26 ? 0.5580 0.6854 0.5740 -0.0188 -0.0054 -0.1272 26 THR A OG1 177 C CG2 . THR A 26 ? 0.5733 0.6480 0.5502 -0.0121 -0.0055 -0.1366 26 THR A CG2 178 N N . ASP A 27 ? 0.6023 0.6703 0.5565 -0.0016 0.0172 -0.1232 27 ASP A N 179 C CA . ASP A 27 ? 0.6260 0.6620 0.5512 0.0033 0.0174 -0.1239 27 ASP A CA 180 C C . ASP A 27 ? 0.6168 0.6391 0.5332 0.0181 0.0081 -0.1357 27 ASP A C 181 O O . ASP A 27 ? 0.6009 0.6363 0.5271 0.0270 0.0063 -0.1409 27 ASP A O 182 C CB . ASP A 27 ? 0.6457 0.6836 0.5577 0.0097 0.0305 -0.1156 27 ASP A CB 183 C CG . ASP A 27 ? 0.6671 0.7227 0.5907 -0.0077 0.0421 -0.1009 27 ASP A CG 184 O OD1 . ASP A 27 ? 0.6923 0.7272 0.6066 -0.0245 0.0396 -0.0952 27 ASP A OD1 185 O OD2 . ASP A 27 ? 0.6687 0.7588 0.6106 -0.0044 0.0536 -0.0946 27 ASP A OD2 186 N N . SER A 28 ? 0.6319 0.6278 0.5303 0.0205 0.0016 -0.1392 28 SER A N 187 C CA . SER A 28 ? 0.6265 0.6169 0.5228 0.0336 -0.0075 -0.1492 28 SER A CA 188 C C . SER A 28 ? 0.6511 0.6160 0.5214 0.0452 -0.0120 -0.1502 28 SER A C 189 O O . SER A 28 ? 0.6816 0.6224 0.5302 0.0420 -0.0095 -0.1440 28 SER A O 190 C CB . SER A 28 ? 0.6153 0.6082 0.5226 0.0302 -0.0129 -0.1546 28 SER A CB 191 O OG . SER A 28 ? 0.6102 0.6239 0.5374 0.0210 -0.0109 -0.1536 28 SER A OG 192 N N . VAL A 29 ? 0.6422 0.6108 0.5137 0.0577 -0.0203 -0.1575 29 VAL A N 193 C CA . VAL A 29 ? 0.6628 0.6120 0.5136 0.0714 -0.0293 -0.1603 29 VAL A CA 194 C C . VAL A 29 ? 0.6444 0.6098 0.5153 0.0790 -0.0407 -0.1692 29 VAL A C 195 O O . VAL A 29 ? 0.6201 0.6090 0.5161 0.0740 -0.0420 -0.1729 29 VAL A O 196 C CB . VAL A 29 ? 0.6847 0.6220 0.5118 0.0807 -0.0306 -0.1591 29 VAL A CB 197 C CG1 . VAL A 29 ? 0.7088 0.6290 0.5116 0.0755 -0.0170 -0.1477 29 VAL A CG1 198 C CG2 . VAL A 29 ? 0.6720 0.6271 0.5130 0.0814 -0.0327 -0.1645 29 VAL A CG2 199 N N . VAL A 30 ? 0.6583 0.6120 0.5186 0.0913 -0.0486 -0.1714 30 VAL A N 200 C CA . VAL A 30 ? 0.6418 0.6186 0.5257 0.1003 -0.0583 -0.1783 30 VAL A CA 201 C C . VAL A 30 ? 0.6608 0.6327 0.5339 0.1160 -0.0736 -0.1815 30 VAL A C 202 O O . VAL A 30 ? 0.6938 0.6357 0.5343 0.1268 -0.0765 -0.1786 30 VAL A O 203 C CB . VAL A 30 ? 0.6446 0.6201 0.5314 0.1051 -0.0542 -0.1793 30 VAL A CB 204 C CG1 . VAL A 30 ? 0.6365 0.6431 0.5504 0.1171 -0.0610 -0.1849 30 VAL A CG1 205 C CG2 . VAL A 30 ? 0.6251 0.6054 0.5209 0.0893 -0.0428 -0.1773 30 VAL A CG2 206 N N . TRP A 31 ? 0.6444 0.6438 0.5432 0.1158 -0.0847 -0.1869 31 TRP A N 207 C CA . TRP A 31 ? 0.6647 0.6647 0.5580 0.1290 -0.1040 -0.1911 31 TRP A CA 208 C C . TRP A 31 ? 0.6511 0.6911 0.5837 0.1353 -0.1147 -0.1953 31 TRP A C 209 O O . TRP A 31 ? 0.6231 0.6960 0.5926 0.1229 -0.1105 -0.1961 31 TRP A O 210 C CB . TRP A 31 ? 0.6693 0.6645 0.5558 0.1220 -0.1128 -0.1944 31 TRP A CB 211 C CG . TRP A 31 ? 0.6862 0.6493 0.5359 0.1196 -0.1015 -0.1902 31 TRP A CG 212 C CD1 . TRP A 31 ? 0.6722 0.6359 0.5256 0.1071 -0.0850 -0.1866 31 TRP A CD1 213 C CD2 . TRP A 31 ? 0.7301 0.6591 0.5341 0.1313 -0.1050 -0.1882 31 TRP A CD2 214 N NE1 . TRP A 31 ? 0.6990 0.6369 0.5169 0.1104 -0.0765 -0.1821 31 TRP A NE1 215 C CE2 . TRP A 31 ? 0.7367 0.6511 0.5216 0.1247 -0.0872 -0.1826 31 TRP A CE2 216 C CE3 . TRP A 31 ? 0.7707 0.6809 0.5470 0.1480 -0.1213 -0.1898 31 TRP A CE3 217 C CZ2 . TRP A 31 ? 0.7789 0.6620 0.5178 0.1335 -0.0821 -0.1778 31 TRP A CZ2 218 C CZ3 . TRP A 31 ? 0.8165 0.6891 0.5416 0.1567 -0.1180 -0.1854 31 TRP A CZ3 219 C CH2 . TRP A 31 ? 0.8192 0.6793 0.5261 0.1490 -0.0971 -0.1791 31 TRP A CH2 220 N N . LEU A 32 ? 0.6750 0.7137 0.6000 0.1553 -0.1279 -0.1969 32 LEU A N 221 C CA . LEU A 32 ? 0.6684 0.7529 0.6346 0.1637 -0.1418 -0.2006 32 LEU A CA 222 C C . LEU A 32 ? 0.6906 0.7757 0.6525 0.1671 -0.1675 -0.2049 32 LEU A C 223 O O . LEU A 32 ? 0.7270 0.7855 0.6549 0.1857 -0.1800 -0.2053 32 LEU A O 224 C CB . LEU A 32 ? 0.6825 0.7715 0.6477 0.1882 -0.1400 -0.2000 32 LEU A CB 225 C CG . LEU A 32 ? 0.6781 0.8224 0.6894 0.2024 -0.1534 -0.2027 32 LEU A CG 226 C CD1 . LEU A 32 ? 0.6374 0.8370 0.7044 0.1844 -0.1438 -0.2018 32 LEU A CD1 227 C CD2 . LEU A 32 ? 0.7023 0.8403 0.7006 0.2335 -0.1515 -0.2026 32 LEU A CD2 228 N N . GLY A 33 ? 0.6759 0.7866 0.6679 0.1486 -0.1768 -0.2080 33 GLY A N 229 C CA . GLY A 33 ? 0.7024 0.8016 0.6808 0.1467 -0.2021 -0.2135 33 GLY A CA 230 C C . GLY A 33 ? 0.7265 0.7688 0.6463 0.1473 -0.1955 -0.2133 33 GLY A C 231 O O . GLY A 33 ? 0.7095 0.7386 0.6226 0.1338 -0.1769 -0.2109 33 GLY A O 232 N N . ASP A 34 ? 0.7704 0.7809 0.6472 0.1648 -0.2098 -0.2148 34 ASP A N 233 C CA . ASP A 34 ? 0.8017 0.7598 0.6190 0.1685 -0.2012 -0.2127 34 ASP A CA 234 C C . ASP A 34 ? 0.8223 0.7491 0.6015 0.1843 -0.1875 -0.2045 34 ASP A C 235 O O . ASP A 34 ? 0.8593 0.7434 0.5853 0.1916 -0.1835 -0.2009 34 ASP A O 236 C CB . ASP A 34 ? 0.8452 0.7798 0.6297 0.1737 -0.2268 -0.2203 34 ASP A CB 237 C CG . ASP A 34 ? 0.8705 0.8263 0.6707 0.1858 -0.2589 -0.2255 34 ASP A CG 238 O OD1 . ASP A 34 ? 0.8715 0.8459 0.6876 0.1999 -0.2588 -0.2215 34 ASP A OD1 239 O OD2 . ASP A 34 ? 0.8991 0.8522 0.6946 0.1820 -0.2856 -0.2340 34 ASP A OD2 240 N N . LEU A 35 ? 0.8049 0.7501 0.6083 0.1895 -0.1798 -0.2011 35 LEU A N 241 C CA . LEU A 35 ? 0.8275 0.7380 0.5958 0.2006 -0.1663 -0.1931 35 LEU A CA 242 C C . LEU A 35 ? 0.7967 0.7089 0.5779 0.1842 -0.1400 -0.1881 35 LEU A C 243 O O . LEU A 35 ? 0.7591 0.7076 0.5841 0.1762 -0.1349 -0.1909 35 LEU A O 244 C CB . LEU A 35 ? 0.8441 0.7633 0.6195 0.2235 -0.1793 -0.1939 35 LEU A CB 245 C CG . LEU A 35 ? 0.8865 0.7980 0.6414 0.2459 -0.2076 -0.1970 35 LEU A CG 246 C CD1 . LEU A 35 ? 0.8965 0.8250 0.6676 0.2703 -0.2168 -0.1974 35 LEU A CD1 247 C CD2 . LEU A 35 ? 0.9420 0.7922 0.6260 0.2539 -0.2076 -0.1909 35 LEU A CD2 248 N N . GLN A 36 ? 0.8166 0.6910 0.5598 0.1785 -0.1237 -0.1799 36 GLN A N 249 C CA . GLN A 36 ? 0.7959 0.6696 0.5488 0.1623 -0.1020 -0.1746 36 GLN A CA 250 C C . GLN A 36 ? 0.8117 0.6733 0.5614 0.1715 -0.1004 -0.1729 36 GLN A C 251 O O . GLN A 36 ? 0.8574 0.6838 0.5707 0.1874 -0.1070 -0.1693 36 GLN A O 252 C CB . GLN A 36 ? 0.8129 0.6565 0.5315 0.1515 -0.0858 -0.1650 36 GLN A CB 253 C CG . GLN A 36 ? 0.7791 0.6329 0.5171 0.1308 -0.0664 -0.1603 36 GLN A CG 254 C CD . GLN A 36 ? 0.7878 0.6204 0.4989 0.1196 -0.0494 -0.1487 36 GLN A CD 255 O OE1 . GLN A 36 ? 0.8205 0.6312 0.4964 0.1273 -0.0488 -0.1441 36 GLN A OE1 256 N NE2 . GLN A 36 ? 0.7598 0.6013 0.4880 0.1013 -0.0354 -0.1435 36 GLN A NE2 257 N N . THR A 37 ? 0.7823 0.6685 0.5650 0.1633 -0.0922 -0.1758 37 THR A N 258 C CA . THR A 37 ? 0.8031 0.6755 0.5797 0.1739 -0.0900 -0.1762 37 THR A CA 259 C C . THR A 37 ? 0.8104 0.6552 0.5708 0.1563 -0.0745 -0.1706 37 THR A C 260 O O . THR A 37 ? 0.8513 0.6541 0.5786 0.1624 -0.0740 -0.1674 37 THR A O 261 C CB . THR A 37 ? 0.7746 0.6937 0.5953 0.1824 -0.0929 -0.1840 37 THR A CB 262 O OG1 . THR A 37 ? 0.7330 0.6863 0.5887 0.1615 -0.0835 -0.1853 37 THR A OG1 263 C CG2 . THR A 37 ? 0.7779 0.7258 0.6169 0.2008 -0.1113 -0.1886 37 THR A CG2 264 N N . HIS A 38 ? 0.7778 0.6438 0.5601 0.1344 -0.0640 -0.1693 38 HIS A N 265 C CA . HIS A 38 ? 0.7827 0.6311 0.5570 0.1153 -0.0521 -0.1641 38 HIS A CA 266 C C . HIS A 38 ? 0.7747 0.6271 0.5495 0.0954 -0.0423 -0.1563 38 HIS A C 267 O O . HIS A 38 ? 0.7551 0.6302 0.5427 0.0958 -0.0427 -0.1575 38 HIS A O 268 C CB . HIS A 38 ? 0.7533 0.6270 0.5559 0.1104 -0.0480 -0.1702 38 HIS A CB 269 C CG . HIS A 38 ? 0.7651 0.6390 0.5676 0.1317 -0.0533 -0.1773 38 HIS A CG 270 N ND1 . HIS A 38 ? 0.7451 0.6561 0.5748 0.1480 -0.0598 -0.1828 38 HIS A ND1 271 C CD2 . HIS A 38 ? 0.7928 0.6355 0.5715 0.1405 -0.0528 -0.1798 38 HIS A CD2 272 C CE1 . HIS A 38 ? 0.7648 0.6735 0.5909 0.1679 -0.0609 -0.1876 38 HIS A CE1 273 N NE2 . HIS A 38 ? 0.7946 0.6584 0.5863 0.1654 -0.0567 -0.1867 38 HIS A NE2 274 N N . ARG A 39 ? 0.7964 0.6263 0.5570 0.0786 -0.0342 -0.1485 39 ARG A N 275 C CA . ARG A 39 ? 0.7916 0.6323 0.5588 0.0589 -0.0226 -0.1395 39 ARG A CA 276 C C . ARG A 39 ? 0.7887 0.6318 0.5690 0.0389 -0.0188 -0.1377 39 ARG A C 277 O O . ARG A 39 ? 0.8184 0.6282 0.5787 0.0365 -0.0235 -0.1382 39 ARG A O 278 C CB . ARG A 39 ? 0.8352 0.6424 0.5660 0.0567 -0.0174 -0.1275 39 ARG A CB 279 C CG . ARG A 39 ? 0.8432 0.6564 0.5782 0.0327 -0.0029 -0.1145 39 ARG A CG 280 C CD . ARG A 39 ? 0.9068 0.6790 0.6014 0.0272 0.0032 -0.1001 39 ARG A CD 281 N NE . ARG A 39 ? 0.9384 0.6998 0.6057 0.0473 0.0030 -0.0991 39 ARG A NE 282 C CZ . ARG A 39 ? 0.9866 0.7056 0.6140 0.0638 -0.0065 -0.0989 39 ARG A CZ 283 N NH1 . ARG A 39 ? 1.0202 0.7007 0.6289 0.0641 -0.0153 -0.0994 39 ARG A NH1 284 N NH2 . ARG A 39 ? 1.0003 0.7117 0.6024 0.0819 -0.0086 -0.0985 39 ARG A NH2 285 N N . TRP A 40 ? 0.7589 0.6378 0.5691 0.0261 -0.0124 -0.1363 40 TRP A N 286 C CA . TRP A 40 ? 0.7600 0.6436 0.5828 0.0058 -0.0111 -0.1336 40 TRP A CA 287 C C . TRP A 40 ? 0.7488 0.6622 0.5927 -0.0105 -0.0010 -0.1236 40 TRP A C 288 O O . TRP A 40 ? 0.7134 0.6635 0.5851 -0.0090 0.0014 -0.1262 40 TRP A O 289 C CB . TRP A 40 ? 0.7351 0.6347 0.5757 0.0098 -0.0171 -0.1444 40 TRP A CB 290 C CG . TRP A 40 ? 0.7512 0.6402 0.5906 -0.0075 -0.0210 -0.1440 40 TRP A CG 291 C CD1 . TRP A 40 ? 0.7939 0.6523 0.6147 -0.0255 -0.0233 -0.1370 40 TRP A CD1 292 C CD2 . TRP A 40 ? 0.7363 0.6409 0.5897 -0.0093 -0.0249 -0.1510 40 TRP A CD2 293 N NE1 . TRP A 40 ? 0.8013 0.6555 0.6244 -0.0388 -0.0308 -0.1405 40 TRP A NE1 294 C CE2 . TRP A 40 ? 0.7660 0.6478 0.6069 -0.0275 -0.0314 -0.1492 40 TRP A CE2 295 C CE3 . TRP A 40 ? 0.7092 0.6421 0.5817 0.0014 -0.0240 -0.1578 40 TRP A CE3 296 C CZ2 . TRP A 40 ? 0.7640 0.6499 0.6079 -0.0326 -0.0379 -0.1552 40 TRP A CZ2 297 C CZ3 . TRP A 40 ? 0.7062 0.6436 0.5817 -0.0037 -0.0277 -0.1619 40 TRP A CZ3 298 C CH2 . TRP A 40 ? 0.7326 0.6464 0.5925 -0.0192 -0.0350 -0.1613 40 TRP A CH2 299 N N . SER A 41 ? 0.7846 0.6815 0.6145 -0.0253 0.0051 -0.1111 41 SER A N 300 C CA . SER A 41 ? 0.7817 0.7111 0.6336 -0.0412 0.0171 -0.0988 41 SER A CA 301 C C . SER A 41 ? 0.7678 0.7207 0.6492 -0.0608 0.0118 -0.0985 41 SER A C 302 O O . SER A 41 ? 0.7829 0.7099 0.6542 -0.0687 -0.0003 -0.1043 41 SER A O 303 C CB . SER A 41 ? 0.8269 0.7304 0.6543 -0.0542 0.0260 -0.0834 41 SER A CB 304 O OG . SER A 41 ? 0.8276 0.7704 0.6781 -0.0658 0.0419 -0.0698 41 SER A OG 305 N N . ASN A 42 ? 0.7461 0.7467 0.6612 -0.0663 0.0200 -0.0924 42 ASN A N 306 C CA . ASN A 42 ? 0.7370 0.7656 0.6829 -0.0860 0.0137 -0.0897 42 ASN A CA 307 C C . ASN A 42 ? 0.7775 0.7822 0.7150 -0.1154 0.0088 -0.0798 42 ASN A C 308 O O . ASN A 42 ? 0.7861 0.7830 0.7282 -0.1315 -0.0058 -0.0835 42 ASN A O 309 C CB . ASN A 42 ? 0.7124 0.7992 0.6960 -0.0839 0.0250 -0.0821 42 ASN A CB 310 C CG . ASN A 42 ? 0.6985 0.8188 0.7157 -0.0952 0.0143 -0.0833 42 ASN A CG 311 O OD1 . ASN A 42 ? 0.6806 0.8038 0.7007 -0.0824 0.0055 -0.0945 42 ASN A OD1 312 N ND2 . ASN A 42 ? 0.7248 0.8712 0.7674 -0.1202 0.0142 -0.0708 42 ASN A ND2 313 N N . ASP A 43 ? 0.8088 0.7969 0.7292 -0.1225 0.0204 -0.0672 43 ASP A N 314 C CA . ASP A 43 ? 0.8572 0.8169 0.7658 -0.1532 0.0176 -0.0546 43 ASP A CA 315 C C . ASP A 43 ? 0.8911 0.7854 0.7613 -0.1581 -0.0013 -0.0646 43 ASP A C 316 O O . ASP A 43 ? 0.9290 0.7982 0.7929 -0.1870 -0.0114 -0.0586 43 ASP A O 317 C CB . ASP A 43 ? 0.8913 0.8374 0.7787 -0.1545 0.0357 -0.0390 43 ASP A CB 318 C CG . ASP A 43 ? 0.8752 0.8821 0.7932 -0.1463 0.0574 -0.0288 43 ASP A CG 319 O OD1 . ASP A 43 ? 0.8475 0.9095 0.8085 -0.1449 0.0576 -0.0312 43 ASP A OD1 320 O OD2 . ASP A 43 ? 0.9098 0.9065 0.8047 -0.1390 0.0742 -0.0184 43 ASP A OD2 321 N N . SER A 44 ? 0.8811 0.7481 0.7254 -0.1295 -0.0063 -0.0796 44 SER A N 322 C CA . SER A 44 ? 0.9178 0.7217 0.7203 -0.1248 -0.0209 -0.0897 44 SER A CA 323 C C . SER A 44 ? 0.8996 0.7070 0.7082 -0.1183 -0.0346 -0.1056 44 SER A C 324 O O . SER A 44 ? 0.8514 0.7001 0.6854 -0.1021 -0.0316 -0.1131 44 SER A O 325 C CB . SER A 44 ? 0.9269 0.6998 0.6960 -0.0953 -0.0171 -0.0945 44 SER A CB 326 O OG . SER A 44 ? 0.9685 0.6798 0.6953 -0.0872 -0.0299 -0.1029 44 SER A OG 327 N N . ALA A 45 ? 0.9448 0.7038 0.7252 -0.1311 -0.0498 -0.1104 45 ALA A N 328 C CA . ALA A 45 ? 0.9427 0.6925 0.7151 -0.1219 -0.0626 -0.1261 45 ALA A CA 329 C C . ALA A 45 ? 0.9512 0.6698 0.6915 -0.0876 -0.0620 -0.1393 45 ALA A C 330 O O . ALA A 45 ? 0.9486 0.6637 0.6808 -0.0734 -0.0677 -0.1521 45 ALA A O 331 C CB . ALA A 45 ? 0.9959 0.7040 0.7470 -0.1492 -0.0807 -0.1268 45 ALA A CB 332 N N . THR A 46 ? 0.9640 0.6635 0.6869 -0.0734 -0.0547 -0.1351 46 THR A N 333 C CA . THR A 46 ? 0.9770 0.6493 0.6719 -0.0404 -0.0554 -0.1456 46 THR A CA 334 C C . THR A 46 ? 0.9324 0.6450 0.6496 -0.0193 -0.0443 -0.1443 46 THR A C 335 O O . THR A 46 ? 0.9209 0.6528 0.6516 -0.0282 -0.0362 -0.1331 46 THR A O 336 C CB . THR A 46 ? 1.0514 0.6493 0.6936 -0.0394 -0.0624 -0.1430 46 THR A CB 337 O OG1 . THR A 46 ? 1.1002 0.6605 0.7253 -0.0713 -0.0729 -0.1384 46 THR A OG1 338 C CG2 . THR A 46 ? 1.0828 0.6455 0.6913 -0.0053 -0.0680 -0.1572 46 THR A CG2 339 N N . ILE A 47 ? 0.9111 0.6370 0.6316 0.0082 -0.0443 -0.1555 47 ILE A N 340 C CA . ILE A 47 ? 0.8774 0.6324 0.6133 0.0289 -0.0389 -0.1560 47 ILE A CA 341 C C . ILE A 47 ? 0.9230 0.6327 0.6213 0.0436 -0.0427 -0.1530 47 ILE A C 342 O O . ILE A 47 ? 0.9701 0.6345 0.6343 0.0561 -0.0497 -0.1584 47 ILE A O 343 C CB . ILE A 47 ? 0.8447 0.6328 0.6012 0.0503 -0.0385 -0.1674 47 ILE A CB 344 C CG1 . ILE A 47 ? 0.8069 0.6321 0.5932 0.0365 -0.0353 -0.1693 47 ILE A CG1 345 C CG2 . ILE A 47 ? 0.8177 0.6354 0.5919 0.0679 -0.0368 -0.1679 47 ILE A CG2 346 C CD1 . ILE A 47 ? 0.7886 0.6364 0.5866 0.0531 -0.0334 -0.1788 47 ILE A CD1 347 N N . SER A 48 ? 0.9152 0.6331 0.6148 0.0441 -0.0383 -0.1446 48 SER A N 348 C CA . SER A 48 ? 0.9619 0.6344 0.6216 0.0566 -0.0420 -0.1392 48 SER A CA 349 C C . SER A 48 ? 0.9495 0.6380 0.6123 0.0882 -0.0473 -0.1463 48 SER A C 350 O O . SER A 48 ? 0.8993 0.6379 0.5972 0.0928 -0.0453 -0.1504 48 SER A O 351 C CB . SER A 48 ? 0.9773 0.6427 0.6279 0.0371 -0.0335 -0.1234 48 SER A CB 352 O OG . SER A 48 ? 0.9874 0.6474 0.6434 0.0052 -0.0291 -0.1152 48 SER A OG 353 N N . PHE A 49 ? 0.9978 0.6417 0.6229 0.1096 -0.0559 -0.1474 49 PHE A N 354 C CA . PHE A 49 ? 0.9958 0.6523 0.6211 0.1402 -0.0641 -0.1524 49 PHE A CA 355 C C . PHE A 49 ? 1.0129 0.6564 0.6173 0.1399 -0.0644 -0.1422 49 PHE A C 356 O O . PHE A 49 ? 1.0580 0.6539 0.6242 0.1275 -0.0608 -0.1303 49 PHE A O 357 C CB . PHE A 49 ? 1.0479 0.6625 0.6399 0.1688 -0.0742 -0.1581 49 PHE A CB 358 C CG . PHE A 49 ? 1.0469 0.6655 0.6479 0.1746 -0.0730 -0.1686 49 PHE A CG 359 C CD1 . PHE A 49 ? 1.1121 0.6668 0.6665 0.1841 -0.0778 -0.1709 49 PHE A CD1 360 C CD2 . PHE A 49 ? 0.9896 0.6699 0.6394 0.1716 -0.0670 -0.1761 49 PHE A CD2 361 C CE1 . PHE A 49 ? 1.1214 0.6746 0.6760 0.1927 -0.0764 -0.1817 49 PHE A CE1 362 C CE2 . PHE A 49 ? 0.9922 0.6742 0.6443 0.1788 -0.0641 -0.1850 49 PHE A CE2 363 C CZ . PHE A 49 ? 1.0602 0.6791 0.6638 0.1905 -0.0686 -0.1885 49 PHE A CZ 364 N N . THR A 50 ? 0.9807 0.6645 0.6079 0.1525 -0.0690 -0.1465 50 THR A N 365 C CA . THR A 50 ? 1.0033 0.6731 0.6046 0.1585 -0.0719 -0.1393 50 THR A CA 366 C C . THR A 50 ? 1.0328 0.6901 0.6156 0.1917 -0.0899 -0.1443 50 THR A C 367 O O . THR A 50 ? 1.0581 0.7032 0.6162 0.2022 -0.0970 -0.1403 50 THR A O 368 C CB . THR A 50 ? 0.9583 0.6743 0.5896 0.1483 -0.0668 -0.1405 50 THR A CB 369 O OG1 . THR A 50 ? 0.9147 0.6799 0.5901 0.1573 -0.0752 -0.1531 50 THR A OG1 370 C CG2 . THR A 50 ? 0.9357 0.6643 0.5830 0.1192 -0.0493 -0.1338 50 THR A CG2 371 N N . LYS A 51 ? 1.0313 0.6936 0.6255 0.2100 -0.0972 -0.1530 51 LYS A N 372 C CA . LYS A 51 ? 1.0621 0.7154 0.6420 0.2452 -0.1146 -0.1576 51 LYS A CA 373 C C . LYS A 51 ? 1.0996 0.7137 0.6558 0.2607 -0.1153 -0.1602 51 LYS A C 374 O O . LYS A 51 ? 1.0845 0.6980 0.6511 0.2454 -0.1045 -0.1628 51 LYS A O 375 C CB . LYS A 51 ? 1.0143 0.7381 0.6492 0.2585 -0.1245 -0.1685 51 LYS A CB 376 C CG . LYS A 51 ? 0.9826 0.7416 0.6391 0.2454 -0.1279 -0.1688 51 LYS A CG 377 C CD . LYS A 51 ? 1.0310 0.7620 0.6480 0.2619 -0.1437 -0.1650 51 LYS A CD 378 C CE . LYS A 51 ? 1.0099 0.7627 0.6356 0.2479 -0.1458 -0.1658 51 LYS A CE 379 N NZ . LYS A 51 ? 1.0013 0.7356 0.6115 0.2213 -0.1243 -0.1575 51 LYS A NZ 380 N N . PRO A 52 ? 1.1545 0.7319 0.6744 0.2932 -0.1295 -0.1600 52 PRO A N 381 C CA . PRO A 52 ? 1.1966 0.7351 0.6911 0.3153 -0.1317 -0.1647 52 PRO A CA 382 C C . PRO A 52 ? 1.1538 0.7529 0.6987 0.3335 -0.1301 -0.1778 52 PRO A C 383 O O . PRO A 52 ? 1.1855 0.7576 0.7126 0.3484 -0.1271 -0.1833 52 PRO A O 384 C CB . PRO A 52 ? 1.2664 0.7571 0.7120 0.3495 -0.1489 -0.1607 52 PRO A CB 385 C CG . PRO A 52 ? 1.2431 0.7756 0.7092 0.3525 -0.1591 -0.1590 52 PRO A CG 386 C CD . PRO A 52 ? 1.1920 0.7508 0.6820 0.3118 -0.1445 -0.1547 52 PRO A CD 387 N N . TRP A 53 ? 1.0885 0.7658 0.6927 0.3316 -0.1317 -0.1823 53 TRP A N 388 C CA . TRP A 53 ? 1.0459 0.7898 0.7039 0.3461 -0.1283 -0.1921 53 TRP A CA 389 C C . TRP A 53 ? 0.9815 0.7742 0.6859 0.3137 -0.1129 -0.1940 53 TRP A C 390 O O . TRP A 53 ? 0.9428 0.7992 0.6975 0.3196 -0.1090 -0.1996 53 TRP A O 391 C CB . TRP A 53 ? 1.0323 0.8325 0.7268 0.3720 -0.1449 -0.1952 53 TRP A CB 392 C CG . TRP A 53 ? 1.0056 0.8214 0.7090 0.3554 -0.1562 -0.1910 53 TRP A CG 393 C CD1 . TRP A 53 ? 1.0468 0.8199 0.7064 0.3654 -0.1713 -0.1855 53 TRP A CD1 394 C CD2 . TRP A 53 ? 0.9367 0.8090 0.6892 0.3280 -0.1539 -0.1924 53 TRP A CD2 395 N NE1 . TRP A 53 ? 1.0154 0.8153 0.6924 0.3470 -0.1783 -0.1844 53 TRP A NE1 396 C CE2 . TRP A 53 ? 0.9477 0.8068 0.6815 0.3240 -0.1686 -0.1889 53 TRP A CE2 397 C CE3 . TRP A 53 ? 0.8773 0.8048 0.6828 0.3074 -0.1413 -0.1959 53 TRP A CE3 398 C CZ2 . TRP A 53 ? 0.9023 0.7987 0.6671 0.3009 -0.1719 -0.1904 53 TRP A CZ2 399 C CZ3 . TRP A 53 ? 0.8294 0.7936 0.6673 0.2831 -0.1447 -0.1960 53 TRP A CZ3 400 C CH2 . TRP A 53 ? 0.8427 0.7899 0.6596 0.2806 -0.1603 -0.1940 53 TRP A CH2 401 N N . SER A 54 ? 0.9744 0.7378 0.6617 0.2803 -0.1039 -0.1884 54 SER A N 402 C CA . SER A 54 ? 0.9177 0.7218 0.6440 0.2498 -0.0913 -0.1890 54 SER A CA 403 C C . SER A 54 ? 0.9066 0.7251 0.6470 0.2506 -0.0796 -0.1952 54 SER A C 404 O O . SER A 54 ? 0.8568 0.7209 0.6363 0.2333 -0.0708 -0.1967 54 SER A O 405 C CB . SER A 54 ? 0.9178 0.6887 0.6219 0.2177 -0.0849 -0.1807 54 SER A CB 406 O OG . SER A 54 ? 0.9278 0.6948 0.6224 0.2156 -0.0922 -0.1749 54 SER A OG 407 N N . GLN A 55 ? 0.9600 0.7344 0.6631 0.2719 -0.0798 -0.1989 55 GLN A N 408 C CA . GLN A 55 ? 0.9645 0.7455 0.6706 0.2786 -0.0691 -0.2061 55 GLN A CA 409 C C . GLN A 55 ? 0.9360 0.7897 0.6918 0.3015 -0.0649 -0.2112 55 GLN A C 410 O O . GLN A 55 ? 0.9194 0.8017 0.6937 0.3003 -0.0520 -0.2151 55 GLN A O 411 C CB . GLN A 55 ? 1.0390 0.7435 0.6830 0.2976 -0.0722 -0.2098 55 GLN A CB 412 C CG . GLN A 55 ? 1.0519 0.7430 0.6820 0.2982 -0.0621 -0.2176 55 GLN A CG 413 C CD . GLN A 55 ? 1.1357 0.7336 0.6947 0.3042 -0.0683 -0.2206 55 GLN A CD 414 O OE1 . GLN A 55 ? 1.1639 0.7074 0.6905 0.2811 -0.0757 -0.2134 55 GLN A OE1 415 N NE2 . GLN A 55 ? 1.1737 0.7514 0.7064 0.3348 -0.0647 -0.2310 55 GLN A NE2 416 N N . GLY A 56 ? 0.9345 0.8195 0.7117 0.3212 -0.0760 -0.2103 56 GLY A N 417 C CA . GLY A 56 ? 0.9117 0.8715 0.7414 0.3430 -0.0740 -0.2134 56 GLY A CA 418 C C . GLY A 56 ? 0.9616 0.9096 0.7706 0.3849 -0.0698 -0.2197 56 GLY A C 419 O O . GLY A 56 ? 1.0199 0.9059 0.7773 0.4081 -0.0792 -0.2212 56 GLY A O 420 N N . LYS A 57 ? 0.9434 0.9487 0.7896 0.3958 -0.0547 -0.2226 57 LYS A N 421 C CA . LYS A 57 ? 0.9932 0.9934 0.8205 0.4392 -0.0464 -0.2292 57 LYS A CA 422 C C . LYS A 57 ? 1.0202 0.9735 0.8043 0.4347 -0.0305 -0.2346 57 LYS A C 423 O O . LYS A 57 ? 1.0707 1.0064 0.8263 0.4709 -0.0221 -0.2417 57 LYS A O 424 C CB . LYS A 57 ? 0.9647 1.0643 0.8607 0.4610 -0.0387 -0.2282 57 LYS A CB 425 C CG . LYS A 57 ? 0.9634 1.1047 0.8944 0.4797 -0.0588 -0.2254 57 LYS A CG 426 C CD . LYS A 57 ? 1.0325 1.1373 0.9236 0.5321 -0.0679 -0.2305 57 LYS A CD 427 N N . LEU A 58 ? 0.9920 0.9240 0.7692 0.3923 -0.0277 -0.2318 58 LEU A N 428 C CA . LEU A 58 ? 1.0148 0.9026 0.7520 0.3822 -0.0167 -0.2367 58 LEU A CA 429 C C . LEU A 58 ? 1.0953 0.8850 0.7545 0.3985 -0.0256 -0.2432 58 LEU A C 430 O O . LEU A 58 ? 1.1215 0.8632 0.7532 0.3971 -0.0411 -0.2403 58 LEU A O 431 C CB . LEU A 58 ? 0.9667 0.8549 0.7164 0.3333 -0.0160 -0.2311 58 LEU A CB 432 C CG . LEU A 58 ? 0.8939 0.8600 0.7080 0.3087 -0.0074 -0.2247 58 LEU A CG 433 C CD1 . LEU A 58 ? 0.8696 0.8140 0.6763 0.2680 -0.0077 -0.2212 58 LEU A CD1 434 C CD2 . LEU A 58 ? 0.8859 0.9097 0.7292 0.3260 0.0115 -0.2259 58 LEU A CD2 435 N N . SER A 59 ? 1.1412 0.8972 0.7606 0.4134 -0.0160 -0.2518 59 SER A N 436 C CA . SER A 59 ? 1.2283 0.8821 0.7674 0.4255 -0.0258 -0.2594 59 SER A CA 437 C C . SER A 59 ? 1.2297 0.8279 0.7418 0.3776 -0.0357 -0.2558 59 SER A C 438 O O . SER A 59 ? 1.1656 0.8081 0.7203 0.3407 -0.0322 -0.2489 59 SER A O 439 C CB . SER A 59 ? 1.2827 0.9171 0.7838 0.4596 -0.0131 -0.2713 59 SER A CB 440 O OG . SER A 59 ? 1.2568 0.9064 0.7633 0.4336 -0.0021 -0.2726 59 SER A OG 441 N N . ASN A 60 ? 1.3084 0.8103 0.7506 0.3783 -0.0486 -0.2599 60 ASN A N 442 C CA . ASN A 60 ? 1.3213 0.7697 0.7376 0.3324 -0.0589 -0.2560 60 ASN A CA 443 C C . ASN A 60 ? 1.3013 0.7678 0.7252 0.3097 -0.0515 -0.2602 60 ASN A C 444 O O . ASN A 60 ? 1.2524 0.7432 0.7065 0.2686 -0.0529 -0.2526 60 ASN A O 445 C CB . ASN A 60 ? 1.4202 0.7570 0.7563 0.3381 -0.0749 -0.2599 60 ASN A CB 446 C CG . ASN A 60 ? 1.4444 0.7532 0.7682 0.3495 -0.0848 -0.2518 60 ASN A CG 447 O OD1 . ASN A 60 ? 1.3850 0.7580 0.7598 0.3521 -0.0813 -0.2438 60 ASN A OD1 448 N ND2 . ASN A 60 ? 1.5394 0.7465 0.7904 0.3560 -0.0988 -0.2537 60 ASN A ND2 449 N N . GLN A 61 ? 1.3448 0.7998 0.7393 0.3398 -0.0433 -0.2722 61 GLN A N 450 C CA . GLN A 61 ? 1.3373 0.8048 0.7294 0.3251 -0.0362 -0.2771 61 GLN A CA 451 C C . GLN A 61 ? 1.2446 0.8122 0.7122 0.3093 -0.0210 -0.2685 61 GLN A C 452 O O . GLN A 61 ? 1.2179 0.7990 0.6963 0.2792 -0.0204 -0.2664 61 GLN A O 453 C CB . GLN A 61 ? 1.4080 0.8423 0.7472 0.3679 -0.0279 -0.2917 61 GLN A CB 454 N N . GLN A 62 ? 1.2026 0.8376 0.7209 0.3294 -0.0107 -0.2634 62 GLN A N 455 C CA . GLN A 62 ? 1.1206 0.8465 0.7109 0.3129 0.0014 -0.2543 62 GLN A CA 456 C C . GLN A 62 ? 1.0685 0.8052 0.6899 0.2701 -0.0089 -0.2441 62 GLN A C 457 O O . GLN A 62 ? 1.0142 0.7975 0.6744 0.2451 -0.0031 -0.2383 62 GLN A O 458 C CB . GLN A 62 ? 1.0963 0.8884 0.7324 0.3436 0.0110 -0.2516 62 GLN A CB 459 C CG . GLN A 62 ? 1.1167 0.9493 0.7587 0.3773 0.0318 -0.2562 62 GLN A CG 460 C CD . GLN A 62 ? 1.0952 1.0062 0.7953 0.4027 0.0400 -0.2513 62 GLN A CD 461 O OE1 . GLN A 62 ? 1.0482 1.0376 0.8061 0.3933 0.0537 -0.2439 62 GLN A OE1 462 N NE2 . GLN A 62 ? 1.1302 1.0197 0.8154 0.4336 0.0299 -0.2547 62 GLN A NE2 463 N N . TRP A 63 ? 1.0901 0.7821 0.6915 0.2639 -0.0234 -0.2415 63 TRP A N 464 C CA . TRP A 63 ? 1.0504 0.7487 0.6752 0.2271 -0.0314 -0.2315 63 TRP A CA 465 C C . TRP A 63 ? 1.0591 0.7244 0.6644 0.1922 -0.0372 -0.2306 63 TRP A C 466 O O . TRP A 63 ? 1.0081 0.7105 0.6497 0.1636 -0.0358 -0.2235 63 TRP A O 467 C CB . TRP A 63 ? 1.0775 0.7382 0.6833 0.2326 -0.0428 -0.2272 63 TRP A CB 468 C CG . TRP A 63 ? 1.0453 0.7079 0.6676 0.1969 -0.0484 -0.2163 63 TRP A CG 469 C CD1 . TRP A 63 ? 1.0791 0.6841 0.6674 0.1731 -0.0575 -0.2111 63 TRP A CD1 470 C CD2 . TRP A 63 ? 0.9791 0.7044 0.6546 0.1813 -0.0442 -0.2090 63 TRP A CD2 471 N NE1 . TRP A 63 ? 1.0377 0.6712 0.6569 0.1460 -0.0566 -0.2004 63 TRP A NE1 472 C CE2 . TRP A 63 ? 0.9778 0.6812 0.6472 0.1521 -0.0493 -0.1999 63 TRP A CE2 473 C CE3 . TRP A 63 ? 0.9267 0.7225 0.6530 0.1887 -0.0370 -0.2088 63 TRP A CE3 474 C CZ2 . TRP A 63 ? 0.9240 0.6713 0.6318 0.1347 -0.0465 -0.1923 63 TRP A CZ2 475 C CZ3 . TRP A 63 ? 0.8774 0.7107 0.6400 0.1683 -0.0373 -0.2017 63 TRP A CZ3 476 C CH2 . TRP A 63 ? 0.8762 0.6840 0.6272 0.1439 -0.0416 -0.1942 63 TRP A CH2 477 N N . GLU A 64 ? 1.1298 0.7247 0.6771 0.1958 -0.0453 -0.2382 64 GLU A N 478 C CA . GLU A 64 ? 1.1489 0.7087 0.6748 0.1625 -0.0551 -0.2383 64 GLU A CA 479 C C . GLU A 64 ? 1.1059 0.7139 0.6593 0.1511 -0.0473 -0.2391 64 GLU A C 480 O O . GLU A 64 ? 1.0732 0.6984 0.6492 0.1184 -0.0522 -0.2326 64 GLU A O 481 C CB . GLU A 64 ? 1.2422 0.7125 0.6952 0.1715 -0.0674 -0.2486 64 GLU A CB 482 C CG . GLU A 64 ? 1.3026 0.7077 0.7202 0.1688 -0.0799 -0.2447 64 GLU A CG 483 C CD . GLU A 64 ? 1.2920 0.6922 0.7266 0.1227 -0.0889 -0.2316 64 GLU A CD 484 O OE1 . GLU A 64 ? 1.3019 0.6882 0.7308 0.0916 -0.0980 -0.2316 64 GLU A OE1 485 O OE2 . GLU A 64 ? 1.2713 0.6832 0.7245 0.1185 -0.0870 -0.2209 64 GLU A OE2 486 N N . LYS A 65 ? 1.1084 0.7395 0.6595 0.1798 -0.0343 -0.2461 65 LYS A N 487 C CA . LYS A 65 ? 1.0747 0.7500 0.6470 0.1730 -0.0244 -0.2456 65 LYS A CA 488 C C . LYS A 65 ? 0.9937 0.7405 0.6322 0.1538 -0.0175 -0.2339 65 LYS A C 489 O O . LYS A 65 ? 0.9665 0.7372 0.6218 0.1339 -0.0166 -0.2301 65 LYS A O 490 C CB . LYS A 65 ? 1.0988 0.7876 0.6558 0.2102 -0.0078 -0.2531 65 LYS A CB 491 N N . LEU A 66 ? 0.9625 0.7387 0.6338 0.1612 -0.0145 -0.2287 66 LEU A N 492 C CA . LEU A 66 ? 0.8949 0.7304 0.6226 0.1451 -0.0102 -0.2191 66 LEU A CA 493 C C . LEU A 66 ? 0.8756 0.6998 0.6113 0.1134 -0.0212 -0.2123 66 LEU A C 494 O O . LEU A 66 ? 0.8330 0.6924 0.6005 0.0946 -0.0193 -0.2062 66 LEU A O 495 C CB . LEU A 66 ? 0.8771 0.7453 0.6332 0.1649 -0.0063 -0.2171 66 LEU A CB 496 C CG . LEU A 66 ? 0.8178 0.7513 0.6304 0.1555 -0.0003 -0.2098 66 LEU A CG 497 C CD1 . LEU A 66 ? 0.8063 0.7828 0.6389 0.1635 0.0146 -0.2095 66 LEU A CD1 498 C CD2 . LEU A 66 ? 0.8119 0.7635 0.6454 0.1687 -0.0051 -0.2081 66 LEU A CD2 499 N N . GLN A 67 ? 0.9104 0.6850 0.6160 0.1087 -0.0318 -0.2124 67 GLN A N 500 C CA . GLN A 67 ? 0.8994 0.6628 0.6104 0.0786 -0.0402 -0.2045 67 GLN A CA 501 C C . GLN A 67 ? 0.9033 0.6608 0.6090 0.0556 -0.0461 -0.2048 67 GLN A C 502 O O . GLN A 67 ? 0.8681 0.6575 0.6051 0.0344 -0.0465 -0.1974 67 GLN A O 503 C CB . GLN A 67 ? 0.9493 0.6556 0.6241 0.0778 -0.0492 -0.2031 67 GLN A CB 504 C CG . GLN A 67 ? 0.9459 0.6424 0.6265 0.0451 -0.0553 -0.1928 67 GLN A CG 505 C CD . GLN A 67 ? 0.9911 0.6398 0.6421 0.0448 -0.0603 -0.1875 67 GLN A CD 506 O OE1 . GLN A 67 ? 0.9726 0.6396 0.6406 0.0441 -0.0558 -0.1791 67 GLN A OE1 507 N NE2 . GLN A 67 ? 1.0534 0.6352 0.6546 0.0461 -0.0703 -0.1922 67 GLN A NE2 508 N N . HIS A 68 ? 0.9503 0.6664 0.6143 0.0622 -0.0517 -0.2139 68 HIS A N 509 C CA . HIS A 68 ? 0.9614 0.6677 0.6139 0.0429 -0.0609 -0.2159 68 HIS A CA 510 C C . HIS A 68 ? 0.9049 0.6692 0.5958 0.0388 -0.0528 -0.2119 68 HIS A C 511 O O . HIS A 68 ? 0.8888 0.6671 0.5949 0.0162 -0.0606 -0.2072 68 HIS A O 512 C CB . HIS A 68 ? 1.0291 0.6806 0.6239 0.0587 -0.0667 -0.2288 68 HIS A CB 513 C CG . HIS A 68 ? 1.0545 0.6899 0.6301 0.0403 -0.0798 -0.2323 68 HIS A CG 514 N ND1 . HIS A 68 ? 1.0377 0.7049 0.6209 0.0457 -0.0735 -0.2338 68 HIS A ND1 515 C CD2 . HIS A 68 ? 1.1047 0.6944 0.6527 0.0156 -0.1007 -0.2343 68 HIS A CD2 516 C CE1 . HIS A 68 ? 1.0712 0.7128 0.6304 0.0276 -0.0908 -0.2372 68 HIS A CE1 517 N NE2 . HIS A 68 ? 1.1138 0.7102 0.6537 0.0082 -0.1084 -0.2379 68 HIS A NE2 518 N N . MET A 69 ? 0.8776 0.6755 0.5845 0.0606 -0.0377 -0.2129 69 MET A N 519 C CA . MET A 69 ? 0.8311 0.6789 0.5715 0.0574 -0.0288 -0.2078 69 MET A CA 520 C C . MET A 69 ? 0.7768 0.6590 0.5601 0.0380 -0.0307 -0.1979 69 MET A C 521 O O . MET A 69 ? 0.7565 0.6596 0.5557 0.0249 -0.0330 -0.1934 69 MET A O 522 C CB . MET A 69 ? 0.8215 0.6993 0.5742 0.0816 -0.0120 -0.2089 69 MET A CB 523 C CG . MET A 69 ? 0.7988 0.7209 0.5795 0.0778 -0.0017 -0.2027 69 MET A CG 524 S SD . MET A 69 ? 0.7838 0.7522 0.6199 0.0640 -0.0002 -0.1927 69 MET A SD 525 C CE . MET A 69 ? 0.7692 0.7482 0.6194 0.0828 0.0042 -0.1949 69 MET A CE 526 N N . PHE A 70 ? 0.7558 0.6411 0.5534 0.0391 -0.0298 -0.1947 70 PHE A N 527 C CA . PHE A 70 ? 0.7115 0.6240 0.5423 0.0245 -0.0302 -0.1861 70 PHE A CA 528 C C . PHE A 70 ? 0.7178 0.6183 0.5464 0.0014 -0.0403 -0.1815 70 PHE A C 529 O O . PHE A 70 ? 0.6874 0.6178 0.5437 -0.0103 -0.0402 -0.1748 70 PHE A O 530 C CB . PHE A 70 ? 0.7025 0.6175 0.5419 0.0337 -0.0270 -0.1842 70 PHE A CB 531 C CG . PHE A 70 ? 0.6738 0.6203 0.5345 0.0503 -0.0191 -0.1856 70 PHE A CG 532 C CD1 . PHE A 70 ? 0.6357 0.6191 0.5266 0.0448 -0.0148 -0.1819 70 PHE A CD1 533 C CD2 . PHE A 70 ? 0.6920 0.6310 0.5433 0.0709 -0.0173 -0.1902 70 PHE A CD2 534 C CE1 . PHE A 70 ? 0.6175 0.6296 0.5302 0.0553 -0.0094 -0.1823 70 PHE A CE1 535 C CE2 . PHE A 70 ? 0.6660 0.6415 0.5438 0.0837 -0.0116 -0.1906 70 PHE A CE2 536 C CZ . PHE A 70 ? 0.6267 0.6387 0.5360 0.0735 -0.0079 -0.1863 70 PHE A CZ 537 N N . GLN A 71 ? 0.7598 0.6164 0.5554 -0.0046 -0.0496 -0.1850 71 GLN A N 538 C CA . GLN A 71 ? 0.7719 0.6169 0.5667 -0.0306 -0.0613 -0.1800 71 GLN A CA 539 C C . GLN A 71 ? 0.7606 0.6261 0.5656 -0.0409 -0.0686 -0.1802 71 GLN A C 540 O O . GLN A 71 ? 0.7447 0.6363 0.5765 -0.0593 -0.0736 -0.1724 71 GLN A O 541 C CB . GLN A 71 ? 0.8321 0.6168 0.5835 -0.0361 -0.0723 -0.1845 71 GLN A CB 542 C CG . GLN A 71 ? 0.8448 0.6058 0.5864 -0.0334 -0.0685 -0.1799 71 GLN A CG 543 C CD . GLN A 71 ? 0.9078 0.5984 0.5976 -0.0336 -0.0793 -0.1854 71 GLN A CD 544 O OE1 . GLN A 71 ? 0.9463 0.6034 0.6034 -0.0304 -0.0888 -0.1953 71 GLN A OE1 545 N NE2 . GLN A 71 ? 0.9244 0.5870 0.6011 -0.0360 -0.0784 -0.1790 71 GLN A NE2 546 N N . VAL A 72 ? 0.7719 0.6273 0.5548 -0.0272 -0.0685 -0.1884 72 VAL A N 547 C CA . VAL A 72 ? 0.7650 0.6373 0.5516 -0.0325 -0.0749 -0.1885 72 VAL A CA 548 C C . VAL A 72 ? 0.7116 0.6351 0.5398 -0.0298 -0.0651 -0.1806 72 VAL A C 549 O O . VAL A 72 ? 0.6994 0.6457 0.5452 -0.0399 -0.0724 -0.1758 72 VAL A O 550 C CB . VAL A 72 ? 0.7991 0.6444 0.5445 -0.0156 -0.0741 -0.1985 72 VAL A CB 551 C CG1 . VAL A 72 ? 0.7873 0.6550 0.5369 -0.0160 -0.0761 -0.1964 72 VAL A CG1 552 C CG2 . VAL A 72 ? 0.8574 0.6446 0.5544 -0.0205 -0.0894 -0.2076 72 VAL A CG2 553 N N . TYR A 73 ? 0.6844 0.6233 0.5267 -0.0156 -0.0506 -0.1796 73 TYR A N 554 C CA . TYR A 73 ? 0.6425 0.6200 0.5179 -0.0124 -0.0423 -0.1734 73 TYR A CA 555 C C . TYR A 73 ? 0.6201 0.6208 0.5246 -0.0246 -0.0451 -0.1655 73 TYR A C 556 O O . TYR A 73 ? 0.6021 0.6280 0.5256 -0.0262 -0.0463 -0.1608 73 TYR A O 557 C CB . TYR A 73 ? 0.6275 0.6131 0.5104 0.0026 -0.0297 -0.1748 73 TYR A CB 558 C CG . TYR A 73 ? 0.5945 0.6097 0.5085 0.0029 -0.0246 -0.1691 73 TYR A CG 559 C CD1 . TYR A 73 ? 0.5819 0.6160 0.5083 0.0032 -0.0222 -0.1655 73 TYR A CD1 560 C CD2 . TYR A 73 ? 0.5906 0.6084 0.5153 0.0036 -0.0228 -0.1673 73 TYR A CD2 561 C CE1 . TYR A 73 ? 0.5626 0.6147 0.5108 0.0041 -0.0194 -0.1616 73 TYR A CE1 562 C CE2 . TYR A 73 ? 0.5707 0.6091 0.5165 0.0056 -0.0195 -0.1638 73 TYR A CE2 563 C CZ . TYR A 73 ? 0.5587 0.6127 0.5159 0.0058 -0.0184 -0.1615 73 TYR A CZ 564 O OH . TYR A 73 ? 0.5582 0.6239 0.5300 0.0084 -0.0170 -0.1592 73 TYR A OH 565 N N . ARG A 74 ? 0.6244 0.6158 0.5301 -0.0311 -0.0452 -0.1634 74 ARG A N 566 C CA . ARG A 74 ? 0.6038 0.6198 0.5359 -0.0404 -0.0433 -0.1547 74 ARG A CA 567 C C . ARG A 74 ? 0.6031 0.6392 0.5512 -0.0553 -0.0534 -0.1496 74 ARG A C 568 O O . ARG A 74 ? 0.5812 0.6517 0.5565 -0.0539 -0.0506 -0.1435 74 ARG A O 569 C CB . ARG A 74 ? 0.6210 0.6180 0.5445 -0.0460 -0.0406 -0.1517 74 ARG A CB 570 C CG . ARG A 74 ? 0.6040 0.6279 0.5514 -0.0495 -0.0324 -0.1422 74 ARG A CG 571 C CD . ARG A 74 ? 0.6265 0.6268 0.5586 -0.0534 -0.0278 -0.1379 74 ARG A CD 572 N NE . ARG A 74 ? 0.6616 0.6397 0.5827 -0.0750 -0.0357 -0.1336 74 ARG A NE 573 C CZ . ARG A 74 ? 0.6886 0.6425 0.5949 -0.0847 -0.0329 -0.1267 74 ARG A CZ 574 N NH1 . ARG A 74 ? 0.6837 0.6334 0.5825 -0.0722 -0.0221 -0.1236 74 ARG A NH1 575 N NH2 . ARG A 74 ? 0.7235 0.6536 0.6193 -0.1081 -0.0424 -0.1225 74 ARG A NH2 576 N N . VAL A 75 ? 0.6305 0.6438 0.5601 -0.0681 -0.0666 -0.1527 75 VAL A N 577 C CA . VAL A 75 ? 0.6355 0.6669 0.5793 -0.0841 -0.0811 -0.1489 75 VAL A CA 578 C C . VAL A 75 ? 0.6169 0.6702 0.5680 -0.0726 -0.0838 -0.1497 75 VAL A C 579 O O . VAL A 75 ? 0.6023 0.6915 0.5819 -0.0761 -0.0889 -0.1431 75 VAL A O 580 C CB . VAL A 75 ? 0.6836 0.6746 0.5960 -0.0997 -0.0984 -0.1548 75 VAL A CB 581 C CG1 . VAL A 75 ? 0.6936 0.7040 0.6199 -0.1164 -0.1181 -0.1521 75 VAL A CG1 582 C CG2 . VAL A 75 ? 0.7107 0.6746 0.6136 -0.1138 -0.0975 -0.1519 75 VAL A CG2 583 N N . SER A 76 ? 0.6204 0.6523 0.5454 -0.0578 -0.0794 -0.1568 76 SER A N 584 C CA . SER A 76 ? 0.6132 0.6549 0.5348 -0.0476 -0.0812 -0.1567 76 SER A CA 585 C C . SER A 76 ? 0.5773 0.6493 0.5263 -0.0370 -0.0709 -0.1505 76 SER A C 586 O O . SER A 76 ? 0.5723 0.6620 0.5307 -0.0334 -0.0770 -0.1463 76 SER A O 587 C CB . SER A 76 ? 0.6306 0.6422 0.5162 -0.0358 -0.0755 -0.1641 76 SER A CB 588 O OG . SER A 76 ? 0.6720 0.6489 0.5237 -0.0419 -0.0864 -0.1715 76 SER A OG 589 N N . PHE A 77 ? 0.5573 0.6304 0.5144 -0.0307 -0.0573 -0.1504 77 PHE A N 590 C CA . PHE A 77 ? 0.5330 0.6259 0.5097 -0.0204 -0.0486 -0.1462 77 PHE A CA 591 C C . PHE A 77 ? 0.5232 0.6469 0.5269 -0.0226 -0.0521 -0.1393 77 PHE A C 592 O O . PHE A 77 ? 0.5168 0.6556 0.5302 -0.0130 -0.0531 -0.1359 77 PHE A O 593 C CB . PHE A 77 ? 0.5239 0.6093 0.5010 -0.0151 -0.0372 -0.1485 77 PHE A CB 594 C CG . PHE A 77 ? 0.5114 0.6095 0.5023 -0.0052 -0.0307 -0.1460 77 PHE A CG 595 C CD1 . PHE A 77 ? 0.5077 0.6209 0.5131 -0.0036 -0.0267 -0.1423 77 PHE A CD1 596 C CD2 . PHE A 77 ? 0.5126 0.6048 0.4990 0.0021 -0.0284 -0.1469 77 PHE A CD2 597 C CE1 . PHE A 77 ? 0.5051 0.6231 0.5154 0.0082 -0.0216 -0.1416 77 PHE A CE1 598 C CE2 . PHE A 77 ? 0.5092 0.6043 0.5025 0.0103 -0.0253 -0.1458 77 PHE A CE2 599 C CZ . PHE A 77 ? 0.5025 0.6084 0.5054 0.0150 -0.0225 -0.1442 77 PHE A CZ 600 N N . THR A 78 ? 0.5254 0.6583 0.5407 -0.0348 -0.0534 -0.1365 78 THR A N 601 C CA . THR A 78 ? 0.5183 0.6889 0.5647 -0.0386 -0.0545 -0.1282 78 THR A CA 602 C C . THR A 78 ? 0.5247 0.7163 0.5821 -0.0376 -0.0686 -0.1256 78 THR A C 603 O O . THR A 78 ? 0.5154 0.7350 0.5923 -0.0246 -0.0667 -0.1208 78 THR A O 604 C CB . THR A 78 ? 0.5295 0.7040 0.5847 -0.0587 -0.0555 -0.1238 78 THR A CB 605 O OG1 . THR A 78 ? 0.5281 0.6757 0.5655 -0.0576 -0.0445 -0.1262 78 THR A OG1 606 C CG2 . THR A 78 ? 0.5178 0.7406 0.6112 -0.0621 -0.0514 -0.1128 78 THR A CG2 607 N N . ARG A 79 ? 0.5450 0.7192 0.5853 -0.0488 -0.0835 -0.1295 79 ARG A N 608 C CA . ARG A 79 ? 0.5571 0.7470 0.6025 -0.0489 -0.1010 -0.1276 79 ARG A CA 609 C C . ARG A 79 ? 0.5571 0.7399 0.5888 -0.0285 -0.0991 -0.1280 79 ARG A C 610 O O . ARG A 79 ? 0.5584 0.7656 0.6048 -0.0197 -0.1080 -0.1230 79 ARG A O 611 C CB . ARG A 79 ? 0.5883 0.7513 0.6082 -0.0651 -0.1187 -0.1333 79 ARG A CB 612 C CG . ARG A 79 ? 0.5996 0.7883 0.6351 -0.0740 -0.1421 -0.1299 79 ARG A CG 613 C CD . ARG A 79 ? 0.6311 0.7818 0.6291 -0.0873 -0.1620 -0.1380 79 ARG A CD 614 N NE . ARG A 79 ? 0.6444 0.7659 0.6022 -0.0709 -0.1645 -0.1431 79 ARG A NE 615 C CZ . ARG A 79 ? 0.6786 0.7610 0.5921 -0.0748 -0.1789 -0.1512 79 ARG A CZ 616 N NH1 . ARG A 79 ? 0.7083 0.7709 0.6100 -0.0951 -0.1950 -0.1566 79 ARG A NH1 617 N NH2 . ARG A 79 ? 0.6896 0.7488 0.5666 -0.0585 -0.1770 -0.1535 79 ARG A NH2 618 N N . ASP A 80 ? 0.5593 0.7094 0.5639 -0.0213 -0.0881 -0.1328 80 ASP A N 619 C CA . ASP A 80 ? 0.5682 0.7057 0.5571 -0.0061 -0.0849 -0.1316 80 ASP A CA 620 C C . ASP A 80 ? 0.5538 0.7102 0.5633 0.0085 -0.0783 -0.1266 80 ASP A C 621 O O . ASP A 80 ? 0.5638 0.7218 0.5696 0.0207 -0.0846 -0.1226 80 ASP A O 622 C CB . ASP A 80 ? 0.5731 0.6786 0.5354 -0.0050 -0.0730 -0.1364 80 ASP A CB 623 C CG . ASP A 80 ? 0.6110 0.6920 0.5407 -0.0101 -0.0793 -0.1407 80 ASP A CG 624 O OD1 . ASP A 80 ? 0.6329 0.7144 0.5584 -0.0193 -0.0938 -0.1430 80 ASP A OD1 625 O OD2 . ASP A 80 ? 0.6333 0.6944 0.5406 -0.0050 -0.0697 -0.1418 80 ASP A OD2 626 N N . ILE A 81 ? 0.5373 0.7032 0.5628 0.0093 -0.0664 -0.1270 81 ILE A N 627 C CA . ILE A 81 ? 0.5316 0.7111 0.5708 0.0256 -0.0594 -0.1239 81 ILE A CA 628 C C . ILE A 81 ? 0.5379 0.7546 0.6016 0.0339 -0.0680 -0.1175 81 ILE A C 629 O O . ILE A 81 ? 0.5489 0.7648 0.6090 0.0518 -0.0713 -0.1149 81 ILE A O 630 C CB . ILE A 81 ? 0.5175 0.7003 0.5651 0.0253 -0.0455 -0.1256 81 ILE A CB 631 C CG1 . ILE A 81 ? 0.5116 0.6611 0.5379 0.0217 -0.0389 -0.1317 81 ILE A CG1 632 C CG2 . ILE A 81 ? 0.5176 0.7161 0.5763 0.0447 -0.0387 -0.1227 81 ILE A CG2 633 C CD1 . ILE A 81 ? 0.5175 0.6423 0.5264 0.0304 -0.0389 -0.1330 81 ILE A CD1 634 N N . GLN A 82 ? 0.5361 0.7850 0.6248 0.0207 -0.0728 -0.1145 82 GLN A N 635 C CA . GLN A 82 ? 0.5422 0.8386 0.6640 0.0271 -0.0812 -0.1072 82 GLN A CA 636 C C . GLN A 82 ? 0.5618 0.8578 0.6756 0.0331 -0.1010 -0.1059 82 GLN A C 637 O O . GLN A 82 ? 0.5695 0.8986 0.7045 0.0493 -0.1077 -0.1003 82 GLN A O 638 C CB . GLN A 82 ? 0.5355 0.8701 0.6906 0.0067 -0.0818 -0.1023 82 GLN A CB 639 C CG . GLN A 82 ? 0.5485 0.8608 0.6898 -0.0204 -0.0927 -0.1062 82 GLN A CG 640 C CD . GLN A 82 ? 0.5493 0.8793 0.7119 -0.0420 -0.0863 -0.1016 82 GLN A CD 641 O OE1 . GLN A 82 ? 0.5356 0.8915 0.7193 -0.0362 -0.0695 -0.0956 82 GLN A OE1 642 N NE2 . GLN A 82 ? 0.5700 0.8813 0.7223 -0.0667 -0.0997 -0.1042 82 GLN A NE2 643 N N . GLU A 83 ? 0.5783 0.8367 0.6592 0.0229 -0.1098 -0.1108 83 GLU A N 644 C CA . GLU A 83 ? 0.6045 0.8515 0.6655 0.0306 -0.1273 -0.1095 83 GLU A CA 645 C C . GLU A 83 ? 0.6159 0.8364 0.6542 0.0532 -0.1209 -0.1076 83 GLU A C 646 O O . GLU A 83 ? 0.6363 0.8585 0.6679 0.0684 -0.1336 -0.1031 83 GLU A O 647 C CB . GLU A 83 ? 0.6236 0.8358 0.6499 0.0144 -0.1365 -0.1151 83 GLU A CB 648 C CG . GLU A 83 ? 0.6305 0.8585 0.6704 -0.0084 -0.1502 -0.1174 83 GLU A CG 649 C CD . GLU A 83 ? 0.6406 0.9178 0.7171 -0.0098 -0.1704 -0.1113 83 GLU A CD 650 O OE1 . GLU A 83 ? 0.6647 0.9438 0.7310 0.0028 -0.1869 -0.1089 83 GLU A OE1 651 O OE2 . GLU A 83 ? 0.6287 0.9444 0.7450 -0.0239 -0.1700 -0.1078 83 GLU A OE2 652 N N . LEU A 84 ? 0.6094 0.8028 0.6344 0.0546 -0.1032 -0.1108 84 LEU A N 653 C CA . LEU A 84 ? 0.6270 0.7911 0.6312 0.0722 -0.0973 -0.1090 84 LEU A CA 654 C C . LEU A 84 ? 0.6312 0.8193 0.6562 0.0950 -0.0957 -0.1058 84 LEU A C 655 O O . LEU A 84 ? 0.6571 0.8255 0.6648 0.1147 -0.1000 -0.1026 84 LEU A O 656 C CB . LEU A 84 ? 0.6165 0.7481 0.6041 0.0641 -0.0818 -0.1136 84 LEU A CB 657 C CG . LEU A 84 ? 0.6283 0.7279 0.5867 0.0508 -0.0800 -0.1148 84 LEU A CG 658 C CD1 . LEU A 84 ? 0.6152 0.7004 0.5719 0.0416 -0.0654 -0.1195 84 LEU A CD1 659 C CD2 . LEU A 84 ? 0.6659 0.7349 0.5939 0.0593 -0.0852 -0.1085 84 LEU A CD2 660 N N . VAL A 85 ? 0.6129 0.8412 0.6720 0.0934 -0.0886 -0.1060 85 VAL A N 661 C CA . VAL A 85 ? 0.6198 0.8811 0.7023 0.1171 -0.0845 -0.1024 85 VAL A CA 662 C C . VAL A 85 ? 0.6419 0.9312 0.7375 0.1322 -0.1021 -0.0962 85 VAL A C 663 O O . VAL A 85 ? 0.6641 0.9521 0.7551 0.1610 -0.1035 -0.0936 85 VAL A O 664 C CB . VAL A 85 ? 0.5950 0.9014 0.7139 0.1089 -0.0722 -0.1012 85 VAL A CB 665 C CG1 . VAL A 85 ? 0.5996 0.9489 0.7453 0.1360 -0.0656 -0.0961 85 VAL A CG1 666 C CG2 . VAL A 85 ? 0.5845 0.8607 0.6864 0.0987 -0.0564 -0.1071 85 VAL A CG2 667 N N . LYS A 86 ? 0.6429 0.9537 0.7513 0.1138 -0.1173 -0.0944 86 LYS A N 668 C CA . LYS A 86 ? 0.6653 1.0045 0.7864 0.1243 -0.1391 -0.0888 86 LYS A CA 669 C C . LYS A 86 ? 0.7052 0.9966 0.7822 0.1423 -0.1497 -0.0875 86 LYS A C 670 O O . LYS A 86 ? 0.7292 1.0383 0.8120 0.1652 -0.1641 -0.0822 86 LYS A O 671 C CB . LYS A 86 ? 0.6605 1.0209 0.7955 0.0962 -0.1558 -0.0891 86 LYS A CB 672 C CG . LYS A 86 ? 0.6319 1.0466 0.8159 0.0772 -0.1506 -0.0868 86 LYS A CG 673 C CD . LYS A 86 ? 0.6309 1.0483 0.8172 0.0455 -0.1690 -0.0889 86 LYS A CD 674 C CE . LYS A 86 ? 0.6085 1.0683 0.8375 0.0214 -0.1622 -0.0856 86 LYS A CE 675 N NZ . LYS A 86 ? 0.6186 1.0692 0.8426 -0.0112 -0.1818 -0.0888 86 LYS A NZ 676 N N . MET A 87 ? 0.7198 0.9525 0.7538 0.1320 -0.1425 -0.0912 87 MET A N 677 C CA . MET A 87 ? 0.7654 0.9454 0.7531 0.1451 -0.1482 -0.0881 87 MET A CA 678 C C . MET A 87 ? 0.7896 0.9508 0.7679 0.1739 -0.1420 -0.0860 87 MET A C 679 O O . MET A 87 ? 0.8276 0.9725 0.7863 0.1967 -0.1545 -0.0804 87 MET A O 680 C CB . MET A 87 ? 0.7675 0.8971 0.7185 0.1243 -0.1379 -0.0911 87 MET A CB 681 C CG . MET A 87 ? 0.7894 0.9085 0.7189 0.1075 -0.1486 -0.0912 87 MET A CG 682 S SD . MET A 87 ? 0.8178 0.8801 0.7018 0.0912 -0.1330 -0.0918 87 MET A SD 683 C CE . MET A 87 ? 0.8596 0.8739 0.7027 0.1102 -0.1361 -0.0816 87 MET A CE 684 N N . MET A 88 ? 0.7767 0.9353 0.7640 0.1741 -0.1240 -0.0908 88 MET A N 685 C CA . MET A 88 ? 0.8101 0.9342 0.7762 0.1985 -0.1175 -0.0915 88 MET A CA 686 C C . MET A 88 ? 0.8196 0.9850 0.8127 0.2310 -0.1173 -0.0902 88 MET A C 687 O O . MET A 88 ? 0.8619 1.0029 0.8332 0.2611 -0.1239 -0.0875 88 MET A O 688 C CB . MET A 88 ? 0.7983 0.8907 0.7522 0.1841 -0.1007 -0.0982 88 MET A CB 689 C CG . MET A 88 ? 0.7930 0.8544 0.7275 0.1534 -0.0978 -0.0992 88 MET A CG 690 S SD . MET A 88 ? 0.8462 0.8611 0.7379 0.1509 -0.1100 -0.0908 88 MET A SD 691 C CE . MET A 88 ? 0.8966 0.8491 0.7503 0.1705 -0.1100 -0.0885 88 MET A CE 692 N N . SER A 89 ? 0.7874 1.0140 0.8262 0.2259 -0.1087 -0.0912 89 SER A N 693 C CA . SER A 89 ? 0.7938 1.0728 0.8658 0.2562 -0.1046 -0.0884 89 SER A CA 694 C C . SER A 89 ? 0.7720 1.1312 0.8990 0.2490 -0.1138 -0.0819 89 SER A C 695 O O . SER A 89 ? 0.7406 1.1477 0.9060 0.2323 -0.1024 -0.0812 89 SER A O 696 C CB . SER A 89 ? 0.7835 1.0644 0.8591 0.2620 -0.0819 -0.0938 89 SER A CB 697 N N . PRO A 90 ? 0.7937 1.1662 0.9237 0.2604 -0.1360 -0.0764 90 PRO A N 698 C CA . PRO A 90 ? 0.7778 1.2274 0.9614 0.2531 -0.1503 -0.0701 90 PRO A CA 699 C C . PRO A 90 ? 0.7739 1.2986 1.0093 0.2811 -0.1412 -0.0645 90 PRO A C 700 O O . PRO A 90 ? 0.8023 1.3163 1.0236 0.3215 -0.1360 -0.0643 90 PRO A O 701 C CB . PRO A 90 ? 0.8119 1.2414 0.9716 0.2635 -0.1782 -0.0666 90 PRO A CB 702 C CG . PRO A 90 ? 0.8417 1.1792 0.9331 0.2675 -0.1753 -0.0702 90 PRO A CG 703 C CD . PRO A 90 ? 0.8390 1.1523 0.9199 0.2793 -0.1508 -0.0751 90 PRO A CD 704 N N . ASP A 93 ? 0.7903 1.0155 0.8191 0.2767 -0.0170 -0.1164 93 ASP A N 705 C CA . ASP A 93 ? 0.7658 1.0622 0.8452 0.2715 -0.0207 -0.1063 93 ASP A CA 706 C C . ASP A 93 ? 0.7270 1.0724 0.8432 0.2432 -0.0088 -0.1020 93 ASP A C 707 O O . ASP A 93 ? 0.6997 1.0528 0.8307 0.2105 -0.0178 -0.0999 93 ASP A O 708 C CB . ASP A 93 ? 0.7907 1.1284 0.8878 0.3130 -0.0176 -0.1014 93 ASP A CB 709 N N . TYR A 94 ? 0.7314 1.1052 0.8572 0.2574 0.0116 -0.1005 94 TYR A N 710 C CA . TYR A 94 ? 0.7037 1.1145 0.8555 0.2328 0.0265 -0.0954 94 TYR A CA 711 C C . TYR A 94 ? 0.7242 1.1413 0.8631 0.2578 0.0506 -0.0960 94 TYR A C 712 O O . TYR A 94 ? 0.7509 1.1905 0.8927 0.2950 0.0588 -0.0943 94 TYR A O 713 C CB . TYR A 94 ? 0.6796 1.1671 0.8908 0.2154 0.0234 -0.0829 94 TYR A CB 714 C CG . TYR A 94 ? 0.6559 1.1331 0.8748 0.1758 0.0051 -0.0829 94 TYR A CG 715 C CD1 . TYR A 94 ? 0.6407 1.0733 0.8340 0.1488 0.0065 -0.0887 94 TYR A CD1 716 C CD2 . TYR A 94 ? 0.6484 1.1592 0.8970 0.1679 -0.0143 -0.0777 94 TYR A CD2 717 C CE1 . TYR A 94 ? 0.6221 1.0420 0.8173 0.1171 -0.0088 -0.0896 94 TYR A CE1 718 C CE2 . TYR A 94 ? 0.6321 1.1272 0.8795 0.1340 -0.0313 -0.0791 94 TYR A CE2 719 C CZ . TYR A 94 ? 0.6214 1.0702 0.8411 0.1098 -0.0272 -0.0853 94 TYR A CZ 720 O OH . TYR A 94 ? 0.6165 1.0468 0.8303 0.0806 -0.0427 -0.0876 94 TYR A OH 721 N N . PRO A 95 ? 0.7161 1.1128 0.8377 0.2404 0.0623 -0.0982 95 PRO A N 722 C CA . PRO A 95 ? 0.6865 1.0619 0.8060 0.2006 0.0553 -0.0994 95 PRO A CA 723 C C . PRO A 95 ? 0.6880 0.9909 0.7653 0.1931 0.0396 -0.1117 95 PRO A C 724 O O . PRO A 95 ? 0.7176 0.9803 0.7629 0.2163 0.0345 -0.1194 95 PRO A O 725 C CB . PRO A 95 ? 0.6926 1.0754 0.8051 0.1966 0.0768 -0.0960 95 PRO A CB 726 C CG . PRO A 95 ? 0.7268 1.1325 0.8336 0.2358 0.0964 -0.0938 95 PRO A CG 727 C CD . PRO A 95 ? 0.7457 1.1345 0.8410 0.2654 0.0841 -0.1004 95 PRO A CD 728 N N . ILE A 96 ? 0.6594 0.9463 0.7369 0.1609 0.0321 -0.1130 96 ILE A N 729 C CA . ILE A 96 ? 0.6551 0.8849 0.7015 0.1503 0.0189 -0.1225 96 ILE A CA 730 C C . ILE A 96 ? 0.6432 0.8519 0.6765 0.1302 0.0227 -0.1258 96 ILE A C 731 O O . ILE A 96 ? 0.6243 0.8576 0.6772 0.1105 0.0270 -0.1199 96 ILE A O 732 C CB . ILE A 96 ? 0.6413 0.8701 0.6987 0.1353 0.0020 -0.1211 96 ILE A CB 733 C CG1 . ILE A 96 ? 0.6610 0.8980 0.7213 0.1592 -0.0049 -0.1187 96 ILE A CG1 734 C CG2 . ILE A 96 ? 0.6393 0.8176 0.6696 0.1210 -0.0073 -0.1284 96 ILE A CG2 735 C CD1 . ILE A 96 ? 0.6572 0.9106 0.7350 0.1474 -0.0200 -0.1139 96 ILE A CD1 736 N N . GLU A 97 ? 0.6555 0.8169 0.6547 0.1354 0.0193 -0.1352 97 GLU A N 737 C CA . GLU A 97 ? 0.6472 0.7857 0.6320 0.1196 0.0191 -0.1394 97 GLU A CA 738 C C . GLU A 97 ? 0.6404 0.7455 0.6150 0.1061 0.0044 -0.1458 97 GLU A C 739 O O . GLU A 97 ? 0.6597 0.7355 0.6167 0.1149 -0.0034 -0.1508 97 GLU A O 740 C CB . GLU A 97 ? 0.6745 0.7915 0.6292 0.1367 0.0272 -0.1443 97 GLU A CB 741 C CG . GLU A 97 ? 0.6850 0.8367 0.6468 0.1514 0.0466 -0.1365 97 GLU A CG 742 C CD . GLU A 97 ? 0.6646 0.8490 0.6502 0.1300 0.0559 -0.1262 97 GLU A CD 743 O OE1 . GLU A 97 ? 0.6504 0.8179 0.6335 0.1088 0.0482 -0.1280 97 GLU A OE1 744 O OE2 . GLU A 97 ? 0.6634 0.8905 0.6702 0.1348 0.0711 -0.1158 97 GLU A OE2 745 N N . ILE A 98 ? 0.6182 0.7273 0.6029 0.0850 0.0016 -0.1448 98 ILE A N 746 C CA . ILE A 98 ? 0.6107 0.6971 0.5900 0.0720 -0.0085 -0.1493 98 ILE A CA 747 C C . ILE A 98 ? 0.6063 0.6809 0.5779 0.0634 -0.0086 -0.1534 98 ILE A C 748 O O . ILE A 98 ? 0.6000 0.6867 0.5761 0.0579 -0.0026 -0.1503 98 ILE A O 749 C CB . ILE A 98 ? 0.5948 0.6960 0.5903 0.0590 -0.0129 -0.1449 98 ILE A CB 750 C CG1 . ILE A 98 ? 0.6070 0.7171 0.6074 0.0696 -0.0162 -0.1409 98 ILE A CG1 751 C CG2 . ILE A 98 ? 0.5887 0.6710 0.5782 0.0469 -0.0190 -0.1482 98 ILE A CG2 752 C CD1 . ILE A 98 ? 0.5986 0.7357 0.6177 0.0608 -0.0197 -0.1351 98 ILE A CD1 753 N N . GLN A 99 ? 0.6133 0.6637 0.5734 0.0618 -0.0166 -0.1596 99 GLN A N 754 C CA . GLN A 99 ? 0.6114 0.6533 0.5665 0.0560 -0.0197 -0.1638 99 GLN A CA 755 C C . GLN A 99 ? 0.6002 0.6406 0.5655 0.0434 -0.0264 -0.1653 99 GLN A C 756 O O . GLN A 99 ? 0.6045 0.6369 0.5714 0.0399 -0.0312 -0.1650 99 GLN A O 757 C CB . GLN A 99 ? 0.6378 0.6569 0.5702 0.0672 -0.0241 -0.1701 99 GLN A CB 758 C CG . GLN A 99 ? 0.6535 0.6746 0.5713 0.0827 -0.0139 -0.1682 99 GLN A CG 759 C CD . GLN A 99 ? 0.6896 0.6807 0.5763 0.0971 -0.0194 -0.1759 99 GLN A CD 760 O OE1 . GLN A 99 ? 0.7032 0.6797 0.5742 0.0974 -0.0253 -0.1804 99 GLN A OE1 761 N NE2 . GLN A 99 ? 0.7197 0.6980 0.5933 0.1112 -0.0190 -0.1779 99 GLN A NE2 762 N N . LEU A 100 ? 0.5902 0.6377 0.5610 0.0378 -0.0258 -0.1660 100 LEU A N 763 C CA . LEU A 100 ? 0.5833 0.6359 0.5655 0.0292 -0.0293 -0.1671 100 LEU A CA 764 C C . LEU A 100 ? 0.5892 0.6395 0.5710 0.0313 -0.0358 -0.1720 100 LEU A C 765 O O . LEU A 100 ? 0.5928 0.6387 0.5641 0.0379 -0.0351 -0.1733 100 LEU A O 766 C CB . LEU A 100 ? 0.5712 0.6353 0.5593 0.0242 -0.0233 -0.1640 100 LEU A CB 767 C CG . LEU A 100 ? 0.5720 0.6408 0.5635 0.0190 -0.0209 -0.1597 100 LEU A CG 768 C CD1 . LEU A 100 ? 0.5763 0.6488 0.5656 0.0216 -0.0192 -0.1562 100 LEU A CD1 769 C CD2 . LEU A 100 ? 0.5712 0.6458 0.5637 0.0148 -0.0175 -0.1595 100 LEU A CD2 770 N N . SER A 101 ? 0.5925 0.6463 0.5862 0.0249 -0.0429 -0.1736 101 SER A N 771 C CA . SER A 101 ? 0.5991 0.6593 0.6002 0.0259 -0.0517 -0.1778 101 SER A CA 772 C C . SER A 101 ? 0.5895 0.6750 0.6153 0.0189 -0.0484 -0.1751 101 SER A C 773 O O . SER A 101 ? 0.5920 0.6853 0.6328 0.0074 -0.0497 -0.1720 101 SER A O 774 C CB . SER A 101 ? 0.6190 0.6636 0.6141 0.0238 -0.0660 -0.1825 101 SER A CB 775 O OG . SER A 101 ? 0.6278 0.6781 0.6270 0.0270 -0.0778 -0.1872 101 SER A OG 776 N N . ALA A 102 ? 0.5852 0.6814 0.6126 0.0266 -0.0431 -0.1755 102 ALA A N 777 C CA . ALA A 102 ? 0.5802 0.7012 0.6266 0.0256 -0.0363 -0.1732 102 ALA A CA 778 C C . ALA A 102 ? 0.5865 0.7237 0.6438 0.0364 -0.0420 -0.1768 102 ALA A C 779 O O . ALA A 102 ? 0.5965 0.7182 0.6364 0.0476 -0.0471 -0.1803 102 ALA A O 780 C CB . ALA A 102 ? 0.5770 0.6921 0.6101 0.0283 -0.0243 -0.1711 102 ALA A CB 781 N N . GLY A 103 ? 0.5854 0.7555 0.6718 0.0338 -0.0405 -0.1746 103 GLY A N 782 C CA . GLY A 103 ? 0.5943 0.7885 0.6970 0.0469 -0.0459 -0.1773 103 GLY A CA 783 C C . GLY A 103 ? 0.5934 0.8326 0.7387 0.0382 -0.0476 -0.1734 103 GLY A C 784 O O . GLY A 103 ? 0.5885 0.8412 0.7486 0.0229 -0.0383 -0.1668 103 GLY A O 785 N N . CYS A 104 ? 0.6007 0.8644 0.7662 0.0477 -0.0600 -0.1763 104 CYS A N 786 C CA . CYS A 104 ? 0.6014 0.9185 0.8158 0.0398 -0.0630 -0.1718 104 CYS A CA 787 C C . CYS A 104 ? 0.6132 0.9460 0.8447 0.0451 -0.0873 -0.1767 104 CYS A C 788 O O . CYS A 104 ? 0.6227 0.9351 0.8296 0.0657 -0.0960 -0.1830 104 CYS A O 789 C CB . CYS A 104 ? 0.5974 0.9520 0.8296 0.0544 -0.0427 -0.1676 104 CYS A CB 790 S SG . CYS A 104 ? 0.6159 0.9520 0.8162 0.0913 -0.0385 -0.1750 104 CYS A SG 791 N N . GLU A 105 ? 0.6185 0.9849 0.8899 0.0250 -0.0998 -0.1733 105 GLU A N 792 C CA . GLU A 105 ? 0.6350 1.0252 0.9301 0.0275 -0.1262 -0.1775 105 GLU A CA 793 C C . GLU A 105 ? 0.6318 1.0944 0.9811 0.0377 -0.1216 -0.1724 105 GLU A C 794 O O . GLU A 105 ? 0.6210 1.1240 1.0042 0.0265 -0.1026 -0.1630 105 GLU A O 795 C CB . GLU A 105 ? 0.6476 1.0289 0.9536 -0.0026 -0.1473 -0.1777 105 GLU A CB 796 N N . MET A 106 ? 0.6470 1.1265 1.0029 0.0607 -0.1383 -0.1778 106 MET A N 797 C CA . MET A 106 ? 0.6496 1.2013 1.0571 0.0778 -0.1347 -0.1736 106 MET A CA 798 C C . MET A 106 ? 0.6585 1.2673 1.1242 0.0616 -0.1614 -0.1715 106 MET A C 799 O O . MET A 106 ? 0.6766 1.2593 1.1282 0.0544 -0.1919 -0.1785 106 MET A O 800 C CB . MET A 106 ? 0.6618 1.1993 1.0404 0.1194 -0.1345 -0.1800 106 MET A CB 801 C CG . MET A 106 ? 0.6664 1.1479 0.9886 0.1345 -0.1107 -0.1821 106 MET A CG 802 S SD . MET A 106 ? 0.6536 1.1557 0.9870 0.1272 -0.0736 -0.1739 106 MET A SD 803 C CE . MET A 106 ? 0.6601 1.2411 1.0431 0.1580 -0.0628 -0.1703 106 MET A CE 804 N N . TYR A 107 ? 0.6516 1.3390 1.1821 0.0557 -0.1498 -0.1614 107 TYR A N 805 C CA . TYR A 107 ? 0.6601 1.4158 1.2586 0.0366 -0.1736 -0.1569 107 TYR A CA 806 C C . TYR A 107 ? 0.6589 1.5017 1.3146 0.0649 -0.1664 -0.1519 107 TYR A C 807 O O . TYR A 107 ? 0.6502 1.5180 1.3115 0.0834 -0.1327 -0.1460 107 TYR A O 808 C CB . TYR A 107 ? 0.6556 1.4328 1.2904 -0.0095 -0.1666 -0.1452 107 TYR A CB 809 C CG . TYR A 107 ? 0.6645 1.3588 1.2450 -0.0358 -0.1701 -0.1486 107 TYR A CG 810 C CD1 . TYR A 107 ? 0.6892 1.3435 1.2532 -0.0566 -0.2053 -0.1564 107 TYR A CD1 811 C CD2 . TYR A 107 ? 0.6555 1.3111 1.1996 -0.0380 -0.1391 -0.1444 107 TYR A CD2 812 C CE1 . TYR A 107 ? 0.6995 1.2776 1.2118 -0.0761 -0.2074 -0.1599 107 TYR A CE1 813 C CE2 . TYR A 107 ? 0.6643 1.2481 1.1612 -0.0586 -0.1425 -0.1471 107 TYR A CE2 814 C CZ . TYR A 107 ? 0.6868 1.2326 1.1683 -0.0763 -0.1756 -0.1549 107 TYR A CZ 815 O OH . TYR A 107 ? 0.6998 1.1742 1.1325 -0.0919 -0.1779 -0.1580 107 TYR A OH 816 N N . PRO A 108 ? 0.6730 1.5622 1.3695 0.0707 -0.1988 -0.1546 108 PRO A N 817 C CA . PRO A 108 ? 0.6722 1.6587 1.4364 0.0955 -0.1935 -0.1481 108 PRO A CA 818 C C . PRO A 108 ? 0.6593 1.7328 1.5031 0.0631 -0.1752 -0.1313 108 PRO A C 819 O O . PRO A 108 ? 0.6636 1.7500 1.5403 0.0179 -0.1947 -0.1262 108 PRO A O 820 C CB . PRO A 108 ? 0.6924 1.6987 1.4764 0.1037 -0.2395 -0.1555 108 PRO A CB 821 C CG . PRO A 108 ? 0.7049 1.6446 1.4536 0.0662 -0.2682 -0.1620 108 PRO A CG 822 C CD . PRO A 108 ? 0.6953 1.5454 1.3699 0.0612 -0.2420 -0.1649 108 PRO A CD 823 N N . GLY A 109 ? 0.6505 1.7789 1.5210 0.0852 -0.1377 -0.1222 109 GLY A N 824 C CA . GLY A 109 ? 0.6550 1.7582 1.4793 0.1387 -0.1161 -0.1294 109 GLY A CA 825 C C . GLY A 109 ? 0.6474 1.7294 1.4410 0.1420 -0.0709 -0.1236 109 GLY A C 826 O O . GLY A 109 ? 0.6396 1.7817 1.4809 0.1213 -0.0459 -0.1090 109 GLY A O 827 N N . ASN A 110 ? 0.6533 1.6483 1.3653 0.1668 -0.0617 -0.1345 110 ASN A N 828 C CA . ASN A 110 ? 0.6535 1.6137 1.3217 0.1757 -0.0235 -0.1324 110 ASN A CA 829 C C . ASN A 110 ? 0.6368 1.5659 1.2919 0.1305 -0.0101 -0.1245 110 ASN A C 830 O O . ASN A 110 ? 0.6404 1.5459 1.2626 0.1346 0.0203 -0.1213 110 ASN A O 831 C CB . ASN A 110 ? 0.6661 1.7007 1.3693 0.2102 0.0079 -0.1255 110 ASN A CB 832 C CG . ASN A 110 ? 0.6956 1.6696 1.3264 0.2475 0.0334 -0.1335 110 ASN A CG 833 O OD1 . ASN A 110 ? 0.7151 1.6088 1.2811 0.2658 0.0195 -0.1466 110 ASN A OD1 834 N ND2 . ASN A 110 ? 0.7159 1.7264 1.3552 0.2581 0.0707 -0.1252 110 ASN A ND2 835 N N . ALA A 111 ? 0.6229 1.5466 1.2986 0.0892 -0.0349 -0.1220 111 ALA A N 836 C CA . ALA A 111 ? 0.6105 1.4948 1.2686 0.0471 -0.0278 -0.1153 111 ALA A CA 837 C C . ALA A 111 ? 0.6061 1.3911 1.1938 0.0410 -0.0466 -0.1279 111 ALA A C 838 O O . ALA A 111 ? 0.6108 1.3698 1.1819 0.0529 -0.0745 -0.1390 111 ALA A O 839 C CB . ALA A 111 ? 0.6107 1.5515 1.3362 0.0033 -0.0412 -0.1030 111 ALA A CB 840 N N . SER A 112 ? 0.5964 1.3285 1.1428 0.0240 -0.0306 -0.1252 112 SER A N 841 C CA . SER A 112 ? 0.5899 1.2343 1.0732 0.0183 -0.0441 -0.1352 112 SER A CA 842 C C . SER A 112 ? 0.5844 1.1907 1.0462 -0.0127 -0.0334 -0.1281 112 SER A C 843 O O . SER A 112 ? 0.5852 1.2186 1.0626 -0.0227 -0.0085 -0.1161 112 SER A O 844 C CB . SER A 112 ? 0.5926 1.1906 1.0203 0.0547 -0.0355 -0.1456 112 SER A CB 845 O OG . SER A 112 ? 0.5956 1.1929 1.0059 0.0651 -0.0043 -0.1409 112 SER A OG 846 N N . GLU A 113 ? 0.5802 1.1229 1.0034 -0.0254 -0.0519 -0.1353 113 GLU A N 847 C CA . GLU A 113 ? 0.5771 1.0721 0.9693 -0.0478 -0.0443 -0.1307 113 GLU A CA 848 C C . GLU A 113 ? 0.5683 0.9958 0.8982 -0.0304 -0.0439 -0.1410 113 GLU A C 849 O O . GLU A 113 ? 0.5703 0.9683 0.8783 -0.0197 -0.0627 -0.1515 113 GLU A O 850 C CB . GLU A 113 ? 0.5930 1.0749 0.9993 -0.0824 -0.0672 -0.1282 113 GLU A CB 851 C CG . GLU A 113 ? 0.6008 1.1443 1.0682 -0.1108 -0.0646 -0.1137 113 GLU A CG 852 N N . SER A 114 ? 0.5590 0.9643 0.8608 -0.0282 -0.0224 -0.1369 114 SER A N 853 C CA . SER A 114 ? 0.5492 0.8980 0.7981 -0.0148 -0.0208 -0.1446 114 SER A CA 854 C C . SER A 114 ? 0.5509 0.8531 0.7744 -0.0339 -0.0283 -0.1436 114 SER A C 855 O O . SER A 114 ? 0.5603 0.8670 0.8004 -0.0578 -0.0306 -0.1356 114 SER A O 856 C CB . SER A 114 ? 0.5480 0.8969 0.7771 0.0014 0.0030 -0.1425 114 SER A CB 857 O OG . SER A 114 ? 0.5481 0.9262 0.7878 0.0263 0.0082 -0.1466 114 SER A OG 858 N N . PHE A 115 ? 0.5429 0.8003 0.7263 -0.0227 -0.0318 -0.1510 115 PHE A N 859 C CA . PHE A 115 ? 0.5465 0.7600 0.7027 -0.0335 -0.0377 -0.1510 115 PHE A CA 860 C C . PHE A 115 ? 0.5360 0.7179 0.6553 -0.0189 -0.0309 -0.1550 115 PHE A C 861 O O . PHE A 115 ? 0.5274 0.7095 0.6369 -0.0022 -0.0290 -0.1605 115 PHE A O 862 C CB . PHE A 115 ? 0.5603 0.7542 0.7143 -0.0403 -0.0606 -0.1573 115 PHE A CB 863 C CG . PHE A 115 ? 0.5601 0.7513 0.7053 -0.0220 -0.0716 -0.1671 115 PHE A CG 864 C CD1 . PHE A 115 ? 0.5585 0.7836 0.7326 -0.0192 -0.0823 -0.1692 115 PHE A CD1 865 C CD2 . PHE A 115 ? 0.5606 0.7171 0.6692 -0.0075 -0.0710 -0.1728 115 PHE A CD2 866 C CE1 . PHE A 115 ? 0.5651 0.7829 0.7256 -0.0007 -0.0934 -0.1774 115 PHE A CE1 867 C CE2 . PHE A 115 ? 0.5654 0.7154 0.6612 0.0083 -0.0795 -0.1797 115 PHE A CE2 868 C CZ . PHE A 115 ? 0.5699 0.7471 0.6885 0.0125 -0.0913 -0.1822 115 PHE A CZ 869 N N . LEU A 116 ? 0.5385 0.6930 0.6380 -0.0260 -0.0284 -0.1515 116 LEU A N 870 C CA . LEU A 116 ? 0.5297 0.6577 0.5996 -0.0152 -0.0257 -0.1546 116 LEU A CA 871 C C . LEU A 116 ? 0.5408 0.6379 0.5945 -0.0211 -0.0335 -0.1538 116 LEU A C 872 O O . LEU A 116 ? 0.5521 0.6397 0.6009 -0.0299 -0.0296 -0.1467 116 LEU A O 873 C CB . LEU A 116 ? 0.5260 0.6588 0.5865 -0.0116 -0.0110 -0.1502 116 LEU A CB 874 C CG . LEU A 116 ? 0.5197 0.6387 0.5583 0.0005 -0.0088 -0.1547 116 LEU A CG 875 C CD1 . LEU A 116 ? 0.5280 0.6506 0.5558 0.0028 0.0026 -0.1515 116 LEU A CD1 876 C CD2 . LEU A 116 ? 0.5158 0.6116 0.5386 0.0010 -0.0151 -0.1555 116 LEU A CD2 877 N N . HIS A 117 ? 0.5419 0.6208 0.5834 -0.0140 -0.0440 -0.1607 117 HIS A N 878 C CA . HIS A 117 ? 0.5577 0.6046 0.5792 -0.0138 -0.0512 -0.1617 117 HIS A CA 879 C C . HIS A 117 ? 0.5491 0.5856 0.5514 0.0005 -0.0456 -0.1629 117 HIS A C 880 O O . HIS A 117 ? 0.5349 0.5802 0.5351 0.0096 -0.0421 -0.1660 117 HIS A O 881 C CB . HIS A 117 ? 0.5777 0.6080 0.5941 -0.0147 -0.0673 -0.1688 117 HIS A CB 882 C CG . HIS A 117 ? 0.5923 0.6328 0.6310 -0.0332 -0.0768 -0.1667 117 HIS A CG 883 N ND1 . HIS A 117 ? 0.5932 0.6480 0.6503 -0.0495 -0.0696 -0.1569 117 HIS A ND1 884 C CD2 . HIS A 117 ? 0.6099 0.6500 0.6564 -0.0393 -0.0937 -0.1722 117 HIS A CD2 885 C CE1 . HIS A 117 ? 0.6036 0.6708 0.6838 -0.0667 -0.0802 -0.1555 117 HIS A CE1 886 N NE2 . HIS A 117 ? 0.6119 0.6706 0.6870 -0.0611 -0.0967 -0.1653 117 HIS A NE2 887 N N . VAL A 118 ? 0.5582 0.5767 0.5474 0.0019 -0.0452 -0.1593 118 VAL A N 888 C CA . VAL A 118 ? 0.5520 0.5675 0.5290 0.0156 -0.0408 -0.1591 118 VAL A CA 889 C C . VAL A 118 ? 0.5787 0.5655 0.5356 0.0257 -0.0474 -0.1619 118 VAL A C 890 O O . VAL A 118 ? 0.6041 0.5667 0.5519 0.0203 -0.0539 -0.1600 118 VAL A O 891 C CB . VAL A 118 ? 0.5433 0.5686 0.5224 0.0137 -0.0341 -0.1521 118 VAL A CB 892 C CG1 . VAL A 118 ? 0.5375 0.5663 0.5105 0.0266 -0.0323 -0.1511 118 VAL A CG1 893 C CG2 . VAL A 118 ? 0.5228 0.5701 0.5135 0.0074 -0.0274 -0.1511 118 VAL A CG2 894 N N . ALA A 119 ? 0.5783 0.5653 0.5256 0.0409 -0.0449 -0.1658 119 ALA A N 895 C CA . ALA A 119 ? 0.6071 0.5684 0.5313 0.0570 -0.0483 -0.1690 119 ALA A CA 896 C C . ALA A 119 ? 0.6004 0.5784 0.5263 0.0723 -0.0392 -0.1645 119 ALA A C 897 O O . ALA A 119 ? 0.5736 0.5830 0.5164 0.0706 -0.0309 -0.1609 119 ALA A O 898 C CB . ALA A 119 ? 0.6237 0.5703 0.5307 0.0655 -0.0524 -0.1773 119 ALA A CB 899 N N . PHE A 120 ? 0.6277 0.5838 0.5361 0.0871 -0.0422 -0.1646 120 PHE A N 900 C CA . PHE A 120 ? 0.6247 0.6001 0.5372 0.1054 -0.0352 -0.1601 120 PHE A CA 901 C C . PHE A 120 ? 0.6595 0.6167 0.5475 0.1311 -0.0329 -0.1656 120 PHE A C 902 O O . PHE A 120 ? 0.6998 0.6124 0.5585 0.1398 -0.0420 -0.1709 120 PHE A O 903 C CB . PHE A 120 ? 0.6332 0.6005 0.5454 0.1047 -0.0408 -0.1539 120 PHE A CB 904 C CG . PHE A 120 ? 0.6345 0.6246 0.5537 0.1251 -0.0371 -0.1490 120 PHE A CG 905 C CD1 . PHE A 120 ? 0.6004 0.6370 0.5486 0.1200 -0.0320 -0.1431 120 PHE A CD1 906 C CD2 . PHE A 120 ? 0.6723 0.6362 0.5686 0.1498 -0.0407 -0.1503 120 PHE A CD2 907 C CE1 . PHE A 120 ? 0.6050 0.6703 0.5662 0.1376 -0.0308 -0.1377 120 PHE A CE1 908 C CE2 . PHE A 120 ? 0.6766 0.6681 0.5837 0.1718 -0.0378 -0.1452 120 PHE A CE2 909 C CZ . PHE A 120 ? 0.6399 0.6863 0.5829 0.1647 -0.0331 -0.1385 120 PHE A CZ 910 N N . GLN A 121 ? 0.6474 0.6369 0.5448 0.1429 -0.0202 -0.1640 121 GLN A N 911 C CA . GLN A 121 ? 0.6779 0.6577 0.5516 0.1701 -0.0127 -0.1684 121 GLN A CA 912 C C . GLN A 121 ? 0.7083 0.6439 0.5469 0.1708 -0.0201 -0.1791 121 GLN A C 913 O O . GLN A 121 ? 0.7540 0.6591 0.5577 0.1945 -0.0199 -0.1859 121 GLN A O 914 C CB . GLN A 121 ? 0.7094 0.6781 0.5701 0.1970 -0.0134 -0.1679 121 GLN A CB 915 C CG . GLN A 121 ? 0.6845 0.6956 0.5787 0.1980 -0.0109 -0.1577 121 GLN A CG 916 C CD . GLN A 121 ? 0.6602 0.7340 0.5878 0.2038 0.0050 -0.1498 121 GLN A CD 917 O OE1 . GLN A 121 ? 0.6396 0.7340 0.5792 0.1890 0.0134 -0.1482 121 GLN A OE1 918 N NE2 . GLN A 121 ? 0.6606 0.7656 0.6045 0.2245 0.0085 -0.1439 121 GLN A NE2 919 N N . GLY A 122 ? 0.6883 0.6207 0.5350 0.1465 -0.0274 -0.1808 122 GLY A N 920 C CA . GLY A 122 ? 0.7159 0.6122 0.5348 0.1439 -0.0382 -0.1906 122 GLY A CA 921 C C . GLY A 122 ? 0.7440 0.5957 0.5472 0.1328 -0.0579 -0.1965 122 GLY A C 922 O O . GLY A 122 ? 0.7767 0.5938 0.5543 0.1311 -0.0711 -0.2057 122 GLY A O 923 N N . LYS A 123 ? 0.7378 0.5888 0.5547 0.1240 -0.0609 -0.1907 123 LYS A N 924 C CA . LYS A 123 ? 0.7672 0.5780 0.5732 0.1079 -0.0778 -0.1927 123 LYS A CA 925 C C . LYS A 123 ? 0.7287 0.5672 0.5707 0.0799 -0.0776 -0.1842 123 LYS A C 926 O O . LYS A 123 ? 0.7002 0.5706 0.5637 0.0792 -0.0671 -0.1758 123 LYS A O 927 C CB . LYS A 123 ? 0.8121 0.5841 0.5905 0.1249 -0.0818 -0.1924 123 LYS A CB 928 C CG . LYS A 123 ? 0.8648 0.5801 0.6199 0.1091 -0.1011 -0.1951 123 LYS A CG 929 C CD . LYS A 123 ? 0.9237 0.5944 0.6464 0.1284 -0.1051 -0.1939 123 LYS A CD 930 C CE . LYS A 123 ? 0.9847 0.5841 0.6726 0.1140 -0.1266 -0.1981 123 LYS A CE 931 N NZ . LYS A 123 ? 1.0213 0.5790 0.6732 0.1209 -0.1399 -0.2130 123 LYS A NZ 932 N N . TYR A 124 ? 0.7330 0.5604 0.5806 0.0576 -0.0896 -0.1863 124 TYR A N 933 C CA . TYR A 124 ? 0.7010 0.5557 0.5817 0.0322 -0.0880 -0.1783 124 TYR A CA 934 C C . TYR A 124 ? 0.7148 0.5531 0.5925 0.0247 -0.0876 -0.1691 124 TYR A C 935 O O . TYR A 124 ? 0.7629 0.5546 0.6157 0.0218 -0.0992 -0.1699 124 TYR A O 936 C CB . TYR A 124 ? 0.7101 0.5602 0.5996 0.0123 -0.1020 -0.1826 124 TYR A CB 937 C CG . TYR A 124 ? 0.6896 0.5664 0.6131 -0.0139 -0.1008 -0.1740 124 TYR A CG 938 C CD1 . TYR A 124 ? 0.6475 0.5680 0.5977 -0.0160 -0.0850 -0.1668 124 TYR A CD1 939 C CD2 . TYR A 124 ? 0.7163 0.5751 0.6446 -0.0370 -0.1157 -0.1729 124 TYR A CD2 940 C CE1 . TYR A 124 ? 0.6351 0.5817 0.6136 -0.0364 -0.0811 -0.1589 124 TYR A CE1 941 C CE2 . TYR A 124 ? 0.7010 0.5916 0.6642 -0.0609 -0.1116 -0.1633 124 TYR A CE2 942 C CZ . TYR A 124 ? 0.6630 0.5982 0.6502 -0.0585 -0.0929 -0.1563 124 TYR A CZ 943 O OH . TYR A 124 ? 0.6474 0.6152 0.6663 -0.0786 -0.0861 -0.1466 124 TYR A OH 944 N N . VAL A 125 ? 0.6793 0.5506 0.5771 0.0219 -0.0753 -0.1604 125 VAL A N 945 C CA . VAL A 125 ? 0.6938 0.5499 0.5834 0.0189 -0.0739 -0.1507 125 VAL A CA 946 C C . VAL A 125 ? 0.6723 0.5527 0.5833 -0.0020 -0.0665 -0.1406 125 VAL A C 947 O O . VAL A 125 ? 0.6984 0.5559 0.5992 -0.0134 -0.0682 -0.1317 125 VAL A O 948 C CB . VAL A 125 ? 0.6910 0.5540 0.5719 0.0434 -0.0680 -0.1488 125 VAL A CB 949 C CG1 . VAL A 125 ? 0.7283 0.5545 0.5788 0.0669 -0.0747 -0.1554 125 VAL A CG1 950 C CG2 . VAL A 125 ? 0.6431 0.5558 0.5483 0.0493 -0.0571 -0.1499 125 VAL A CG2 951 N N . VAL A 126 ? 0.6307 0.5538 0.5668 -0.0054 -0.0576 -0.1416 126 VAL A N 952 C CA . VAL A 126 ? 0.6143 0.5626 0.5662 -0.0189 -0.0477 -0.1332 126 VAL A CA 953 C C . VAL A 126 ? 0.5909 0.5716 0.5694 -0.0293 -0.0441 -0.1362 126 VAL A C 954 O O . VAL A 126 ? 0.5753 0.5673 0.5602 -0.0213 -0.0468 -0.1448 126 VAL A O 955 C CB . VAL A 126 ? 0.5958 0.5614 0.5446 -0.0068 -0.0399 -0.1304 126 VAL A CB 956 C CG1 . VAL A 126 ? 0.5811 0.5704 0.5398 -0.0171 -0.0294 -0.1244 126 VAL A CG1 957 C CG2 . VAL A 126 ? 0.6225 0.5606 0.5479 0.0034 -0.0446 -0.1252 126 VAL A CG2 958 N N . ARG A 127 ? 0.5934 0.5889 0.5859 -0.0457 -0.0374 -0.1281 127 ARG A N 959 C CA . ARG A 127 ? 0.5730 0.6063 0.5936 -0.0524 -0.0315 -0.1291 127 ARG A CA 960 C C . ARG A 127 ? 0.5707 0.6265 0.5967 -0.0566 -0.0154 -0.1201 127 ARG A C 961 O O . ARG A 127 ? 0.5942 0.6343 0.6059 -0.0637 -0.0105 -0.1101 127 ARG A O 962 C CB . ARG A 127 ? 0.5873 0.6222 0.6268 -0.0699 -0.0415 -0.1289 127 ARG A CB 963 C CG . ARG A 127 ? 0.6250 0.6286 0.6548 -0.0890 -0.0469 -0.1196 127 ARG A CG 964 C CD . ARG A 127 ? 0.6218 0.6524 0.6763 -0.1112 -0.0362 -0.1063 127 ARG A CD 965 N NE . ARG A 127 ? 0.6228 0.6732 0.7092 -0.1298 -0.0467 -0.1071 127 ARG A NE 966 C CZ . ARG A 127 ? 0.6443 0.6997 0.7495 -0.1580 -0.0474 -0.0951 127 ARG A CZ 967 N NH1 . ARG A 127 ? 0.6699 0.7069 0.7602 -0.1704 -0.0364 -0.0805 127 ARG A NH1 968 N NH2 . ARG A 127 ? 0.6437 0.7224 0.7824 -0.1749 -0.0602 -0.0968 127 ARG A NH2 969 N N . PHE A 128 ? 0.5481 0.6364 0.5892 -0.0499 -0.0072 -0.1237 128 PHE A N 970 C CA . PHE A 128 ? 0.5494 0.6606 0.5946 -0.0517 0.0092 -0.1163 128 PHE A CA 971 C C . PHE A 128 ? 0.5579 0.6956 0.6332 -0.0689 0.0140 -0.1084 128 PHE A C 972 O O . PHE A 128 ? 0.5450 0.7058 0.6474 -0.0705 0.0075 -0.1135 128 PHE A O 973 C CB . PHE A 128 ? 0.5308 0.6605 0.5748 -0.0350 0.0159 -0.1239 128 PHE A CB 974 C CG . PHE A 128 ? 0.5392 0.6794 0.5712 -0.0308 0.0324 -0.1183 128 PHE A CG 975 C CD1 . PHE A 128 ? 0.5485 0.6662 0.5483 -0.0237 0.0334 -0.1183 128 PHE A CD1 976 C CD2 . PHE A 128 ? 0.5401 0.7142 0.5924 -0.0329 0.0466 -0.1131 128 PHE A CD2 977 C CE1 . PHE A 128 ? 0.5651 0.6863 0.5456 -0.0183 0.0473 -0.1143 128 PHE A CE1 978 C CE2 . PHE A 128 ? 0.5603 0.7418 0.5953 -0.0257 0.0641 -0.1082 128 PHE A CE2 979 C CZ . PHE A 128 ? 0.5713 0.7226 0.5668 -0.0182 0.0639 -0.1094 128 PHE A CZ 980 N N . TRP A 129 ? 0.5839 0.7194 0.6547 -0.0825 0.0246 -0.0949 129 TRP A N 981 C CA . TRP A 129 ? 0.5981 0.7619 0.7007 -0.1037 0.0310 -0.0837 129 TRP A CA 982 C C . TRP A 129 ? 0.6127 0.8008 0.7138 -0.1049 0.0557 -0.0710 129 TRP A C 983 O O . TRP A 129 ? 0.6385 0.7990 0.7078 -0.1076 0.0631 -0.0618 129 TRP A O 984 C CB . TRP A 129 ? 0.6274 0.7563 0.7252 -0.1265 0.0178 -0.0767 129 TRP A CB 985 C CG . TRP A 129 ? 0.6406 0.7984 0.7780 -0.1532 0.0169 -0.0674 129 TRP A CG 986 C CD1 . TRP A 129 ? 0.6709 0.8294 0.8149 -0.1790 0.0265 -0.0493 129 TRP A CD1 987 C CD2 . TRP A 129 ? 0.6230 0.8152 0.8006 -0.1583 0.0048 -0.0746 129 TRP A CD2 988 N NE1 . TRP A 129 ? 0.6755 0.8704 0.8660 -0.2024 0.0209 -0.0445 129 TRP A NE1 989 C CE2 . TRP A 129 ? 0.6439 0.8609 0.8561 -0.1891 0.0063 -0.0605 129 TRP A CE2 990 C CE3 . TRP A 129 ? 0.5966 0.8005 0.7833 -0.1402 -0.0080 -0.0908 129 TRP A CE3 991 C CZ2 . TRP A 129 ? 0.6414 0.8985 0.9006 -0.2023 -0.0067 -0.0629 129 TRP A CZ2 992 C CZ3 . TRP A 129 ? 0.5953 0.8341 0.8227 -0.1506 -0.0207 -0.0934 129 TRP A CZ3 993 C CH2 . TRP A 129 ? 0.6182 0.8853 0.8833 -0.1813 -0.0211 -0.0801 129 TRP A CH2 994 N N . GLY A 130 ? 0.6024 0.8416 0.7350 -0.1001 0.0684 -0.0705 130 GLY A N 995 C CA . GLY A 130 ? 0.6214 0.8899 0.7530 -0.0967 0.0951 -0.0592 130 GLY A CA 996 C C . GLY A 130 ? 0.6266 0.8758 0.7150 -0.0710 0.1040 -0.0663 130 GLY A C 997 O O . GLY A 130 ? 0.6098 0.8750 0.6994 -0.0493 0.1061 -0.0778 130 GLY A O 998 N N . THR A 131 ? 0.6552 0.8659 0.7025 -0.0735 0.1069 -0.0594 131 THR A N 999 C CA . THR A 131 ? 0.6711 0.8604 0.6734 -0.0525 0.1132 -0.0647 131 THR A CA 1000 C C . THR A 131 ? 0.6760 0.8157 0.6430 -0.0489 0.0939 -0.0706 131 THR A C 1001 O O . THR A 131 ? 0.6928 0.8115 0.6214 -0.0352 0.0948 -0.0740 131 THR A O 1002 C CB . THR A 131 ? 0.7113 0.9066 0.6899 -0.0532 0.1386 -0.0495 131 THR A CB 1003 O OG1 . THR A 131 ? 0.7389 0.9109 0.7083 -0.0757 0.1385 -0.0331 131 THR A OG1 1004 C CG2 . THR A 131 ? 0.7108 0.9636 0.7239 -0.0506 0.1621 -0.0436 131 THR A CG2 1005 N N . SER A 132 ? 0.6682 0.7900 0.6473 -0.0600 0.0759 -0.0721 132 SER A N 1006 C CA . SER A 132 ? 0.6773 0.7578 0.6272 -0.0551 0.0592 -0.0757 132 SER A CA 1007 C C . SER A 132 ? 0.6577 0.7272 0.6243 -0.0566 0.0397 -0.0847 132 SER A C 1008 O O . SER A 132 ? 0.6422 0.7306 0.6400 -0.0639 0.0367 -0.0881 132 SER A O 1009 C CB . SER A 132 ? 0.7178 0.7680 0.6389 -0.0651 0.0626 -0.0602 132 SER A CB 1010 O OG . SER A 132 ? 0.7332 0.7862 0.6747 -0.0874 0.0665 -0.0482 132 SER A OG 1011 N N . TRP A 133 ? 0.6643 0.7048 0.6089 -0.0479 0.0265 -0.0886 133 TRP A N 1012 C CA . TRP A 133 ? 0.6586 0.6833 0.6105 -0.0464 0.0103 -0.0953 133 TRP A CA 1013 C C . TRP A 133 ? 0.6933 0.6874 0.6365 -0.0595 0.0050 -0.0856 133 TRP A C 1014 O O . TRP A 133 ? 0.7251 0.6979 0.6439 -0.0634 0.0091 -0.0741 133 TRP A O 1015 C CB . TRP A 133 ? 0.6510 0.6639 0.5863 -0.0299 0.0002 -0.1022 133 TRP A CB 1016 C CG . TRP A 133 ? 0.6306 0.6649 0.5706 -0.0202 0.0022 -0.1114 133 TRP A CG 1017 C CD1 . TRP A 133 ? 0.6421 0.6768 0.5628 -0.0136 0.0045 -0.1117 133 TRP A CD1 1018 C CD2 . TRP A 133 ? 0.6042 0.6556 0.5643 -0.0164 0.0001 -0.1216 133 TRP A CD2 1019 N NE1 . TRP A 133 ? 0.6215 0.6703 0.5495 -0.0076 0.0037 -0.1216 133 TRP A NE1 1020 C CE2 . TRP A 133 ? 0.6007 0.6601 0.5527 -0.0088 0.0019 -0.1269 133 TRP A CE2 1021 C CE3 . TRP A 133 ? 0.5948 0.6513 0.5746 -0.0186 -0.0043 -0.1266 133 TRP A CE3 1022 C CZ2 . TRP A 133 ? 0.5878 0.6582 0.5508 -0.0040 0.0005 -0.1357 133 TRP A CZ2 1023 C CZ3 . TRP A 133 ? 0.5761 0.6465 0.5664 -0.0120 -0.0054 -0.1353 133 TRP A CZ3 1024 C CH2 . TRP A 133 ? 0.5719 0.6483 0.5540 -0.0051 -0.0024 -0.1392 133 TRP A CH2 1025 N N . GLN A 134 ? 0.6952 0.6816 0.6532 -0.0661 -0.0053 -0.0904 134 GLN A N 1026 C CA . GLN A 134 ? 0.7383 0.6864 0.6840 -0.0793 -0.0140 -0.0831 134 GLN A CA 1027 C C . GLN A 134 ? 0.7441 0.6641 0.6813 -0.0688 -0.0312 -0.0940 134 GLN A C 1028 O O . GLN A 134 ? 0.7193 0.6565 0.6739 -0.0636 -0.0362 -0.1054 134 GLN A O 1029 C CB . GLN A 134 ? 0.7494 0.7119 0.7200 -0.1055 -0.0093 -0.0749 134 GLN A CB 1030 C CG . GLN A 134 ? 0.7756 0.7531 0.7451 -0.1183 0.0096 -0.0587 134 GLN A CG 1031 C CD . GLN A 134 ? 0.7937 0.7967 0.7967 -0.1460 0.0161 -0.0487 134 GLN A CD 1032 O OE1 . GLN A 134 ? 0.8212 0.8012 0.8303 -0.1652 0.0027 -0.0463 134 GLN A OE1 1033 N NE2 . GLN A 134 ? 0.7786 0.8296 0.8031 -0.1479 0.0362 -0.0426 134 GLN A NE2 1034 N N . THR A 135 ? 0.7838 0.6584 0.6901 -0.0631 -0.0397 -0.0901 135 THR A N 1035 C CA . THR A 135 ? 0.8035 0.6442 0.6949 -0.0514 -0.0550 -0.0995 135 THR A CA 1036 C C . THR A 135 ? 0.8328 0.6522 0.7296 -0.0732 -0.0648 -0.1002 135 THR A C 1037 O O . THR A 135 ? 0.8564 0.6695 0.7582 -0.0983 -0.0619 -0.0883 135 THR A O 1038 C CB . THR A 135 ? 0.8436 0.6388 0.6972 -0.0348 -0.0620 -0.0953 135 THR A CB 1039 O OG1 . THR A 135 ? 0.8907 0.6514 0.7244 -0.0524 -0.0614 -0.0805 135 THR A OG1 1040 C CG2 . THR A 135 ? 0.8153 0.6354 0.6672 -0.0127 -0.0568 -0.0959 135 THR A CG2 1041 N N . VAL A 136 ? 0.8355 0.6445 0.7310 -0.0645 -0.0767 -0.1135 136 VAL A N 1042 C CA . VAL A 136 ? 0.8703 0.6548 0.7673 -0.0841 -0.0914 -0.1169 136 VAL A CA 1043 C C . VAL A 136 ? 0.9420 0.6542 0.7969 -0.0856 -0.1055 -0.1144 136 VAL A C 1044 O O . VAL A 136 ? 0.9605 0.6452 0.7853 -0.0634 -0.1043 -0.1130 136 VAL A O 1045 C CB . VAL A 136 ? 0.8496 0.6483 0.7557 -0.0730 -0.0999 -0.1330 136 VAL A CB 1046 C CG1 . VAL A 136 ? 0.7886 0.6510 0.7313 -0.0709 -0.0869 -0.1345 136 VAL A CG1 1047 C CG2 . VAL A 136 ? 0.8648 0.6336 0.7375 -0.0414 -0.1046 -0.1436 136 VAL A CG2 1048 N N . PRO A 137 ? 0.9888 0.6686 0.8408 -0.1119 -0.1205 -0.1133 137 PRO A N 1049 C CA . PRO A 137 ? 1.0663 0.6655 0.8706 -0.1123 -0.1370 -0.1129 137 PRO A CA 1050 C C . PRO A 137 ? 1.0877 0.6506 0.8554 -0.0765 -0.1474 -0.1299 137 PRO A C 1051 O O . PRO A 137 ? 1.0616 0.6474 0.8402 -0.0660 -0.1508 -0.1436 137 PRO A O 1052 C CB . PRO A 137 ? 1.1027 0.6834 0.9186 -0.1510 -0.1532 -0.1107 137 PRO A CB 1053 C CG . PRO A 137 ? 1.0434 0.6971 0.9118 -0.1606 -0.1486 -0.1155 137 PRO A CG 1054 C CD . PRO A 137 ? 0.9761 0.6906 0.8685 -0.1440 -0.1235 -0.1104 137 PRO A CD 1055 N N . GLY A 138 ? 1.1388 0.6466 0.8620 -0.0558 -0.1511 -0.1282 138 GLY A N 1056 C CA . GLY A 138 ? 1.1646 0.6398 0.8511 -0.0164 -0.1573 -0.1426 138 GLY A CA 1057 C C . GLY A 138 ? 1.1051 0.6389 0.8109 0.0156 -0.1400 -0.1459 138 GLY A C 1058 O O . GLY A 138 ? 1.1020 0.6410 0.7989 0.0423 -0.1399 -0.1589 138 GLY A O 1059 N N . ALA A 139 ? 1.0631 0.6397 0.7934 0.0121 -0.1254 -0.1336 139 ALA A N 1060 C CA . ALA A 139 ? 1.0072 0.6404 0.7589 0.0366 -0.1111 -0.1350 139 ALA A CA 1061 C C . ALA A 139 ? 1.0320 0.6465 0.7596 0.0631 -0.1104 -0.1288 139 ALA A C 1062 O O . ALA A 139 ? 1.0804 0.6496 0.7819 0.0554 -0.1164 -0.1186 139 ALA A O 1063 C CB . ALA A 139 ? 0.9452 0.6414 0.7403 0.0160 -0.0976 -0.1281 139 ALA A CB 1064 N N . PRO A 140 ? 1.0023 0.6531 0.7393 0.0937 -0.1034 -0.1336 140 PRO A N 1065 C CA . PRO A 140 ? 1.0247 0.6648 0.7432 0.1225 -0.1049 -0.1282 140 PRO A CA 1066 C C . PRO A 140 ? 1.0123 0.6656 0.7379 0.1090 -0.1022 -0.1137 140 PRO A C 1067 O O . PRO A 140 ? 0.9602 0.6625 0.7182 0.0902 -0.0929 -0.1105 140 PRO A O 1068 C CB . PRO A 140 ? 0.9827 0.6797 0.7263 0.1495 -0.0957 -0.1348 140 PRO A CB 1069 C CG . PRO A 140 ? 0.9573 0.6723 0.7158 0.1397 -0.0911 -0.1453 140 PRO A CG 1070 C CD . PRO A 140 ? 0.9472 0.6542 0.7150 0.1017 -0.0938 -0.1422 140 PRO A CD 1071 N N . SER A 141 ? 1.0648 0.6699 0.7547 0.1207 -0.1106 -0.1054 141 SER A N 1072 C CA . SER A 141 ? 1.0701 0.6722 0.7534 0.1077 -0.1096 -0.0903 141 SER A CA 1073 C C . SER A 141 ? 1.0223 0.6849 0.7311 0.1207 -0.1044 -0.0872 141 SER A C 1074 O O . SER A 141 ? 1.0203 0.6889 0.7260 0.1077 -0.1021 -0.0764 141 SER A O 1075 C CB . SER A 141 ? 1.1525 0.6777 0.7835 0.1183 -0.1217 -0.0815 141 SER A CB 1076 O OG . SER A 141 ? 1.1802 0.6964 0.7943 0.1612 -0.1291 -0.0862 141 SER A OG 1077 N N . TRP A 142 ? 0.9865 0.6933 0.7192 0.1451 -0.1027 -0.0963 142 TRP A N 1078 C CA . TRP A 142 ? 0.9426 0.7100 0.7042 0.1538 -0.1004 -0.0941 142 TRP A CA 1079 C C . TRP A 142 ? 0.8853 0.6989 0.6793 0.1256 -0.0903 -0.0951 142 TRP A C 1080 O O . TRP A 142 ? 0.8603 0.7133 0.6712 0.1254 -0.0905 -0.0923 142 TRP A O 1081 C CB . TRP A 142 ? 0.9284 0.7333 0.7095 0.1866 -0.1009 -0.1010 142 TRP A CB 1082 C CG . TRP A 142 ? 0.9006 0.7251 0.7004 0.1873 -0.0917 -0.1124 142 TRP A CG 1083 C CD1 . TRP A 142 ? 0.9337 0.7248 0.7121 0.2068 -0.0922 -0.1203 142 TRP A CD1 1084 C CD2 . TRP A 142 ? 0.8408 0.7175 0.6781 0.1697 -0.0812 -0.1171 142 TRP A CD2 1085 N NE1 . TRP A 142 ? 0.8973 0.7182 0.6970 0.2022 -0.0822 -0.1291 142 TRP A NE1 1086 C CE2 . TRP A 142 ? 0.8410 0.7143 0.6777 0.1792 -0.0753 -0.1267 142 TRP A CE2 1087 C CE3 . TRP A 142 ? 0.7957 0.7158 0.6615 0.1481 -0.0769 -0.1144 142 TRP A CE3 1088 C CZ2 . TRP A 142 ? 0.7981 0.7108 0.6625 0.1672 -0.0651 -0.1322 142 TRP A CZ2 1089 C CZ3 . TRP A 142 ? 0.7541 0.7108 0.6476 0.1363 -0.0673 -0.1205 142 TRP A CZ3 1090 C CH2 . TRP A 142 ? 0.7539 0.7072 0.6470 0.1455 -0.0613 -0.1285 142 TRP A CH2 1091 N N . LEU A 143 ? 0.8707 0.6773 0.6715 0.1031 -0.0835 -0.0995 143 LEU A N 1092 C CA . LEU A 143 ? 0.8239 0.6689 0.6518 0.0792 -0.0737 -0.1008 143 LEU A CA 1093 C C . LEU A 143 ? 0.8353 0.6721 0.6513 0.0604 -0.0704 -0.0901 143 LEU A C 1094 O O . LEU A 143 ? 0.8022 0.6725 0.6357 0.0476 -0.0627 -0.0906 143 LEU A O 1095 C CB . LEU A 143 ? 0.8099 0.6516 0.6490 0.0640 -0.0691 -0.1085 143 LEU A CB 1096 C CG . LEU A 143 ? 0.7816 0.6511 0.6406 0.0759 -0.0664 -0.1199 143 LEU A CG 1097 C CD1 . LEU A 143 ? 0.7903 0.6344 0.6435 0.0664 -0.0684 -0.1269 143 LEU A CD1 1098 C CD2 . LEU A 143 ? 0.7336 0.6559 0.6236 0.0684 -0.0583 -0.1220 143 LEU A CD2 1099 N N . ASP A 144 ? 0.8875 0.6765 0.6697 0.0603 -0.0756 -0.0800 144 ASP A N 1100 C CA . ASP A 144 ? 0.9096 0.6842 0.6732 0.0429 -0.0703 -0.0673 144 ASP A CA 1101 C C . ASP A 144 ? 0.8893 0.6977 0.6557 0.0481 -0.0691 -0.0652 144 ASP A C 1102 O O . ASP A 144 ? 0.8805 0.7029 0.6480 0.0315 -0.0586 -0.0614 144 ASP A O 1103 C CB . ASP A 144 ? 0.9792 0.6908 0.6993 0.0463 -0.0781 -0.0553 144 ASP A CB 1104 C CG . ASP A 144 ? 1.0141 0.6819 0.7249 0.0319 -0.0802 -0.0555 144 ASP A CG 1105 O OD1 . ASP A 144 ? 0.9887 0.6781 0.7275 0.0141 -0.0742 -0.0625 144 ASP A OD1 1106 O OD2 . ASP A 144 ? 1.0746 0.6829 0.7475 0.0385 -0.0898 -0.0487 144 ASP A OD2 1107 N N . LEU A 145 ? 0.8860 0.7086 0.6536 0.0718 -0.0804 -0.0682 145 LEU A N 1108 C CA . LEU A 145 ? 0.8735 0.7253 0.6423 0.0769 -0.0850 -0.0672 145 LEU A CA 1109 C C . LEU A 145 ? 0.8191 0.7186 0.6211 0.0655 -0.0777 -0.0770 145 LEU A C 1110 O O . LEU A 145 ? 0.8183 0.7250 0.6115 0.0546 -0.0730 -0.0752 145 LEU A O 1111 C CB . LEU A 145 ? 0.8899 0.7477 0.6556 0.1048 -0.1018 -0.0667 145 LEU A CB 1112 C CG . LEU A 145 ? 0.8925 0.7780 0.6581 0.1131 -0.1141 -0.0652 145 LEU A CG 1113 C CD1 . LEU A 145 ? 0.9275 0.7846 0.6524 0.1033 -0.1140 -0.0556 145 LEU A CD1 1114 C CD2 . LEU A 145 ? 0.9149 0.8073 0.6827 0.1429 -0.1310 -0.0636 145 LEU A CD2 1115 N N . PRO A 146 ? 0.7802 0.7079 0.6152 0.0690 -0.0762 -0.0869 146 PRO A N 1116 C CA . PRO A 146 ? 0.7352 0.6991 0.5969 0.0569 -0.0689 -0.0951 146 PRO A CA 1117 C C . PRO A 146 ? 0.7286 0.6852 0.5859 0.0370 -0.0555 -0.0945 146 PRO A C 1118 O O . PRO A 146 ? 0.7138 0.6882 0.5742 0.0295 -0.0512 -0.0976 146 PRO A O 1119 C CB . PRO A 146 ? 0.7096 0.6904 0.5977 0.0638 -0.0670 -0.1029 146 PRO A CB 1120 C CG . PRO A 146 ? 0.7356 0.7077 0.6172 0.0862 -0.0766 -0.1002 146 PRO A CG 1121 C CD . PRO A 146 ? 0.7814 0.7091 0.6266 0.0881 -0.0815 -0.0907 146 PRO A CD 1122 N N . ILE A 147 ? 0.7440 0.6747 0.5940 0.0290 -0.0496 -0.0905 147 ILE A N 1123 C CA . ILE A 147 ? 0.7416 0.6717 0.5929 0.0100 -0.0363 -0.0875 147 ILE A CA 1124 C C . ILE A 147 ? 0.7656 0.6897 0.5914 0.0056 -0.0305 -0.0789 147 ILE A C 1125 O O . ILE A 147 ? 0.7532 0.6967 0.5838 -0.0012 -0.0199 -0.0812 147 ILE A O 1126 C CB . ILE A 147 ? 0.7630 0.6653 0.6123 -0.0010 -0.0344 -0.0829 147 ILE A CB 1127 C CG1 . ILE A 147 ? 0.7403 0.6498 0.6121 0.0020 -0.0387 -0.0939 147 ILE A CG1 1128 C CG2 . ILE A 147 ? 0.7719 0.6779 0.6239 -0.0221 -0.0204 -0.0753 147 ILE A CG2 1129 C CD1 . ILE A 147 ? 0.6950 0.6438 0.5952 -0.0002 -0.0329 -0.1038 147 ILE A CD1 1130 N N . LYS A 148 ? 0.8043 0.6987 0.5988 0.0125 -0.0375 -0.0692 148 LYS A N 1131 C CA . LYS A 148 ? 0.8340 0.7169 0.5952 0.0115 -0.0335 -0.0602 148 LYS A CA 1132 C C . LYS A 148 ? 0.8148 0.7234 0.5765 0.0185 -0.0381 -0.0690 148 LYS A C 1133 O O . LYS A 148 ? 0.8272 0.7385 0.5720 0.0137 -0.0279 -0.0678 148 LYS A O 1134 C CB . LYS A 148 ? 0.8852 0.7284 0.6096 0.0216 -0.0445 -0.0488 148 LYS A CB 1135 C CG . LYS A 148 ? 0.9335 0.7556 0.6145 0.0196 -0.0389 -0.0366 148 LYS A CG 1136 C CD . LYS A 148 ? 0.9945 0.7731 0.6355 0.0321 -0.0522 -0.0248 148 LYS A CD 1137 N N . VAL A 149 ? 0.7897 0.7163 0.5697 0.0297 -0.0531 -0.0775 149 VAL A N 1138 C CA . VAL A 149 ? 0.7734 0.7229 0.5573 0.0326 -0.0614 -0.0861 149 VAL A CA 1139 C C . VAL A 149 ? 0.7468 0.7141 0.5457 0.0221 -0.0482 -0.0945 149 VAL A C 1140 O O . VAL A 149 ? 0.7612 0.7268 0.5396 0.0207 -0.0463 -0.0975 149 VAL A O 1141 C CB . VAL A 149 ? 0.7520 0.7253 0.5626 0.0432 -0.0784 -0.0917 149 VAL A CB 1142 C CG1 . VAL A 149 ? 0.7305 0.7291 0.5527 0.0391 -0.0865 -0.1006 149 VAL A CG1 1143 C CG2 . VAL A 149 ? 0.7845 0.7435 0.5767 0.0586 -0.0940 -0.0838 149 VAL A CG2 1144 N N . LEU A 150 ? 0.7133 0.6936 0.5431 0.0168 -0.0401 -0.0986 150 LEU A N 1145 C CA . LEU A 150 ? 0.6882 0.6856 0.5341 0.0099 -0.0292 -0.1065 150 LEU A CA 1146 C C . LEU A 150 ? 0.7061 0.6981 0.5372 0.0036 -0.0118 -0.1019 150 LEU A C 1147 O O . LEU A 150 ? 0.7030 0.7046 0.5319 0.0038 -0.0043 -0.1081 150 LEU A O 1148 C CB . LEU A 150 ? 0.6550 0.6662 0.5345 0.0077 -0.0274 -0.1116 150 LEU A CB 1149 C CG . LEU A 150 ? 0.6322 0.6579 0.5320 0.0143 -0.0385 -0.1171 150 LEU A CG 1150 C CD1 . LEU A 150 ? 0.6133 0.6431 0.5348 0.0138 -0.0343 -0.1202 150 LEU A CD1 1151 C CD2 . LEU A 150 ? 0.6127 0.6542 0.5178 0.0125 -0.0432 -0.1242 150 LEU A CD2 1152 N N . ASN A 151 ? 0.7296 0.7060 0.5499 -0.0014 -0.0046 -0.0903 151 ASN A N 1153 C CA . ASN A 151 ? 0.7489 0.7261 0.5587 -0.0090 0.0147 -0.0824 151 ASN A CA 1154 C C . ASN A 151 ? 0.7863 0.7520 0.5545 -0.0025 0.0201 -0.0793 151 ASN A C 1155 O O . ASN A 151 ? 0.8033 0.7755 0.5616 -0.0050 0.0394 -0.0742 151 ASN A O 1156 C CB . ASN A 151 ? 0.7678 0.7301 0.5792 -0.0210 0.0206 -0.0689 151 ASN A CB 1157 C CG . ASN A 151 ? 0.7384 0.7152 0.5892 -0.0309 0.0210 -0.0726 151 ASN A CG 1158 O OD1 . ASN A 151 ? 0.7020 0.7055 0.5789 -0.0296 0.0235 -0.0827 151 ASN A OD1 1159 N ND2 . ASN A 151 ? 0.7536 0.7078 0.6042 -0.0404 0.0168 -0.0644 151 ASN A ND2 1160 N N . ALA A 152 ? 0.8017 0.7522 0.5458 0.0067 0.0028 -0.0824 152 ALA A N 1161 C CA . ALA A 152 ? 0.8419 0.7761 0.5402 0.0144 0.0023 -0.0820 152 ALA A CA 1162 C C . ALA A 152 ? 0.8344 0.7795 0.5299 0.0191 0.0050 -0.0957 152 ALA A C 1163 O O . ALA A 152 ? 0.8731 0.8023 0.5266 0.0265 0.0083 -0.0973 152 ALA A O 1164 C CB . ALA A 152 ? 0.8624 0.7785 0.5385 0.0223 -0.0215 -0.0812 152 ALA A CB 1165 N N . ASP A 153 ? 0.7918 0.7583 0.5263 0.0162 0.0032 -0.1055 153 ASP A N 1166 C CA . ASP A 153 ? 0.7880 0.7589 0.5196 0.0208 0.0039 -0.1185 153 ASP A CA 1167 C C . ASP A 153 ? 0.7884 0.7734 0.5259 0.0234 0.0285 -0.1178 153 ASP A C 1168 O O . ASP A 153 ? 0.7556 0.7636 0.5327 0.0185 0.0357 -0.1179 153 ASP A O 1169 C CB . ASP A 153 ? 0.7485 0.7328 0.5154 0.0168 -0.0104 -0.1277 153 ASP A CB 1170 C CG . ASP A 153 ? 0.7523 0.7305 0.5091 0.0201 -0.0143 -0.1405 153 ASP A CG 1171 O OD1 . ASP A 153 ? 0.7807 0.7438 0.5029 0.0283 -0.0058 -0.1443 153 ASP A OD1 1172 O OD2 . ASP A 153 ? 0.7310 0.7170 0.5118 0.0151 -0.0255 -0.1465 153 ASP A OD2 1173 N N . GLN A 154 ? 0.8310 0.8034 0.5279 0.0329 0.0407 -0.1173 154 GLN A N 1174 C CA . GLN A 154 ? 0.8390 0.8304 0.5401 0.0391 0.0668 -0.1152 154 GLN A CA 1175 C C . GLN A 154 ? 0.8217 0.8219 0.5360 0.0483 0.0671 -0.1294 154 GLN A C 1176 O O . GLN A 154 ? 0.8026 0.8321 0.5480 0.0506 0.0828 -0.1282 154 GLN A O 1177 C CB . GLN A 154 ? 0.8981 0.8727 0.5462 0.0497 0.0828 -0.1093 154 GLN A CB 1178 C CG . GLN A 154 ? 0.9326 0.8928 0.5597 0.0417 0.0843 -0.0928 154 GLN A CG 1179 C CD . GLN A 154 ? 0.9125 0.8963 0.5835 0.0248 0.0951 -0.0779 154 GLN A CD 1180 O OE1 . GLN A 154 ? 0.8938 0.9109 0.6008 0.0208 0.1133 -0.0748 154 GLN A OE1 1181 N NE2 . GLN A 154 ? 0.9197 0.8845 0.5865 0.0153 0.0819 -0.0687 154 GLN A NE2 1182 N N . GLY A 155 ? 0.8320 0.8060 0.5225 0.0528 0.0480 -0.1422 155 GLY A N 1183 C CA . GLY A 155 ? 0.8239 0.7945 0.5189 0.0608 0.0447 -0.1556 155 GLY A CA 1184 C C . GLY A 155 ? 0.7705 0.7681 0.5197 0.0528 0.0427 -0.1558 155 GLY A C 1185 O O . GLY A 155 ? 0.7638 0.7736 0.5267 0.0621 0.0517 -0.1608 155 GLY A O 1186 N N . THR A 156 ? 0.7379 0.7433 0.5145 0.0383 0.0304 -0.1505 156 THR A N 1187 C CA . THR A 156 ? 0.6931 0.7201 0.5150 0.0314 0.0277 -0.1505 156 THR A CA 1188 C C . THR A 156 ? 0.6794 0.7360 0.5305 0.0304 0.0452 -0.1427 156 THR A C 1189 O O . THR A 156 ? 0.6609 0.7357 0.5380 0.0338 0.0489 -0.1463 156 THR A O 1190 C CB . THR A 156 ? 0.6701 0.6964 0.5089 0.0196 0.0115 -0.1472 156 THR A CB 1191 O OG1 . THR A 156 ? 0.6786 0.6865 0.4997 0.0182 -0.0054 -0.1538 156 THR A OG1 1192 C CG2 . THR A 156 ? 0.6283 0.6730 0.5066 0.0149 0.0102 -0.1474 156 THR A CG2 1193 N N . SER A 157 ? 0.6929 0.7537 0.5388 0.0250 0.0547 -0.1313 157 SER A N 1194 C CA . SER A 157 ? 0.6838 0.7737 0.5585 0.0189 0.0710 -0.1214 157 SER A CA 1195 C C . SER A 157 ? 0.6878 0.8028 0.5717 0.0320 0.0874 -0.1250 157 SER A C 1196 O O . SER A 157 ? 0.6662 0.8110 0.5896 0.0294 0.0905 -0.1244 157 SER A O 1197 C CB . SER A 157 ? 0.7119 0.7951 0.5682 0.0113 0.0810 -0.1071 157 SER A CB 1198 O OG . SER A 157 ? 0.7090 0.8226 0.5942 0.0022 0.0983 -0.0958 157 SER A OG 1199 N N . ALA A 158 ? 0.7211 0.8226 0.5664 0.0481 0.0964 -0.1295 158 ALA A N 1200 C CA . ALA A 158 ? 0.7338 0.8549 0.5801 0.0673 0.1124 -0.1345 158 ALA A CA 1201 C C . ALA A 158 ? 0.7102 0.8332 0.5761 0.0752 0.1005 -0.1466 158 ALA A C 1202 O O . ALA A 158 ? 0.6989 0.8556 0.5956 0.0838 0.1098 -0.1465 158 ALA A O 1203 C CB . ALA A 158 ? 0.7855 0.8785 0.5741 0.0860 0.1209 -0.1397 158 ALA A CB 1204 N N . THR A 159 ? 0.7066 0.7951 0.5554 0.0718 0.0798 -0.1556 159 THR A N 1205 C CA . THR A 159 ? 0.6936 0.7752 0.5525 0.0779 0.0682 -0.1656 159 THR A CA 1206 C C . THR A 159 ? 0.6523 0.7638 0.5608 0.0676 0.0638 -0.1615 159 THR A C 1207 O O . THR A 159 ? 0.6459 0.7700 0.5712 0.0781 0.0633 -0.1662 159 THR A O 1208 C CB . THR A 159 ? 0.7031 0.7424 0.5334 0.0723 0.0481 -0.1735 159 THR A CB 1209 O OG1 . THR A 159 ? 0.7476 0.7556 0.5288 0.0797 0.0481 -0.1779 159 THR A OG1 1210 C CG2 . THR A 159 ? 0.7027 0.7277 0.5337 0.0797 0.0391 -0.1825 159 THR A CG2 1211 N N . VAL A 160 ? 0.6309 0.7496 0.5581 0.0490 0.0591 -0.1534 160 VAL A N 1212 C CA . VAL A 160 ? 0.5998 0.7410 0.5676 0.0387 0.0534 -0.1502 160 VAL A CA 1213 C C . VAL A 160 ? 0.5989 0.7821 0.5988 0.0410 0.0672 -0.1444 160 VAL A C 1214 O O . VAL A 160 ? 0.5816 0.7857 0.6104 0.0438 0.0622 -0.1472 160 VAL A O 1215 C CB . VAL A 160 ? 0.5874 0.7191 0.5610 0.0207 0.0445 -0.1437 160 VAL A CB 1216 C CG1 . VAL A 160 ? 0.5627 0.7122 0.5717 0.0108 0.0384 -0.1412 160 VAL A CG1 1217 C CG2 . VAL A 160 ? 0.5840 0.6864 0.5370 0.0198 0.0304 -0.1490 160 VAL A CG2 1218 N N . GLN A 161 ? 0.6203 0.8174 0.6150 0.0401 0.0843 -0.1358 161 GLN A N 1219 C CA . GLN A 161 ? 0.6248 0.8697 0.6533 0.0411 0.1010 -0.1278 161 GLN A CA 1220 C C . GLN A 161 ? 0.6316 0.8983 0.6698 0.0652 0.1056 -0.1361 161 GLN A C 1221 O O . GLN A 161 ? 0.6170 0.9240 0.6983 0.0649 0.1048 -0.1341 161 GLN A O 1222 C CB . GLN A 161 ? 0.6513 0.9040 0.6636 0.0387 0.1224 -0.1161 161 GLN A CB 1223 C CG . GLN A 161 ? 0.6476 0.8946 0.6670 0.0124 0.1209 -0.1027 161 GLN A CG 1224 C CD . GLN A 161 ? 0.6760 0.9178 0.6657 0.0110 0.1408 -0.0907 161 GLN A CD 1225 O OE1 . GLN A 161 ? 0.6947 0.9725 0.6954 0.0162 0.1640 -0.0822 161 GLN A OE1 1226 N NE2 . GLN A 161 ? 0.6896 0.8883 0.6410 0.0053 0.1321 -0.0891 161 GLN A NE2 1227 N N . MET A 162 ? 0.6607 0.8979 0.6568 0.0864 0.1081 -0.1457 162 MET A N 1228 C CA . MET A 162 ? 0.6788 0.9229 0.6722 0.1137 0.1107 -0.1551 162 MET A CA 1229 C C . MET A 162 ? 0.6572 0.9007 0.6734 0.1135 0.0911 -0.1614 162 MET A C 1230 O O . MET A 162 ? 0.6562 0.9307 0.6977 0.1295 0.0927 -0.1634 162 MET A O 1231 C CB . MET A 162 ? 0.7194 0.9140 0.6527 0.1328 0.1113 -0.1656 162 MET A CB 1232 C CG . MET A 162 ? 0.7507 0.9408 0.6698 0.1648 0.1143 -0.1760 162 MET A CG 1233 S SD . MET A 162 ? 0.8115 0.9228 0.6567 0.1792 0.1021 -0.1912 162 MET A SD 1234 C CE . MET A 162 ? 0.7735 0.8546 0.6275 0.1546 0.0742 -0.1936 162 MET A CE 1235 N N . LEU A 163 ? 0.6452 0.8550 0.6516 0.0970 0.0732 -0.1639 163 LEU A N 1236 C CA . LEU A 163 ? 0.6328 0.8354 0.6521 0.0964 0.0555 -0.1691 163 LEU A CA 1237 C C . LEU A 163 ? 0.6099 0.8538 0.6783 0.0850 0.0503 -0.1634 163 LEU A C 1238 O O . LEU A 163 ? 0.6053 0.8619 0.6906 0.0951 0.0410 -0.1674 163 LEU A O 1239 C CB . LEU A 163 ? 0.6275 0.7862 0.6220 0.0830 0.0411 -0.1721 163 LEU A CB 1240 C CG . LEU A 163 ? 0.6592 0.7725 0.6074 0.0913 0.0384 -0.1793 163 LEU A CG 1241 C CD1 . LEU A 163 ? 0.6488 0.7354 0.5845 0.0724 0.0272 -0.1781 163 LEU A CD1 1242 C CD2 . LEU A 163 ? 0.6811 0.7747 0.6140 0.1100 0.0324 -0.1873 163 LEU A CD2 1243 N N . LEU A 164 ? 0.6021 0.8629 0.6900 0.0637 0.0542 -0.1542 164 LEU A N 1244 C CA . LEU A 164 ? 0.5887 0.8829 0.7204 0.0483 0.0466 -0.1487 164 LEU A CA 1245 C C . LEU A 164 ? 0.5949 0.9477 0.7670 0.0552 0.0585 -0.1431 164 LEU A C 1246 O O . LEU A 164 ? 0.5873 0.9692 0.7916 0.0594 0.0478 -0.1452 164 LEU A O 1247 C CB . LEU A 164 ? 0.5832 0.8654 0.7167 0.0218 0.0441 -0.1407 164 LEU A CB 1248 C CG . LEU A 164 ? 0.5831 0.8169 0.6853 0.0155 0.0317 -0.1450 164 LEU A CG 1249 C CD1 . LEU A 164 ? 0.5875 0.8104 0.6914 -0.0062 0.0295 -0.1367 164 LEU A CD1 1250 C CD2 . LEU A 164 ? 0.5732 0.7926 0.6748 0.0209 0.0141 -0.1538 164 LEU A CD2 1251 N N . ASN A 165 ? 0.6124 0.9845 0.7826 0.0575 0.0808 -0.1354 165 ASN A N 1252 C CA . ASN A 165 ? 0.6211 1.0573 0.8335 0.0636 0.0970 -0.1273 165 ASN A CA 1253 C C . ASN A 165 ? 0.6309 1.0887 0.8475 0.0981 0.1000 -0.1357 165 ASN A C 1254 O O . ASN A 165 ? 0.6238 1.1381 0.8890 0.1033 0.0994 -0.1324 165 ASN A O 1255 C CB . ASN A 165 ? 0.6430 1.0915 0.8453 0.0590 0.1236 -0.1156 165 ASN A CB 1256 C CG . ASN A 165 ? 0.6479 1.0821 0.8521 0.0248 0.1217 -0.1040 165 ASN A CG 1257 O OD1 . ASN A 165 ? 0.6331 1.0460 0.8447 0.0055 0.1004 -0.1058 165 ASN A OD1 1258 N ND2 . ASN A 165 ? 0.6796 1.1217 0.8720 0.0192 0.1447 -0.0918 165 ASN A ND2 1259 N N . ASP A 166 ? 0.6514 1.0630 0.8169 0.1214 0.1014 -0.1464 166 ASP A N 1260 C CA . ASP A 166 ? 0.6748 1.0954 0.8317 0.1584 0.1066 -0.1545 166 ASP A CA 1261 C C . ASP A 166 ? 0.6784 1.0547 0.8099 0.1724 0.0845 -0.1670 166 ASP A C 1262 O O . ASP A 166 ? 0.6816 1.0824 0.8343 0.1924 0.0773 -0.1704 166 ASP A O 1263 C CB . ASP A 166 ? 0.7115 1.1137 0.8241 0.1798 0.1293 -0.1565 166 ASP A CB 1264 C CG . ASP A 166 ? 0.7211 1.1761 0.8589 0.1741 0.1565 -0.1426 166 ASP A CG 1265 O OD1 . ASP A 166 ? 0.7053 1.2270 0.9045 0.1640 0.1610 -0.1322 166 ASP A OD1 1266 O OD2 . ASP A 166 ? 0.7504 1.1801 0.8455 0.1789 0.1730 -0.1415 166 ASP A OD2 1267 N N . THR A 167 ? 0.6812 0.9945 0.7684 0.1619 0.0740 -0.1725 167 THR A N 1268 C CA . THR A 167 ? 0.6952 0.9590 0.7485 0.1748 0.0573 -0.1826 167 THR A CA 1269 C C . THR A 167 ? 0.6741 0.9447 0.7524 0.1670 0.0368 -0.1830 167 THR A C 1270 O O . THR A 167 ? 0.6924 0.9509 0.7611 0.1879 0.0268 -0.1887 167 THR A O 1271 C CB . THR A 167 ? 0.7072 0.9069 0.7094 0.1636 0.0527 -0.1869 167 THR A CB 1272 O OG1 . THR A 167 ? 0.7317 0.9246 0.7095 0.1667 0.0691 -0.1860 167 THR A OG1 1273 C CG2 . THR A 167 ? 0.7372 0.8846 0.6985 0.1804 0.0410 -0.1961 167 THR A CG2 1274 N N . CYS A 168 ? 0.6436 0.9279 0.7480 0.1387 0.0295 -0.1772 168 CYS A N 1275 C CA . CYS A 168 ? 0.6288 0.9155 0.7511 0.1310 0.0091 -0.1784 168 CYS A CA 1276 C C . CYS A 168 ? 0.6280 0.9616 0.7868 0.1494 0.0026 -0.1789 168 CYS A C 1277 O O . CYS A 168 ? 0.6417 0.9566 0.7862 0.1663 -0.0113 -0.1845 168 CYS A O 1278 C CB . CYS A 168 ? 0.6076 0.8996 0.7490 0.0997 0.0028 -0.1728 168 CYS A CB 1279 S SG . CYS A 168 ? 0.6114 0.8811 0.7504 0.0908 -0.0226 -0.1768 168 CYS A SG 1280 N N . PRO A 169 ? 0.6154 1.0116 0.8216 0.1466 0.0129 -0.1720 169 PRO A N 1281 C CA . PRO A 169 ? 0.6139 1.0651 0.8639 0.1628 0.0050 -0.1715 169 PRO A CA 1282 C C . PRO A 169 ? 0.6391 1.0851 0.8687 0.2041 0.0090 -0.1781 169 PRO A C 1283 O O . PRO A 169 ? 0.6478 1.1114 0.8928 0.2227 -0.0067 -0.1812 169 PRO A O 1284 C CB . PRO A 169 ? 0.6033 1.1232 0.9063 0.1492 0.0215 -0.1603 169 PRO A CB 1285 C CG . PRO A 169 ? 0.5950 1.0875 0.8814 0.1191 0.0307 -0.1548 169 PRO A CG 1286 C CD . PRO A 169 ? 0.6077 1.0294 0.8305 0.1285 0.0324 -0.1628 169 PRO A CD 1287 N N . LEU A 170 ? 0.6553 1.0729 0.8463 0.2195 0.0282 -0.1806 170 LEU A N 1288 C CA . LEU A 170 ? 0.6886 1.0905 0.8508 0.2606 0.0330 -0.1879 170 LEU A CA 1289 C C . LEU A 170 ? 0.7044 1.0411 0.8214 0.2711 0.0122 -0.1958 170 LEU A C 1290 O O . LEU A 170 ? 0.7295 1.0653 0.8403 0.3029 0.0039 -0.2002 170 LEU A O 1291 C CB . LEU A 170 ? 0.7152 1.0912 0.8374 0.2720 0.0564 -0.1900 170 LEU A CB 1292 C CG . LEU A 170 ? 0.7660 1.1134 0.8461 0.3162 0.0634 -0.1989 170 LEU A CG 1293 C CD1 . LEU A 170 ? 0.7769 1.1977 0.9023 0.3495 0.0726 -0.1966 170 LEU A CD1 1294 C CD2 . LEU A 170 ? 0.7974 1.1030 0.8266 0.3192 0.0816 -0.2023 170 LEU A CD2 1295 N N . PHE A 171 ? 0.6907 0.9744 0.7764 0.2449 0.0045 -0.1965 171 PHE A N 1296 C CA . PHE A 171 ? 0.7076 0.9286 0.7496 0.2486 -0.0121 -0.2012 171 PHE A CA 1297 C C . PHE A 171 ? 0.6967 0.9353 0.7620 0.2489 -0.0335 -0.2003 171 PHE A C 1298 O O . PHE A 171 ? 0.7274 0.9373 0.7670 0.2718 -0.0459 -0.2038 171 PHE A O 1299 C CB . PHE A 171 ? 0.6985 0.8687 0.7075 0.2196 -0.0116 -0.2005 171 PHE A CB 1300 C CG . PHE A 171 ? 0.7193 0.8291 0.6862 0.2186 -0.0257 -0.2026 171 PHE A CG 1301 C CD1 . PHE A 171 ? 0.7665 0.8248 0.6862 0.2409 -0.0273 -0.2072 171 PHE A CD1 1302 C CD2 . PHE A 171 ? 0.6982 0.7996 0.6692 0.1958 -0.0363 -0.1992 171 PHE A CD2 1303 C CE1 . PHE A 171 ? 0.7924 0.7937 0.6725 0.2370 -0.0389 -0.2066 171 PHE A CE1 1304 C CE2 . PHE A 171 ? 0.7231 0.7721 0.6550 0.1945 -0.0459 -0.1990 171 PHE A CE2 1305 C CZ . PHE A 171 ? 0.7702 0.7699 0.6580 0.2134 -0.0469 -0.2017 171 PHE A CZ 1306 N N . VAL A 172 ? 0.6575 0.9386 0.7668 0.2241 -0.0392 -0.1957 172 VAL A N 1307 C CA . VAL A 172 ? 0.6489 0.9415 0.7757 0.2198 -0.0624 -0.1958 172 VAL A CA 1308 C C . VAL A 172 ? 0.6631 0.9997 0.8188 0.2497 -0.0733 -0.1971 172 VAL A C 1309 O O . VAL A 172 ? 0.6818 0.9997 0.8223 0.2628 -0.0938 -0.1998 172 VAL A O 1310 C CB . VAL A 172 ? 0.6155 0.9369 0.7784 0.1851 -0.0678 -0.1916 172 VAL A CB 1311 C CG1 . VAL A 172 ? 0.6177 0.9409 0.7885 0.1817 -0.0945 -0.1937 172 VAL A CG1 1312 C CG2 . VAL A 172 ? 0.6031 0.8806 0.7358 0.1606 -0.0586 -0.1903 172 VAL A CG2 1313 N N . ARG A 173 ? 0.6558 1.0519 0.8521 0.2619 -0.0589 -0.1945 173 ARG A N 1314 C CA . ARG A 173 ? 0.6705 1.1173 0.8988 0.2954 -0.0658 -0.1952 173 ARG A CA 1315 C C . ARG A 173 ? 0.7142 1.1050 0.8871 0.3338 -0.0708 -0.2017 173 ARG A C 1316 O O . ARG A 173 ? 0.7357 1.1377 0.9144 0.3590 -0.0898 -0.2036 173 ARG A O 1317 C CB . ARG A 173 ? 0.6618 1.1803 0.9378 0.3040 -0.0424 -0.1901 173 ARG A CB 1318 C CG . ARG A 173 ? 0.6293 1.2203 0.9745 0.2706 -0.0424 -0.1813 173 ARG A CG 1319 C CD . ARG A 173 ? 0.6337 1.3023 1.0283 0.2817 -0.0166 -0.1738 173 ARG A CD 1320 N NE . ARG A 173 ? 0.6372 1.2778 0.9978 0.2791 0.0132 -0.1724 173 ARG A NE 1321 N N . GLY A 174 ? 0.7321 1.0595 0.8494 0.3369 -0.0558 -0.2048 174 GLY A N 1322 C CA . GLY A 174 ? 0.7817 1.0384 0.8357 0.3665 -0.0610 -0.2104 174 GLY A CA 1323 C C . GLY A 174 ? 0.7935 0.9962 0.8124 0.3574 -0.0833 -0.2103 174 GLY A C 1324 O O . GLY A 174 ? 0.8357 1.0064 0.8239 0.3864 -0.0971 -0.2124 174 GLY A O 1325 N N . LEU A 175 ? 0.7606 0.9519 0.7813 0.3193 -0.0860 -0.2073 175 LEU A N 1326 C CA . LEU A 175 ? 0.7701 0.9163 0.7595 0.3087 -0.1041 -0.2061 175 LEU A CA 1327 C C . LEU A 175 ? 0.7754 0.9574 0.7916 0.3217 -0.1281 -0.2063 175 LEU A C 1328 O O . LEU A 175 ? 0.8112 0.9501 0.7884 0.3353 -0.1445 -0.2063 175 LEU A O 1329 C CB . LEU A 175 ? 0.7357 0.8701 0.7252 0.2685 -0.0996 -0.2032 175 LEU A CB 1330 C CG . LEU A 175 ? 0.7381 0.8125 0.6822 0.2512 -0.0867 -0.2018 175 LEU A CG 1331 C CD1 . LEU A 175 ? 0.7005 0.7755 0.6527 0.2182 -0.0873 -0.1987 175 LEU A CD1 1332 C CD2 . LEU A 175 ? 0.7840 0.7885 0.6680 0.2662 -0.0927 -0.2012 175 LEU A CD2 1333 N N . LEU A 176 ? 0.7440 1.0038 0.8256 0.3161 -0.1309 -0.2055 176 LEU A N 1334 C CA . LEU A 176 ? 0.7480 1.0512 0.8640 0.3247 -0.1570 -0.2059 176 LEU A CA 1335 C C . LEU A 176 ? 0.7899 1.0993 0.8989 0.3704 -0.1684 -0.2080 176 LEU A C 1336 O O . LEU A 176 ? 0.8145 1.1203 0.9167 0.3838 -0.1946 -0.2090 176 LEU A O 1337 C CB . LEU A 176 ? 0.7066 1.0941 0.8987 0.3031 -0.1571 -0.2032 176 LEU A CB 1338 C CG . LEU A 176 ? 0.6742 1.0562 0.8751 0.2589 -0.1567 -0.2015 176 LEU A CG 1339 C CD1 . LEU A 176 ? 0.6396 1.0963 0.9092 0.2374 -0.1472 -0.1965 176 LEU A CD1 1340 C CD2 . LEU A 176 ? 0.6879 1.0463 0.8726 0.2487 -0.1859 -0.2044 176 LEU A CD2 1341 N N . GLU A 177 ? 0.8055 1.1212 0.9122 0.3967 -0.1496 -0.2090 177 GLU A N 1342 C CA . GLU A 177 ? 0.8552 1.1681 0.9472 0.4457 -0.1584 -0.2115 177 GLU A CA 1343 C C . GLU A 177 ? 0.9090 1.1194 0.9151 0.4606 -0.1648 -0.2129 177 GLU A C 1344 O O . GLU A 177 ? 0.9529 1.1433 0.9354 0.4921 -0.1851 -0.2135 177 GLU A O 1345 C CB . GLU A 177 ? 0.8597 1.2143 0.9758 0.4729 -0.1349 -0.2127 177 GLU A CB 1346 C CG . GLU A 177 ? 0.8250 1.2936 1.0317 0.4711 -0.1314 -0.2089 177 GLU A CG 1347 C CD . GLU A 177 ? 0.8503 1.3642 1.0772 0.5140 -0.1122 -0.2099 177 GLU A CD 1348 O OE1 . GLU A 177 ? 0.8969 1.4052 1.1085 0.5604 -0.1241 -0.2131 177 GLU A OE1 1349 O OE2 . GLU A 177 ? 0.8268 1.3810 1.0823 0.5036 -0.0847 -0.2071 177 GLU A OE2 1350 N N . ALA A 178 ? 0.9083 1.0550 0.8689 0.4369 -0.1483 -0.2125 178 ALA A N 1351 C CA . ALA A 178 ? 0.9606 1.0089 0.8411 0.4429 -0.1515 -0.2116 178 ALA A CA 1352 C C . ALA A 178 ? 0.9724 0.9879 0.8271 0.4296 -0.1720 -0.2076 178 ALA A C 1353 O O . ALA A 178 ? 1.0281 0.9789 0.8251 0.4487 -0.1833 -0.2053 178 ALA A O 1354 C CB . ALA A 178 ? 0.9533 0.9533 0.8017 0.4166 -0.1298 -0.2114 178 ALA A CB 1355 N N . GLY A 179 ? 0.9266 0.9825 0.8192 0.3980 -0.1765 -0.2064 179 GLY A N 1356 C CA . GLY A 179 ? 0.9406 0.9665 0.8065 0.3847 -0.1942 -0.2036 179 GLY A CA 1357 C C . GLY A 179 ? 0.9394 1.0192 0.8438 0.3946 -0.2213 -0.2058 179 GLY A C 1358 O O . GLY A 179 ? 0.9413 1.0084 0.8329 0.3785 -0.2361 -0.2052 179 GLY A O 1359 N N . LYS A 180 ? 0.9413 1.0817 0.8919 0.4221 -0.2285 -0.2085 180 LYS A N 1360 C CA . LYS A 180 ? 0.9407 1.1438 0.9382 0.4316 -0.2569 -0.2104 180 LYS A CA 1361 C C . LYS A 180 ? 0.9942 1.1456 0.9378 0.4468 -0.2851 -0.2098 180 LYS A C 1362 O O . LYS A 180 ? 0.9912 1.1641 0.9503 0.4342 -0.3090 -0.2116 180 LYS A O 1363 C CB . LYS A 180 ? 0.9431 1.2163 0.9931 0.4666 -0.2580 -0.2118 180 LYS A CB 1364 C CG . LYS A 180 ? 0.9285 1.2905 1.0501 0.4686 -0.2849 -0.2128 180 LYS A CG 1365 C CD . LYS A 180 ? 0.9399 1.3715 1.1102 0.5102 -0.2856 -0.2128 180 LYS A CD 1366 N N . SER A 181 ? 1.0507 1.1285 0.9262 0.4731 -0.2826 -0.2069 181 SER A N 1367 C CA . SER A 181 ? 1.1131 1.1315 0.9260 0.4919 -0.3067 -0.2042 181 SER A CA 1368 C C . SER A 181 ? 1.1142 1.0875 0.8873 0.4590 -0.3088 -0.2017 181 SER A C 1369 O O . SER A 181 ? 1.1430 1.1094 0.8979 0.4646 -0.3357 -0.2024 181 SER A O 1370 C CB . SER A 181 ? 1.1759 1.1167 0.9201 0.5229 -0.2993 -0.1999 181 SER A CB 1371 O OG . SER A 181 ? 1.2419 1.1295 0.9271 0.5469 -0.3242 -0.1960 181 SER A OG 1372 N N . ASP A 182 ? 1.0870 1.0310 0.8456 0.4270 -0.2811 -0.1990 182 ASP A N 1373 C CA . ASP A 182 ? 1.0880 0.9922 0.8100 0.3978 -0.2776 -0.1960 182 ASP A CA 1374 C C . ASP A 182 ? 1.0460 1.0051 0.8167 0.3730 -0.2889 -0.2022 182 ASP A C 1375 O O . ASP A 182 ? 1.0644 0.9963 0.8026 0.3620 -0.2995 -0.2025 182 ASP A O 1376 C CB . ASP A 182 ? 1.0735 0.9347 0.7694 0.3729 -0.2450 -0.1904 182 ASP A CB 1377 C CG . ASP A 182 ? 1.1355 0.9141 0.7573 0.3867 -0.2379 -0.1816 182 ASP A CG 1378 O OD1 . ASP A 182 ? 1.1887 0.9386 0.7752 0.4185 -0.2569 -0.1796 182 ASP A OD1 1379 O OD2 . ASP A 182 ? 1.1314 0.8728 0.7301 0.3647 -0.2143 -0.1758 182 ASP A OD2 1380 N N . LEU A 183 ? 0.8380 1.0821 0.8556 0.2406 0.0304 -0.3396 183 LEU A N 1381 C CA . LEU A 183 ? 0.8182 1.0839 0.8092 0.2334 0.0366 -0.3065 183 LEU A CA 1382 C C . LEU A 183 ? 0.7943 1.0571 0.8170 0.2329 0.0410 -0.2795 183 LEU A C 1383 O O . LEU A 183 ? 0.7696 1.0309 0.7823 0.2218 0.0383 -0.2475 183 LEU A O 1384 C CB . LEU A 183 ? 0.8435 1.1502 0.7961 0.2394 0.0527 -0.3170 183 LEU A CB 1385 C CG . LEU A 183 ? 0.8665 1.1837 0.7737 0.2380 0.0463 -0.3345 183 LEU A CG 1386 C CD1 . LEU A 183 ? 0.9051 1.2604 0.7807 0.2483 0.0643 -0.3551 183 LEU A CD1 1387 C CD2 . LEU A 183 ? 0.8446 1.1589 0.7201 0.2258 0.0362 -0.3037 183 LEU A CD2 1388 N N . GLU A 184 ? 0.8050 1.0668 0.8671 0.2454 0.0466 -0.2939 184 GLU A N 1389 C CA . GLU A 184 ? 0.7868 1.0494 0.8843 0.2474 0.0486 -0.2717 184 GLU A CA 1390 C C . GLU A 184 ? 0.7725 0.9922 0.9008 0.2442 0.0307 -0.2588 184 GLU A C 1391 O O . GLU A 184 ? 0.7608 0.9774 0.9213 0.2480 0.0283 -0.2430 184 GLU A O 1392 C CB . GLU A 184 ? 0.8057 1.0969 0.9314 0.2646 0.0652 -0.2919 184 GLU A CB 1393 C CG . GLU A 184 ? 0.8196 1.1578 0.9164 0.2649 0.0866 -0.2944 184 GLU A CG 1394 C CD . GLU A 184 ? 0.8461 1.2167 0.9736 0.2818 0.1057 -0.3162 184 GLU A CD 1395 O OE1 . GLU A 184 ? 0.8414 1.2048 1.0195 0.2920 0.1020 -0.3169 184 GLU A OE1 1396 O OE2 . GLU A 184 ? 0.8732 1.2781 0.9738 0.2854 0.1248 -0.3323 184 GLU A OE2 1397 N N . LYS A 185 ? 0.7756 0.9642 0.8929 0.2367 0.0181 -0.2649 185 LYS A N 1398 C CA . LYS A 185 ? 0.7703 0.9152 0.9110 0.2319 0.0029 -0.2541 185 LYS A CA 1399 C C . LYS A 185 ? 0.7395 0.8763 0.8735 0.2186 -0.0044 -0.2159 185 LYS A C 1400 O O . LYS A 185 ? 0.7235 0.8762 0.8263 0.2078 -0.0023 -0.2012 185 LYS A O 1401 C CB . LYS A 185 ? 0.7854 0.9057 0.9143 0.2246 -0.0054 -0.2727 185 LYS A CB 1402 C CG . LYS A 185 ? 0.7976 0.8700 0.9522 0.2197 -0.0179 -0.2683 185 LYS A CG 1403 C CD . LYS A 185 ? 0.8217 0.8767 0.9690 0.2120 -0.0235 -0.2929 185 LYS A CD 1404 C CE . LYS A 185 ? 0.8281 0.8374 0.9917 0.1996 -0.0345 -0.2798 185 LYS A CE 1405 N N . GLN A 186 ? 0.7356 0.8466 0.8979 0.2201 -0.0134 -0.2003 186 GLN A N 1406 C CA . GLN A 186 ? 0.7103 0.8132 0.8670 0.2083 -0.0212 -0.1662 186 GLN A CA 1407 C C . GLN A 186 ? 0.7131 0.7718 0.8700 0.1980 -0.0343 -0.1546 186 GLN A C 1408 O O . GLN A 186 ? 0.7343 0.7632 0.9158 0.2048 -0.0402 -0.1613 186 GLN A O 1409 C CB . GLN A 186 ? 0.7045 0.8222 0.8901 0.2175 -0.0212 -0.1529 186 GLN A CB 1410 C CG . GLN A 186 ? 0.6959 0.8618 0.8826 0.2236 -0.0059 -0.1587 186 GLN A CG 1411 C CD . GLN A 186 ? 0.6725 0.8589 0.8265 0.2081 -0.0006 -0.1396 186 GLN A CD 1412 O OE1 . GLN A 186 ? 0.6654 0.8865 0.8082 0.2092 0.0140 -0.1450 186 GLN A OE1 1413 N NE2 . GLN A 186 ? 0.6585 0.8219 0.7965 0.1937 -0.0116 -0.1170 186 GLN A NE2 1414 N N . GLU A 187 ? 0.6962 0.7500 0.8258 0.1818 -0.0377 -0.1371 187 GLU A N 1415 C CA . GLU A 187 ? 0.6991 0.7151 0.8258 0.1697 -0.0474 -0.1242 187 GLU A CA 1416 C C . GLU A 187 ? 0.6799 0.6925 0.7939 0.1590 -0.0525 -0.0932 187 GLU A C 1417 O O . GLU A 187 ? 0.6616 0.6967 0.7542 0.1522 -0.0485 -0.0841 187 GLU A O 1418 C CB . GLU A 187 ? 0.7014 0.7120 0.8100 0.1596 -0.0467 -0.1385 187 GLU A CB 1419 C CG . GLU A 187 ? 0.7321 0.7327 0.8567 0.1666 -0.0457 -0.1700 187 GLU A CG 1420 C CD . GLU A 187 ? 0.7610 0.7206 0.9151 0.1697 -0.0514 -0.1697 187 GLU A CD 1421 O OE1 . GLU A 187 ? 0.7792 0.7362 0.9570 0.1850 -0.0494 -0.1875 187 GLU A OE1 1422 O OE2 . GLU A 187 ? 0.7632 0.6923 0.9162 0.1575 -0.0572 -0.1513 187 GLU A OE2 1423 N N . LYS A 188 ? 0.6898 0.6725 0.8159 0.1577 -0.0616 -0.0771 188 LYS A N 1424 C CA . LYS A 188 ? 0.6768 0.6543 0.7910 0.1485 -0.0682 -0.0490 188 LYS A CA 1425 C C . LYS A 188 ? 0.6643 0.6297 0.7500 0.1306 -0.0677 -0.0394 188 LYS A C 1426 O O . LYS A 188 ? 0.6752 0.6160 0.7595 0.1239 -0.0678 -0.0451 188 LYS A O 1427 C CB . LYS A 188 ? 0.6993 0.6483 0.8318 0.1543 -0.0793 -0.0346 188 LYS A CB 1428 C CG . LYS A 188 ? 0.7116 0.6774 0.8757 0.1733 -0.0821 -0.0389 188 LYS A CG 1429 C CD . LYS A 188 ? 0.7457 0.6771 0.9303 0.1827 -0.0944 -0.0277 188 LYS A CD 1430 C CE . LYS A 188 ? 0.7593 0.7108 0.9809 0.2044 -0.0974 -0.0346 188 LYS A CE 1431 N NZ . LYS A 188 ? 0.7982 0.7129 1.0443 0.2181 -0.1087 -0.0288 188 LYS A NZ 1432 N N . PRO A 189 ? 0.6430 0.6258 0.7086 0.1224 -0.0664 -0.0258 189 PRO A N 1433 C CA . PRO A 189 ? 0.6321 0.6036 0.6729 0.1069 -0.0659 -0.0157 189 PRO A CA 1434 C C . PRO A 189 ? 0.6443 0.5848 0.6800 0.0986 -0.0733 0.0031 189 PRO A C 1435 O O . PRO A 189 ? 0.6553 0.5872 0.7026 0.1048 -0.0812 0.0138 189 PRO A O 1436 C CB . PRO A 189 ? 0.6110 0.6082 0.6360 0.1032 -0.0626 -0.0071 189 PRO A CB 1437 C CG . PRO A 189 ? 0.6124 0.6270 0.6555 0.1127 -0.0649 -0.0035 189 PRO A CG 1438 C CD . PRO A 189 ? 0.6293 0.6441 0.6969 0.1269 -0.0638 -0.0211 189 PRO A CD 1439 N N . VAL A 190 ? 0.6435 0.5691 0.6617 0.0852 -0.0705 0.0071 190 VAL A N 1440 C CA . VAL A 190 ? 0.6550 0.5543 0.6595 0.0745 -0.0745 0.0261 190 VAL A CA 1441 C C . VAL A 190 ? 0.6390 0.5481 0.6184 0.0629 -0.0701 0.0325 190 VAL A C 1442 O O . VAL A 190 ? 0.6239 0.5493 0.5994 0.0614 -0.0635 0.0208 190 VAL A O 1443 C CB . VAL A 190 ? 0.6781 0.5463 0.6884 0.0680 -0.0721 0.0233 190 VAL A CB 1444 C CG1 . VAL A 190 ? 0.6914 0.5354 0.6800 0.0538 -0.0721 0.0431 190 VAL A CG1 1445 C CG2 . VAL A 190 ? 0.7006 0.5514 0.7360 0.0800 -0.0774 0.0191 190 VAL A CG2 1446 N N . ALA A 191 ? 0.6444 0.5436 0.6066 0.0558 -0.0748 0.0505 191 ALA A N 1447 C CA . ALA A 191 ? 0.6288 0.5347 0.5677 0.0453 -0.0707 0.0555 191 ALA A CA 1448 C C . ALA A 191 ? 0.6476 0.5293 0.5650 0.0325 -0.0698 0.0682 191 ALA A C 1449 O O . ALA A 191 ? 0.6706 0.5308 0.5858 0.0318 -0.0758 0.0800 191 ALA A O 1450 C CB . ALA A 191 ? 0.6182 0.5439 0.5541 0.0481 -0.0757 0.0612 191 ALA A CB 1451 N N . TRP A 192 ? 0.6389 0.5239 0.5397 0.0230 -0.0618 0.0659 192 TRP A N 1452 C CA . TRP A 192 ? 0.6554 0.5221 0.5320 0.0101 -0.0581 0.0762 192 TRP A CA 1453 C C . TRP A 192 ? 0.6458 0.5232 0.5043 0.0039 -0.0526 0.0738 192 TRP A C 1454 O O . TRP A 192 ? 0.6265 0.5224 0.4926 0.0090 -0.0500 0.0641 192 TRP A O 1455 C CB . TRP A 192 ? 0.6686 0.5180 0.5499 0.0026 -0.0491 0.0735 192 TRP A CB 1456 C CG . TRP A 192 ? 0.6440 0.5079 0.5403 0.0017 -0.0393 0.0556 192 TRP A CG 1457 C CD1 . TRP A 192 ? 0.6339 0.5027 0.5227 -0.0070 -0.0287 0.0505 192 TRP A CD1 1458 C CD2 . TRP A 192 ? 0.6230 0.4999 0.5451 0.0106 -0.0403 0.0396 192 TRP A CD2 1459 N NE1 . TRP A 192 ? 0.6139 0.4994 0.5239 -0.0036 -0.0248 0.0333 192 TRP A NE1 1460 C CE2 . TRP A 192 ? 0.6087 0.4990 0.5371 0.0066 -0.0320 0.0262 192 TRP A CE2 1461 C CE3 . TRP A 192 ? 0.6259 0.5060 0.5664 0.0223 -0.0474 0.0339 192 TRP A CE3 1462 C CZ2 . TRP A 192 ? 0.6051 0.5122 0.5547 0.0132 -0.0326 0.0078 192 TRP A CZ2 1463 C CZ3 . TRP A 192 ? 0.6148 0.5101 0.5747 0.0285 -0.0458 0.0144 192 TRP A CZ3 1464 C CH2 . TRP A 192 ? 0.6045 0.5131 0.5674 0.0236 -0.0394 0.0019 192 TRP A CH2 1465 N N . LEU A 193 ? 0.6647 0.5286 0.4974 -0.0066 -0.0506 0.0829 193 LEU A N 1466 C CA . LEU A 193 ? 0.6584 0.5284 0.4729 -0.0124 -0.0456 0.0797 193 LEU A CA 1467 C C . LEU A 193 ? 0.6656 0.5290 0.4702 -0.0217 -0.0312 0.0746 193 LEU A C 1468 O O . LEU A 193 ? 0.6872 0.5356 0.4862 -0.0289 -0.0260 0.0802 193 LEU A O 1469 C CB . LEU A 193 ? 0.6771 0.5415 0.4683 -0.0170 -0.0553 0.0906 193 LEU A CB 1470 C CG . LEU A 193 ? 0.6705 0.5462 0.4731 -0.0095 -0.0701 0.0955 193 LEU A CG 1471 C CD1 . LEU A 193 ? 0.6873 0.5587 0.4654 -0.0165 -0.0804 0.1043 193 LEU A CD1 1472 C CD2 . LEU A 193 ? 0.6425 0.5392 0.4643 -0.0028 -0.0680 0.0854 193 LEU A CD2 1473 N N . SER A 194 ? 0.6494 0.5239 0.4535 -0.0213 -0.0240 0.0643 194 SER A N 1474 C CA . SER A 194 ? 0.6564 0.5285 0.4514 -0.0292 -0.0099 0.0580 194 SER A CA 1475 C C . SER A 194 ? 0.6504 0.5279 0.4347 -0.0281 -0.0073 0.0514 194 SER A C 1476 O O . SER A 194 ? 0.6393 0.5214 0.4244 -0.0226 -0.0160 0.0526 194 SER A O 1477 C CB . SER A 194 ? 0.6434 0.5260 0.4648 -0.0270 -0.0014 0.0468 194 SER A CB 1478 O OG . SER A 194 ? 0.6233 0.5243 0.4628 -0.0155 -0.0044 0.0366 194 SER A OG 1479 N N . SER A 195 ? 0.6587 0.5351 0.4348 -0.0336 0.0057 0.0440 195 SER A N 1480 C CA . SER A 195 ? 0.6578 0.5359 0.4260 -0.0317 0.0097 0.0358 195 SER A CA 1481 C C . SER A 195 ? 0.6550 0.5420 0.4356 -0.0300 0.0243 0.0227 195 SER A C 1482 O O . SER A 195 ? 0.6656 0.5548 0.4505 -0.0365 0.0349 0.0205 195 SER A O 1483 C CB . SER A 195 ? 0.6861 0.5497 0.4206 -0.0413 0.0082 0.0398 195 SER A CB 1484 O OG . SER A 195 ? 0.7125 0.5677 0.4264 -0.0522 0.0189 0.0413 195 SER A OG 1485 N N . VAL A 196 ? 0.6446 0.5367 0.4329 -0.0211 0.0250 0.0145 196 VAL A N 1486 C CA . VAL A 196 ? 0.6398 0.5433 0.4450 -0.0154 0.0365 0.0013 196 VAL A CA 1487 C C . VAL A 196 ? 0.6497 0.5429 0.4417 -0.0130 0.0406 -0.0053 196 VAL A C 1488 O O . VAL A 196 ? 0.6547 0.5349 0.4308 -0.0143 0.0322 0.0002 196 VAL A O 1489 C CB . VAL A 196 ? 0.6157 0.5379 0.4518 -0.0021 0.0302 -0.0020 196 VAL A CB 1490 C CG1 . VAL A 196 ? 0.6091 0.5298 0.4464 0.0102 0.0216 -0.0004 196 VAL A CG1 1491 C CG2 . VAL A 196 ? 0.6202 0.5608 0.4809 0.0005 0.0406 -0.0148 196 VAL A CG2 1492 N N . PRO A 197 ? 0.6553 0.5543 0.4556 -0.0101 0.0541 -0.0184 197 PRO A N 1493 C CA . PRO A 197 ? 0.6680 0.5545 0.4594 -0.0052 0.0572 -0.0263 197 PRO A CA 1494 C C . PRO A 197 ? 0.6525 0.5375 0.4585 0.0092 0.0461 -0.0230 197 PRO A C 1495 O O . PRO A 197 ? 0.6317 0.5330 0.4609 0.0198 0.0408 -0.0210 197 PRO A O 1496 C CB . PRO A 197 ? 0.6764 0.5741 0.4818 -0.0019 0.0743 -0.0421 197 PRO A CB 1497 C CG . PRO A 197 ? 0.6763 0.5874 0.4853 -0.0128 0.0827 -0.0407 197 PRO A CG 1498 C CD . PRO A 197 ? 0.6568 0.5720 0.4737 -0.0130 0.0684 -0.0275 197 PRO A CD 1499 N N . SER A 198 ? 0.6653 0.5301 0.4560 0.0084 0.0426 -0.0221 198 SER A N 1500 C CA . SER A 198 ? 0.6595 0.5173 0.4607 0.0208 0.0353 -0.0179 198 SER A CA 1501 C C . SER A 198 ? 0.6682 0.5270 0.4871 0.0354 0.0432 -0.0294 198 SER A C 1502 O O . SER A 198 ? 0.6806 0.5434 0.5015 0.0339 0.0557 -0.0428 198 SER A O 1503 C CB . SER A 198 ? 0.6765 0.5106 0.4578 0.0122 0.0304 -0.0140 198 SER A CB 1504 O OG . SER A 198 ? 0.6854 0.5039 0.4741 0.0223 0.0294 -0.0138 198 SER A OG 1505 N N . SER A 199 ? 0.6650 0.5206 0.4968 0.0502 0.0363 -0.0236 199 SER A N 1506 C CA . SER A 199 ? 0.6783 0.5319 0.5280 0.0672 0.0411 -0.0325 199 SER A CA 1507 C C . SER A 199 ? 0.7084 0.5319 0.5459 0.0647 0.0488 -0.0418 199 SER A C 1508 O O . SER A 199 ? 0.7246 0.5451 0.5760 0.0766 0.0569 -0.0546 199 SER A O 1509 C CB . SER A 199 ? 0.6718 0.5287 0.5346 0.0846 0.0298 -0.0207 199 SER A CB 1510 O OG . SER A 199 ? 0.6909 0.5196 0.5390 0.0831 0.0251 -0.0093 199 SER A OG 1511 N N . ALA A 200 ? 0.7174 0.5202 0.5314 0.0496 0.0459 -0.0370 200 ALA A N 1512 C CA . ALA A 200 ? 0.7506 0.5232 0.5508 0.0438 0.0517 -0.0476 200 ALA A CA 1513 C C . ALA A 200 ? 0.7628 0.5373 0.5432 0.0289 0.0617 -0.0624 200 ALA A C 1514 O O . ALA A 200 ? 0.7509 0.5391 0.5175 0.0159 0.0590 -0.0569 200 ALA A O 1515 C CB . ALA A 200 ? 0.7579 0.5083 0.5458 0.0345 0.0423 -0.0357 200 ALA A CB 1516 N N . HIS A 201 ? 0.7928 0.5522 0.5707 0.0317 0.0733 -0.0810 201 HIS A N 1517 C CA . HIS A 201 ? 0.8127 0.5739 0.5683 0.0188 0.0854 -0.0973 201 HIS A CA 1518 C C . HIS A 201 ? 0.8241 0.5739 0.5458 -0.0022 0.0778 -0.0938 201 HIS A C 1519 O O . HIS A 201 ? 0.8388 0.5655 0.5534 -0.0073 0.0696 -0.0928 201 HIS A O 1520 C CB . HIS A 201 ? 0.8471 0.5924 0.6071 0.0275 0.0997 -0.1203 201 HIS A CB 1521 C CG . HIS A 201 ? 0.8779 0.6231 0.6096 0.0138 0.1136 -0.1388 201 HIS A CG 1522 N ND1 . HIS A 201 ? 0.8762 0.6482 0.6060 0.0105 0.1272 -0.1443 201 HIS A ND1 1523 C CD2 . HIS A 201 ? 0.9122 0.6339 0.6143 0.0016 0.1162 -0.1535 201 HIS A CD2 1524 C CE1 . HIS A 201 ? 0.9092 0.6741 0.6063 -0.0025 0.1385 -0.1600 201 HIS A CE1 1525 N NE2 . HIS A 201 ? 0.9329 0.6680 0.6121 -0.0076 0.1312 -0.1669 201 HIS A NE2 1526 N N . GLY A 202 ? 0.8197 0.5861 0.5220 -0.0144 0.0803 -0.0917 202 GLY A N 1527 C CA . GLY A 202 ? 0.8341 0.5936 0.5025 -0.0331 0.0718 -0.0884 202 GLY A CA 1528 C C . GLY A 202 ? 0.8056 0.5732 0.4776 -0.0377 0.0541 -0.0666 202 GLY A C 1529 O O . GLY A 202 ? 0.8154 0.5806 0.4644 -0.0514 0.0438 -0.0617 202 GLY A O 1530 N N . HIS A 203 ? 0.7717 0.5507 0.4728 -0.0254 0.0502 -0.0545 203 HIS A N 1531 C CA . HIS A 203 ? 0.7439 0.5322 0.4520 -0.0273 0.0355 -0.0357 203 HIS A CA 1532 C C . HIS A 203 ? 0.7187 0.5297 0.4341 -0.0255 0.0358 -0.0264 203 HIS A C 1533 O O . HIS A 203 ? 0.7172 0.5386 0.4401 -0.0209 0.0475 -0.0332 203 HIS A O 1534 C CB . HIS A 203 ? 0.7313 0.5138 0.4624 -0.0161 0.0300 -0.0282 203 HIS A CB 1535 C CG . HIS A 203 ? 0.7600 0.5171 0.4853 -0.0214 0.0273 -0.0329 203 HIS A CG 1536 N ND1 . HIS A 203 ? 0.7620 0.5148 0.4907 -0.0279 0.0164 -0.0213 203 HIS A ND1 1537 C CD2 . HIS A 203 ? 0.7960 0.5300 0.5143 -0.0222 0.0349 -0.0492 203 HIS A CD2 1538 C CE1 . HIS A 203 ? 0.7938 0.5213 0.5186 -0.0338 0.0172 -0.0295 203 HIS A CE1 1539 N NE2 . HIS A 203 ? 0.8165 0.5306 0.5342 -0.0300 0.0278 -0.0469 203 HIS A NE2 1540 N N . ARG A 204 ? 0.7000 0.5188 0.4160 -0.0295 0.0232 -0.0118 204 ARG A N 1541 C CA . ARG A 204 ? 0.6799 0.5160 0.4037 -0.0286 0.0215 -0.0026 204 ARG A CA 1542 C C . ARG A 204 ? 0.6547 0.5003 0.3984 -0.0214 0.0103 0.0093 204 ARG A C 1543 O O . ARG A 204 ? 0.6575 0.4971 0.4008 -0.0231 0.0021 0.0141 204 ARG A O 1544 C CB . ARG A 204 ? 0.6962 0.5300 0.3936 -0.0422 0.0179 0.0026 204 ARG A CB 1545 C CG . ARG A 204 ? 0.7128 0.5452 0.3921 -0.0485 0.0326 -0.0053 204 ARG A CG 1546 C CD . ARG A 204 ? 0.6964 0.5399 0.3830 -0.0498 0.0355 0.0038 204 ARG A CD 1547 N NE . ARG A 204 ? 0.6980 0.5496 0.3939 -0.0487 0.0539 -0.0062 204 ARG A NE 1548 C CZ . ARG A 204 ? 0.6859 0.5489 0.3978 -0.0495 0.0598 -0.0022 204 ARG A CZ 1549 N NH1 . ARG A 204 ? 0.6680 0.5322 0.3864 -0.0502 0.0487 0.0114 204 ARG A NH1 1550 N NH2 . ARG A 204 ? 0.6886 0.5623 0.4127 -0.0497 0.0774 -0.0131 204 ARG A NH2 1551 N N . GLN A 205 ? 0.6325 0.4939 0.3941 -0.0141 0.0109 0.0128 205 GLN A N 1552 C CA . GLN A 205 ? 0.6118 0.4842 0.3897 -0.0070 0.0014 0.0221 205 GLN A CA 1553 C C . GLN A 205 ? 0.6060 0.4863 0.3844 -0.0115 -0.0043 0.0296 205 GLN A C 1554 O O . GLN A 205 ? 0.6026 0.4894 0.3877 -0.0114 0.0006 0.0273 205 GLN A O 1555 C CB . GLN A 205 ? 0.5975 0.4815 0.3968 0.0074 0.0042 0.0186 205 GLN A CB 1556 C CG . GLN A 205 ? 0.5859 0.4774 0.3951 0.0156 -0.0040 0.0272 205 GLN A CG 1557 C CD . GLN A 205 ? 0.5821 0.4894 0.4089 0.0300 -0.0041 0.0243 205 GLN A CD 1558 O OE1 . GLN A 205 ? 0.5704 0.4925 0.4086 0.0318 -0.0042 0.0199 205 GLN A OE1 1559 N NE2 . GLN A 205 ? 0.5909 0.4943 0.4196 0.0402 -0.0049 0.0271 205 GLN A NE2 1560 N N . LEU A 206 ? 0.6064 0.4859 0.3803 -0.0156 -0.0147 0.0383 206 LEU A N 1561 C CA . LEU A 206 ? 0.6029 0.4877 0.3793 -0.0175 -0.0220 0.0463 206 LEU A CA 1562 C C . LEU A 206 ? 0.5828 0.4825 0.3826 -0.0067 -0.0249 0.0477 206 LEU A C 1563 O O . LEU A 206 ? 0.5750 0.4815 0.3834 -0.0005 -0.0267 0.0484 206 LEU A O 1564 C CB . LEU A 206 ? 0.6127 0.4941 0.3781 -0.0248 -0.0333 0.0538 206 LEU A CB 1565 C CG . LEU A 206 ? 0.6338 0.5023 0.3740 -0.0359 -0.0341 0.0507 206 LEU A CG 1566 C CD1 . LEU A 206 ? 0.6349 0.5065 0.3703 -0.0418 -0.0490 0.0581 206 LEU A CD1 1567 C CD2 . LEU A 206 ? 0.6508 0.5092 0.3692 -0.0422 -0.0256 0.0472 206 LEU A CD2 1568 N N . VAL A 207 ? 0.5796 0.4832 0.3884 -0.0051 -0.0245 0.0478 207 VAL A N 1569 C CA . VAL A 207 ? 0.5634 0.4811 0.3933 0.0047 -0.0272 0.0457 207 VAL A CA 1570 C C . VAL A 207 ? 0.5663 0.4838 0.4021 0.0048 -0.0354 0.0524 207 VAL A C 1571 O O . VAL A 207 ? 0.5802 0.4860 0.4090 -0.0016 -0.0363 0.0572 207 VAL A O 1572 C CB . VAL A 207 ? 0.5589 0.4831 0.4016 0.0081 -0.0202 0.0359 207 VAL A CB 1573 C CG1 . VAL A 207 ? 0.5427 0.4825 0.4046 0.0184 -0.0244 0.0310 207 VAL A CG1 1574 C CG2 . VAL A 207 ? 0.5577 0.4836 0.3982 0.0104 -0.0128 0.0289 207 VAL A CG2 1575 N N . CYS A 208 ? 0.5566 0.4869 0.4052 0.0127 -0.0406 0.0531 208 CYS A N 1576 C CA . CYS A 208 ? 0.5586 0.4922 0.4196 0.0166 -0.0478 0.0566 208 CYS A CA 1577 C C . CYS A 208 ? 0.5468 0.4913 0.4259 0.0261 -0.0457 0.0469 208 CYS A C 1578 O O . CYS A 208 ? 0.5383 0.4986 0.4238 0.0339 -0.0447 0.0424 208 CYS A O 1579 C CB . CYS A 208 ? 0.5569 0.5007 0.4216 0.0182 -0.0542 0.0625 208 CYS A CB 1580 S SG . CYS A 208 ? 0.5752 0.5252 0.4590 0.0250 -0.0639 0.0665 208 CYS A SG 1581 N N . HIS A 209 ? 0.5521 0.4873 0.4378 0.0244 -0.0446 0.0434 209 HIS A N 1582 C CA . HIS A 209 ? 0.5438 0.4879 0.4477 0.0316 -0.0435 0.0311 209 HIS A CA 1583 C C . HIS A 209 ? 0.5431 0.4907 0.4614 0.0397 -0.0496 0.0307 209 HIS A C 1584 O O . HIS A 209 ? 0.5552 0.4883 0.4756 0.0377 -0.0544 0.0389 209 HIS A O 1585 C CB . HIS A 209 ? 0.5531 0.4846 0.4626 0.0243 -0.0391 0.0265 209 HIS A CB 1586 C CG . HIS A 209 ? 0.5544 0.4837 0.4533 0.0161 -0.0313 0.0259 209 HIS A CG 1587 N ND1 . HIS A 209 ? 0.5489 0.4928 0.4571 0.0186 -0.0268 0.0134 209 HIS A ND1 1588 C CD2 . HIS A 209 ? 0.5664 0.4821 0.4469 0.0062 -0.0271 0.0349 209 HIS A CD2 1589 C CE1 . HIS A 209 ? 0.5555 0.4955 0.4550 0.0112 -0.0193 0.0145 209 HIS A CE1 1590 N NE2 . HIS A 209 ? 0.5689 0.4912 0.4499 0.0032 -0.0185 0.0269 209 HIS A NE2 1591 N N . VAL A 210 ? 0.5312 0.4982 0.4585 0.0497 -0.0493 0.0213 210 VAL A N 1592 C CA . VAL A 210 ? 0.5319 0.5061 0.4753 0.0592 -0.0528 0.0170 210 VAL A CA 1593 C C . VAL A 210 ? 0.5335 0.5154 0.4892 0.0660 -0.0510 -0.0012 210 VAL A C 1594 O O . VAL A 210 ? 0.5268 0.5271 0.4773 0.0706 -0.0483 -0.0099 210 VAL A O 1595 C CB . VAL A 210 ? 0.5233 0.5175 0.4656 0.0646 -0.0525 0.0214 210 VAL A CB 1596 C CG1 . VAL A 210 ? 0.5289 0.5323 0.4913 0.0746 -0.0550 0.0167 210 VAL A CG1 1597 C CG2 . VAL A 210 ? 0.5232 0.5118 0.4535 0.0559 -0.0548 0.0365 210 VAL A CG2 1598 N N . SER A 211 ? 0.5471 0.5140 0.5183 0.0665 -0.0533 -0.0072 211 SER A N 1599 C CA . SER A 211 ? 0.5540 0.5249 0.5385 0.0702 -0.0522 -0.0273 211 SER A CA 1600 C C . SER A 211 ? 0.5689 0.5334 0.5738 0.0790 -0.0548 -0.0374 211 SER A C 1601 O O . SER A 211 ? 0.5827 0.5281 0.5957 0.0794 -0.0583 -0.0268 211 SER A O 1602 C CB . SER A 211 ? 0.5599 0.5156 0.5470 0.0585 -0.0501 -0.0302 211 SER A CB 1603 O OG . SER A 211 ? 0.5607 0.5290 0.5586 0.0604 -0.0499 -0.0515 211 SER A OG 1604 N N . GLY A 212 ? 0.5722 0.5527 0.5847 0.0869 -0.0537 -0.0585 212 GLY A N 1605 C CA . GLY A 212 ? 0.5900 0.5628 0.6240 0.0952 -0.0551 -0.0745 212 GLY A CA 1606 C C . GLY A 212 ? 0.5903 0.5823 0.6298 0.1098 -0.0536 -0.0799 212 GLY A C 1607 O O . GLY A 212 ? 0.6062 0.5905 0.6658 0.1187 -0.0543 -0.0926 212 GLY A O 1608 N N . PHE A 213 ? 0.5754 0.5916 0.5988 0.1120 -0.0504 -0.0710 213 PHE A N 1609 C CA . PHE A 213 ? 0.5771 0.6150 0.6068 0.1237 -0.0465 -0.0735 213 PHE A CA 1610 C C . PHE A 213 ? 0.5873 0.6510 0.6107 0.1327 -0.0405 -0.0953 213 PHE A C 1611 O O . PHE A 213 ? 0.5869 0.6595 0.5922 0.1295 -0.0403 -0.1023 213 PHE A O 1612 C CB . PHE A 213 ? 0.5607 0.6107 0.5797 0.1198 -0.0449 -0.0519 213 PHE A CB 1613 C CG . PHE A 213 ? 0.5439 0.6039 0.5365 0.1123 -0.0418 -0.0444 213 PHE A CG 1614 C CD1 . PHE A 213 ? 0.5343 0.5765 0.5153 0.1008 -0.0454 -0.0322 213 PHE A CD1 1615 C CD2 . PHE A 213 ? 0.5446 0.6310 0.5233 0.1173 -0.0346 -0.0488 213 PHE A CD2 1616 C CE1 . PHE A 213 ? 0.5260 0.5758 0.4856 0.0960 -0.0428 -0.0259 213 PHE A CE1 1617 C CE2 . PHE A 213 ? 0.5406 0.6324 0.4949 0.1119 -0.0326 -0.0397 213 PHE A CE2 1618 C CZ . PHE A 213 ? 0.5271 0.6002 0.4738 0.1020 -0.0373 -0.0289 213 PHE A CZ 1619 N N . TYR A 214 ? 0.6013 0.6782 0.6401 0.1448 -0.0360 -0.1064 214 TYR A N 1620 C CA . TYR A 214 ? 0.6147 0.7196 0.6451 0.1546 -0.0280 -0.1269 214 TYR A CA 1621 C C . TYR A 214 ? 0.6189 0.7435 0.6656 0.1651 -0.0201 -0.1267 214 TYR A C 1622 O O . TYR A 214 ? 0.6231 0.7343 0.6980 0.1701 -0.0238 -0.1241 214 TYR A O 1623 C CB . TYR A 214 ? 0.6361 0.7318 0.6753 0.1593 -0.0308 -0.1558 214 TYR A CB 1624 C CG . TYR A 214 ? 0.6560 0.7811 0.6799 0.1686 -0.0237 -0.1795 214 TYR A CG 1625 C CD1 . TYR A 214 ? 0.6773 0.8163 0.7158 0.1821 -0.0155 -0.1972 214 TYR A CD1 1626 C CD2 . TYR A 214 ? 0.6632 0.8034 0.6572 0.1650 -0.0254 -0.1845 214 TYR A CD2 1627 C CE1 . TYR A 214 ? 0.7054 0.8726 0.7254 0.1905 -0.0076 -0.2198 214 TYR A CE1 1628 C CE2 . TYR A 214 ? 0.6892 0.8570 0.6633 0.1738 -0.0199 -0.2052 214 TYR A CE2 1629 C CZ . TYR A 214 ? 0.7120 0.8930 0.6973 0.1858 -0.0103 -0.2231 214 TYR A CZ 1630 O OH . TYR A 214 ? 0.7425 0.9517 0.7040 0.1943 -0.0035 -0.2447 214 TYR A OH 1631 N N . PRO A 215 ? 0.6218 0.7790 0.6520 0.1688 -0.0089 -0.1285 215 PRO A N 1632 C CA . PRO A 215 ? 0.6253 0.7993 0.6192 0.1651 -0.0046 -0.1284 215 PRO A CA 1633 C C . PRO A 215 ? 0.6091 0.7762 0.5835 0.1525 -0.0078 -0.1016 215 PRO A C 1634 O O . PRO A 215 ? 0.5948 0.7433 0.5819 0.1450 -0.0138 -0.0848 215 PRO A O 1635 C CB . PRO A 215 ? 0.6381 0.8467 0.6263 0.1737 0.0107 -0.1354 215 PRO A CB 1636 C CG . PRO A 215 ? 0.6276 0.8403 0.6494 0.1768 0.0141 -0.1276 215 PRO A CG 1637 C CD . PRO A 215 ? 0.6271 0.8086 0.6772 0.1788 0.0012 -0.1322 215 PRO A CD 1638 N N . LYS A 216 ? 0.6167 0.7982 0.5590 0.1511 -0.0039 -0.0982 216 LYS A N 1639 C CA . LYS A 216 ? 0.6067 0.7796 0.5283 0.1413 -0.0073 -0.0764 216 LYS A CA 1640 C C . LYS A 216 ? 0.5941 0.7640 0.5218 0.1328 -0.0033 -0.0518 216 LYS A C 1641 O O . LYS A 216 ? 0.5811 0.7300 0.5115 0.1238 -0.0106 -0.0384 216 LYS A O 1642 C CB . LYS A 216 ? 0.6241 0.8141 0.5101 0.1450 -0.0040 -0.0777 216 LYS A CB 1643 C CG . LYS A 216 ? 0.6226 0.8002 0.4899 0.1398 -0.0131 -0.0669 216 LYS A CG 1644 C CD . LYS A 216 ? 0.6546 0.8504 0.4851 0.1456 -0.0097 -0.0633 216 LYS A CD 1645 C CE . LYS A 216 ? 0.6617 0.8477 0.4758 0.1441 -0.0202 -0.0543 216 LYS A CE 1646 N NZ . LYS A 216 ? 0.6733 0.8622 0.4918 0.1484 -0.0328 -0.0769 216 LYS A NZ 1647 N N . PRO A 217 ? 0.6008 0.7930 0.5312 0.1346 0.0088 -0.0473 217 PRO A N 1648 C CA . PRO A 217 ? 0.5904 0.7826 0.5270 0.1244 0.0126 -0.0253 217 PRO A CA 1649 C C . PRO A 217 ? 0.5740 0.7464 0.5356 0.1184 0.0017 -0.0180 217 PRO A C 1650 O O . PRO A 217 ? 0.5739 0.7451 0.5615 0.1248 -0.0026 -0.0281 217 PRO A O 1651 C CB . PRO A 217 ? 0.5996 0.8228 0.5478 0.1288 0.0275 -0.0288 217 PRO A CB 1652 C CG . PRO A 217 ? 0.6214 0.8606 0.5489 0.1394 0.0346 -0.0465 217 PRO A CG 1653 C CD . PRO A 217 ? 0.6196 0.8397 0.5487 0.1450 0.0209 -0.0633 217 PRO A CD 1654 N N . VAL A 218 ? 0.5650 0.7210 0.5170 0.1068 -0.0027 -0.0004 218 VAL A N 1655 C CA . VAL A 218 ? 0.5526 0.6891 0.5198 0.0996 -0.0135 0.0079 218 VAL A CA 1656 C C . VAL A 218 ? 0.5491 0.6821 0.5098 0.0865 -0.0124 0.0263 218 VAL A C 1657 O O . VAL A 218 ? 0.5555 0.6920 0.4967 0.0824 -0.0045 0.0337 218 VAL A O 1658 C CB . VAL A 218 ? 0.5491 0.6590 0.5088 0.0988 -0.0235 0.0033 218 VAL A CB 1659 C CG1 . VAL A 218 ? 0.5466 0.6444 0.4808 0.0915 -0.0237 0.0119 218 VAL A CG1 1660 C CG2 . VAL A 218 ? 0.5477 0.6393 0.5245 0.0951 -0.0338 0.0084 218 VAL A CG2 1661 N N . TRP A 219 ? 0.5429 0.6681 0.5196 0.0801 -0.0209 0.0334 219 TRP A N 1662 C CA . TRP A 219 ? 0.5401 0.6595 0.5126 0.0663 -0.0224 0.0477 219 TRP A CA 1663 C C . TRP A 219 ? 0.5363 0.6293 0.5037 0.0602 -0.0353 0.0519 219 TRP A C 1664 O O . TRP A 219 ? 0.5359 0.6253 0.5184 0.0640 -0.0447 0.0499 219 TRP A O 1665 C CB . TRP A 219 ? 0.5405 0.6851 0.5399 0.0634 -0.0200 0.0508 219 TRP A CB 1666 C CG . TRP A 219 ? 0.5481 0.6915 0.5469 0.0475 -0.0201 0.0630 219 TRP A CG 1667 C CD1 . TRP A 219 ? 0.5604 0.7121 0.5524 0.0388 -0.0075 0.0702 219 TRP A CD1 1668 C CD2 . TRP A 219 ? 0.5508 0.6834 0.5558 0.0377 -0.0334 0.0687 219 TRP A CD2 1669 N NE1 . TRP A 219 ? 0.5606 0.7060 0.5574 0.0234 -0.0119 0.0785 219 TRP A NE1 1670 C CE2 . TRP A 219 ? 0.5551 0.6905 0.5590 0.0227 -0.0284 0.0768 219 TRP A CE2 1671 C CE3 . TRP A 219 ? 0.5477 0.6674 0.5569 0.0397 -0.0491 0.0683 219 TRP A CE3 1672 C CZ2 . TRP A 219 ? 0.5583 0.6860 0.5660 0.0096 -0.0395 0.0812 219 TRP A CZ2 1673 C CZ3 . TRP A 219 ? 0.5524 0.6652 0.5614 0.0277 -0.0602 0.0749 219 TRP A CZ3 1674 C CH2 . TRP A 219 ? 0.5557 0.6737 0.5646 0.0128 -0.0558 0.0797 219 TRP A CH2 1675 N N . VAL A 220 ? 0.5360 0.6099 0.4810 0.0516 -0.0352 0.0581 220 VAL A N 1676 C CA . VAL A 220 ? 0.5350 0.5846 0.4703 0.0446 -0.0444 0.0615 220 VAL A CA 1677 C C . VAL A 220 ? 0.5394 0.5787 0.4619 0.0314 -0.0438 0.0700 220 VAL A C 1678 O O . VAL A 220 ? 0.5446 0.5787 0.4530 0.0297 -0.0361 0.0721 220 VAL A O 1679 C CB . VAL A 220 ? 0.5343 0.5671 0.4559 0.0489 -0.0444 0.0551 220 VAL A CB 1680 C CG1 . VAL A 220 ? 0.5380 0.5488 0.4522 0.0419 -0.0520 0.0583 220 VAL A CG1 1681 C CG2 . VAL A 220 ? 0.5317 0.5741 0.4652 0.0610 -0.0434 0.0437 220 VAL A CG2 1682 N N . MET A 221 ? 0.5419 0.5773 0.4688 0.0227 -0.0528 0.0744 221 MET A N 1683 C CA . MET A 221 ? 0.5503 0.5743 0.4658 0.0090 -0.0535 0.0793 221 MET A CA 1684 C C . MET A 221 ? 0.5585 0.5661 0.4630 0.0017 -0.0648 0.0803 221 MET A C 1685 O O . MET A 221 ? 0.5614 0.5731 0.4741 0.0052 -0.0749 0.0814 221 MET A O 1686 C CB . MET A 221 ? 0.5533 0.5971 0.4869 0.0015 -0.0514 0.0830 221 MET A CB 1687 C CG . MET A 221 ? 0.5553 0.6079 0.4890 0.0026 -0.0367 0.0856 221 MET A CG 1688 S SD . MET A 221 ? 0.5680 0.5916 0.4741 -0.0030 -0.0288 0.0898 221 MET A SD 1689 C CE . MET A 221 ? 0.5774 0.5945 0.4899 -0.0229 -0.0309 0.0938 221 MET A CE 1690 N N . TRP A 222 ? 0.5670 0.5553 0.4516 -0.0075 -0.0630 0.0802 222 TRP A N 1691 C CA . TRP A 222 ? 0.5793 0.5535 0.4488 -0.0168 -0.0724 0.0803 222 TRP A CA 1692 C C . TRP A 222 ? 0.5907 0.5761 0.4705 -0.0280 -0.0806 0.0817 222 TRP A C 1693 O O . TRP A 222 ? 0.5911 0.5816 0.4797 -0.0344 -0.0742 0.0817 222 TRP A O 1694 C CB . TRP A 222 ? 0.5874 0.5375 0.4323 -0.0214 -0.0657 0.0763 222 TRP A CB 1695 C CG . TRP A 222 ? 0.5741 0.5149 0.4101 -0.0133 -0.0611 0.0738 222 TRP A CG 1696 C CD1 . TRP A 222 ? 0.5570 0.5003 0.3978 -0.0036 -0.0524 0.0709 222 TRP A CD1 1697 C CD2 . TRP A 222 ? 0.5767 0.5056 0.3979 -0.0155 -0.0649 0.0740 222 TRP A CD2 1698 N NE1 . TRP A 222 ? 0.5525 0.4876 0.3868 -0.0004 -0.0506 0.0676 222 TRP A NE1 1699 C CE2 . TRP A 222 ? 0.5633 0.4884 0.3852 -0.0081 -0.0568 0.0703 222 TRP A CE2 1700 C CE3 . TRP A 222 ? 0.5897 0.5112 0.3957 -0.0234 -0.0745 0.0774 222 TRP A CE3 1701 C CZ2 . TRP A 222 ? 0.5701 0.4834 0.3807 -0.0099 -0.0558 0.0703 222 TRP A CZ2 1702 C CZ3 . TRP A 222 ? 0.5977 0.5058 0.3872 -0.0241 -0.0736 0.0791 222 TRP A CZ3 1703 C CH2 . TRP A 222 ? 0.5864 0.4901 0.3797 -0.0181 -0.0631 0.0758 222 TRP A CH2 1704 N N . MET A 223 ? 0.6031 0.5922 0.4820 -0.0308 -0.0952 0.0835 223 MET A N 1705 C CA . MET A 223 ? 0.6122 0.6194 0.5071 -0.0399 -0.1069 0.0839 223 MET A CA 1706 C C . MET A 223 ? 0.6369 0.6312 0.5080 -0.0513 -0.1194 0.0817 223 MET A C 1707 O O . MET A 223 ? 0.6480 0.6245 0.4930 -0.0490 -0.1225 0.0832 223 MET A O 1708 C CB . MET A 223 ? 0.6051 0.6380 0.5280 -0.0294 -0.1169 0.0880 223 MET A CB 1709 C CG . MET A 223 ? 0.5875 0.6356 0.5331 -0.0167 -0.1048 0.0877 223 MET A CG 1710 S SD . MET A 223 ? 0.5930 0.6674 0.5664 -0.0239 -0.0934 0.0861 223 MET A SD 1711 C CE . MET A 223 ? 0.5871 0.6976 0.5983 -0.0247 -0.1100 0.0864 223 MET A CE 1712 N N . ARG A 224 ? 0.6497 0.6537 0.5297 -0.0648 -0.1259 0.0774 224 ARG A N 1713 C CA . ARG A 224 ? 0.6785 0.6813 0.5427 -0.0754 -0.1434 0.0741 224 ARG A CA 1714 C C . ARG A 224 ? 0.6777 0.7149 0.5763 -0.0777 -0.1590 0.0752 224 ARG A C 1715 O O . ARG A 224 ? 0.6800 0.7307 0.5992 -0.0904 -0.1585 0.0694 224 ARG A O 1716 C CB . ARG A 224 ? 0.6984 0.6814 0.5430 -0.0916 -0.1387 0.0635 224 ARG A CB 1717 C CG . ARG A 224 ? 0.7170 0.6683 0.5238 -0.0905 -0.1289 0.0599 224 ARG A CG 1718 C CD . ARG A 224 ? 0.7589 0.6937 0.5413 -0.1062 -0.1327 0.0472 224 ARG A CD 1719 N NE . ARG A 224 ? 0.7732 0.6787 0.5286 -0.1050 -0.1170 0.0409 224 ARG A NE 1720 C CZ . ARG A 224 ? 0.7861 0.6784 0.5100 -0.1010 -0.1151 0.0407 224 ARG A CZ 1721 N NH1 . ARG A 224 ? 0.7933 0.6944 0.5041 -0.0982 -0.1285 0.0486 224 ARG A NH1 1722 N NH2 . ARG A 224 ? 0.7944 0.6644 0.5007 -0.0997 -0.0993 0.0332 224 ARG A NH2 1723 N N . GLY A 225 ? 0.6775 0.7289 0.5849 -0.0651 -0.1725 0.0829 225 GLY A N 1724 C CA . GLY A 225 ? 0.6760 0.7644 0.6227 -0.0625 -0.1874 0.0843 225 GLY A CA 1725 C C . GLY A 225 ? 0.6524 0.7636 0.6392 -0.0599 -0.1717 0.0828 225 GLY A C 1726 O O . GLY A 225 ? 0.6351 0.7417 0.6257 -0.0470 -0.1573 0.0861 225 GLY A O 1727 N N . ASP A 226 ? 0.6554 0.7914 0.6710 -0.0734 -0.1736 0.0770 226 ASP A N 1728 C CA . ASP A 226 ? 0.6388 0.7996 0.6925 -0.0739 -0.1571 0.0763 226 ASP A CA 1729 C C . ASP A 226 ? 0.6366 0.7732 0.6744 -0.0817 -0.1330 0.0758 226 ASP A C 1730 O O . ASP A 226 ? 0.6265 0.7788 0.6878 -0.0824 -0.1165 0.0773 226 ASP A O 1731 C CB . ASP A 226 ? 0.6441 0.8441 0.7398 -0.0868 -0.1677 0.0709 226 ASP A CB 1732 C CG . ASP A 226 ? 0.6661 0.8545 0.7486 -0.1102 -0.1753 0.0627 226 ASP A CG 1733 O OD1 . ASP A 226 ? 0.6802 0.8298 0.7197 -0.1151 -0.1725 0.0610 226 ASP A OD1 1734 O OD2 . ASP A 226 ? 0.6681 0.8878 0.7858 -0.1240 -0.1838 0.0564 226 ASP A OD2 1735 N N . GLN A 227 ? 0.6504 0.7495 0.6481 -0.0866 -0.1307 0.0741 227 GLN A N 1736 C CA . GLN A 227 ? 0.6551 0.7282 0.6371 -0.0939 -0.1112 0.0736 227 GLN A CA 1737 C C . GLN A 227 ? 0.6432 0.6939 0.6014 -0.0785 -0.0978 0.0781 227 GLN A C 1738 O O . GLN A 227 ? 0.6475 0.6769 0.5773 -0.0725 -0.1025 0.0772 227 GLN A O 1739 C CB . GLN A 227 ? 0.6808 0.7285 0.6400 -0.1109 -0.1164 0.0655 227 GLN A CB 1740 C CG . GLN A 227 ? 0.6955 0.7217 0.6528 -0.1227 -0.0989 0.0644 227 GLN A CG 1741 C CD . GLN A 227 ? 0.7058 0.7552 0.7004 -0.1389 -0.0956 0.0639 227 GLN A CD 1742 O OE1 . GLN A 227 ? 0.7183 0.7840 0.7290 -0.1531 -0.1104 0.0559 227 GLN A OE1 1743 N NE2 . GLN A 227 ? 0.6962 0.7485 0.7042 -0.1376 -0.0762 0.0723 227 GLN A NE2 1744 N N . GLU A 228 ? 0.6322 0.6894 0.6018 -0.0730 -0.0810 0.0826 228 GLU A N 1745 C CA . GLU A 228 ? 0.6232 0.6619 0.5722 -0.0599 -0.0684 0.0855 228 GLU A CA 1746 C C . GLU A 228 ? 0.6387 0.6423 0.5605 -0.0668 -0.0615 0.0840 228 GLU A C 1747 O O . GLU A 228 ? 0.6533 0.6490 0.5794 -0.0798 -0.0550 0.0847 228 GLU A O 1748 C CB . GLU A 228 ? 0.6124 0.6698 0.5782 -0.0531 -0.0532 0.0905 228 GLU A CB 1749 C CG . GLU A 228 ? 0.6048 0.6989 0.6015 -0.0447 -0.0566 0.0898 228 GLU A CG 1750 C CD . GLU A 228 ? 0.6083 0.7214 0.6171 -0.0385 -0.0390 0.0930 228 GLU A CD 1751 O OE1 . GLU A 228 ? 0.6002 0.7472 0.6397 -0.0350 -0.0379 0.0912 228 GLU A OE1 1752 O OE2 . GLU A 228 ? 0.6202 0.7156 0.6073 -0.0364 -0.0262 0.0971 228 GLU A OE2 1753 N N . GLN A 229 ? 0.6375 0.6200 0.5340 -0.0584 -0.0622 0.0816 229 GLN A N 1754 C CA . GLN A 229 ? 0.6523 0.6030 0.5254 -0.0621 -0.0556 0.0784 229 GLN A CA 1755 C C . GLN A 229 ? 0.6524 0.5952 0.5242 -0.0548 -0.0407 0.0844 229 GLN A C 1756 O O . GLN A 229 ? 0.6375 0.5873 0.5072 -0.0404 -0.0364 0.0870 229 GLN A O 1757 C CB . GLN A 229 ? 0.6516 0.5866 0.5011 -0.0559 -0.0597 0.0732 229 GLN A CB 1758 C CG . GLN A 229 ? 0.6584 0.5981 0.5014 -0.0621 -0.0747 0.0698 229 GLN A CG 1759 C CD . GLN A 229 ? 0.6824 0.6175 0.5235 -0.0793 -0.0822 0.0636 229 GLN A CD 1760 O OE1 . GLN A 229 ? 0.6821 0.6383 0.5440 -0.0867 -0.0911 0.0647 229 GLN A OE1 1761 N NE2 . GLN A 229 ? 0.7001 0.6090 0.5183 -0.0858 -0.0785 0.0553 229 GLN A NE2 1762 N N . GLN A 230 ? 0.6748 0.6017 0.5469 -0.0650 -0.0337 0.0866 230 GLN A N 1763 C CA . GLN A 230 ? 0.6827 0.6013 0.5527 -0.0593 -0.0201 0.0961 230 GLN A CA 1764 C C . GLN A 230 ? 0.6836 0.5807 0.5330 -0.0451 -0.0160 0.0954 230 GLN A C 1765 O O . GLN A 230 ? 0.6890 0.5813 0.5334 -0.0360 -0.0075 0.1041 230 GLN A O 1766 C CB . GLN A 230 ? 0.7100 0.6142 0.5878 -0.0757 -0.0136 0.1005 230 GLN A CB 1767 C CG . GLN A 230 ? 0.7148 0.6470 0.6200 -0.0900 -0.0149 0.1022 230 GLN A CG 1768 C CD . GLN A 230 ? 0.7073 0.6724 0.6259 -0.0806 -0.0082 0.1102 230 GLN A CD 1769 O OE1 . GLN A 230 ? 0.6845 0.6776 0.6157 -0.0746 -0.0161 0.1057 230 GLN A OE1 1770 N NE2 . GLN A 230 ? 0.7241 0.6845 0.6385 -0.0784 0.0066 0.1222 230 GLN A NE2 1771 N N . GLY A 231 ? 0.6806 0.5671 0.5183 -0.0430 -0.0222 0.0854 231 GLY A N 1772 C CA . GLY A 231 ? 0.6799 0.5518 0.5034 -0.0298 -0.0187 0.0822 231 GLY A CA 1773 C C . GLY A 231 ? 0.6568 0.5485 0.4812 -0.0156 -0.0205 0.0816 231 GLY A C 1774 O O . GLY A 231 ? 0.6560 0.5414 0.4733 -0.0045 -0.0181 0.0783 231 GLY A O 1775 N N . THR A 232 ? 0.6414 0.5573 0.4774 -0.0160 -0.0250 0.0835 232 THR A N 1776 C CA . THR A 232 ? 0.6241 0.5571 0.4636 -0.0038 -0.0270 0.0812 232 THR A CA 1777 C C . THR A 232 ? 0.6262 0.5639 0.4630 0.0093 -0.0206 0.0847 232 THR A C 1778 O O . THR A 232 ? 0.6372 0.5800 0.4757 0.0094 -0.0151 0.0929 232 THR A O 1779 C CB . THR A 232 ? 0.6110 0.5678 0.4668 -0.0052 -0.0324 0.0825 232 THR A CB 1780 O OG1 . THR A 232 ? 0.6154 0.5699 0.4729 -0.0165 -0.0412 0.0806 232 THR A OG1 1781 C CG2 . THR A 232 ? 0.5934 0.5625 0.4534 0.0068 -0.0346 0.0782 232 THR A CG2 1782 N N . HIS A 233 ? 0.6222 0.5594 0.4544 0.0197 -0.0213 0.0785 233 HIS A N 1783 C CA . HIS A 233 ? 0.6248 0.5700 0.4537 0.0334 -0.0185 0.0800 233 HIS A CA 1784 C C . HIS A 233 ? 0.6109 0.5771 0.4471 0.0421 -0.0217 0.0728 233 HIS A C 1785 O O . HIS A 233 ? 0.6022 0.5680 0.4423 0.0432 -0.0251 0.0640 233 HIS A O 1786 C CB . HIS A 233 ? 0.6343 0.5633 0.4551 0.0402 -0.0171 0.0776 233 HIS A CB 1787 C CG . HIS A 233 ? 0.6359 0.5762 0.4537 0.0558 -0.0179 0.0778 233 HIS A CG 1788 N ND1 . HIS A 233 ? 0.6271 0.5783 0.4507 0.0642 -0.0217 0.0669 233 HIS A ND1 1789 C CD2 . HIS A 233 ? 0.6448 0.5886 0.4537 0.0641 -0.0159 0.0877 233 HIS A CD2 1790 C CE1 . HIS A 233 ? 0.6300 0.5926 0.4492 0.0775 -0.0239 0.0685 233 HIS A CE1 1791 N NE2 . HIS A 233 ? 0.6427 0.6003 0.4504 0.0784 -0.0205 0.0819 233 HIS A NE2 1792 N N . ARG A 234 ? 0.6133 0.5972 0.4515 0.0473 -0.0195 0.0759 234 ARG A N 1793 C CA . ARG A 234 ? 0.6065 0.6100 0.4501 0.0572 -0.0218 0.0671 234 ARG A CA 1794 C C . ARG A 234 ? 0.6097 0.6141 0.4458 0.0682 -0.0241 0.0615 234 ARG A C 1795 O O . ARG A 234 ? 0.6251 0.6245 0.4486 0.0736 -0.0222 0.0690 234 ARG A O 1796 C CB . ARG A 234 ? 0.6147 0.6373 0.4577 0.0610 -0.0166 0.0712 234 ARG A CB 1797 C CG . ARG A 234 ? 0.6161 0.6530 0.4764 0.0572 -0.0165 0.0680 234 ARG A CG 1798 C CD . ARG A 234 ? 0.6417 0.6985 0.5006 0.0600 -0.0076 0.0727 234 ARG A CD 1799 N NE . ARG A 234 ? 0.6397 0.7174 0.5172 0.0633 -0.0071 0.0640 234 ARG A NE 1800 C CZ . ARG A 234 ? 0.6458 0.7422 0.5222 0.0743 -0.0039 0.0543 234 ARG A CZ 1801 N NH1 . ARG A 234 ? 0.6550 0.7542 0.5102 0.0825 -0.0022 0.0526 234 ARG A NH1 1802 N NH2 . ARG A 234 ? 0.6406 0.7537 0.5373 0.0778 -0.0032 0.0453 234 ARG A NH2 1803 N N . GLY A 235 ? 0.5991 0.6100 0.4446 0.0714 -0.0287 0.0488 235 GLY A N 1804 C CA . GLY A 235 ? 0.5992 0.6189 0.4433 0.0820 -0.0325 0.0402 235 GLY A CA 1805 C C . GLY A 235 ? 0.6031 0.6445 0.4435 0.0916 -0.0340 0.0347 235 GLY A C 1806 O O . GLY A 235 ? 0.6064 0.6551 0.4450 0.0904 -0.0299 0.0384 235 GLY A O 1807 N N . ASP A 236 ? 0.6059 0.6599 0.4457 0.1013 -0.0399 0.0244 236 ASP A N 1808 C CA . ASP A 236 ? 0.6108 0.6869 0.4446 0.1107 -0.0427 0.0151 236 ASP A CA 1809 C C . ASP A 236 ? 0.5962 0.6788 0.4481 0.1073 -0.0437 -0.0008 236 ASP A C 1810 O O . ASP A 236 ? 0.5833 0.6550 0.4524 0.0996 -0.0449 -0.0062 236 ASP A O 1811 C CB . ASP A 236 ? 0.6232 0.7124 0.4513 0.1222 -0.0516 0.0078 236 ASP A CB 1812 C CG . ASP A 236 ? 0.6439 0.7227 0.4574 0.1279 -0.0522 0.0239 236 ASP A CG 1813 O OD1 . ASP A 236 ? 0.6655 0.7371 0.4599 0.1287 -0.0464 0.0405 236 ASP A OD1 1814 O OD2 . ASP A 236 ? 0.6478 0.7254 0.4710 0.1316 -0.0578 0.0196 236 ASP A OD2 1815 N N . PHE A 237 ? 0.6015 0.7004 0.4484 0.1131 -0.0423 -0.0081 237 PHE A N 1816 C CA . PHE A 237 ? 0.5941 0.6991 0.4586 0.1130 -0.0441 -0.0266 237 PHE A CA 1817 C C . PHE A 237 ? 0.5932 0.7062 0.4659 0.1162 -0.0531 -0.0450 237 PHE A C 1818 O O . PHE A 237 ? 0.6038 0.7329 0.4623 0.1249 -0.0587 -0.0494 237 PHE A O 1819 C CB . PHE A 237 ? 0.6069 0.7295 0.4633 0.1201 -0.0391 -0.0324 237 PHE A CB 1820 C CG . PHE A 237 ? 0.6058 0.7257 0.4635 0.1158 -0.0297 -0.0181 237 PHE A CG 1821 C CD1 . PHE A 237 ? 0.5987 0.7121 0.4793 0.1117 -0.0282 -0.0216 237 PHE A CD1 1822 C CD2 . PHE A 237 ? 0.6199 0.7441 0.4575 0.1160 -0.0226 -0.0011 237 PHE A CD2 1823 C CE1 . PHE A 237 ? 0.5979 0.7139 0.4843 0.1082 -0.0211 -0.0099 237 PHE A CE1 1824 C CE2 . PHE A 237 ? 0.6190 0.7440 0.4624 0.1102 -0.0136 0.0105 237 PHE A CE2 1825 C CZ . PHE A 237 ? 0.6072 0.7305 0.4764 0.1065 -0.0134 0.0052 237 PHE A CZ 1826 N N . LEU A 238 ? 0.5802 0.6822 0.4762 0.1085 -0.0548 -0.0550 238 LEU A N 1827 C CA . LEU A 238 ? 0.5794 0.6888 0.4902 0.1078 -0.0621 -0.0736 238 LEU A CA 1828 C C . LEU A 238 ? 0.5833 0.6919 0.5119 0.1063 -0.0631 -0.0932 238 LEU A C 1829 O O . LEU A 238 ? 0.5807 0.6717 0.5201 0.1011 -0.0583 -0.0889 238 LEU A O 1830 C CB . LEU A 238 ? 0.5696 0.6646 0.4942 0.0978 -0.0612 -0.0681 238 LEU A CB 1831 C CG . LEU A 238 ? 0.5660 0.6556 0.4774 0.0984 -0.0589 -0.0501 238 LEU A CG 1832 C CD1 . LEU A 238 ? 0.5574 0.6331 0.4838 0.0875 -0.0555 -0.0482 238 LEU A CD1 1833 C CD2 . LEU A 238 ? 0.5775 0.6870 0.4758 0.1108 -0.0659 -0.0514 238 LEU A CD2 1834 N N . PRO A 239 ? 0.5929 0.7199 0.5252 0.1113 -0.0704 -0.1156 239 PRO A N 1835 C CA . PRO A 239 ? 0.6012 0.7264 0.5492 0.1110 -0.0710 -0.1370 239 PRO A CA 1836 C C . PRO A 239 ? 0.5979 0.7022 0.5764 0.0983 -0.0710 -0.1448 239 PRO A C 1837 O O . PRO A 239 ? 0.5914 0.6936 0.5804 0.0900 -0.0725 -0.1425 239 PRO A O 1838 C CB . PRO A 239 ? 0.6168 0.7702 0.5553 0.1198 -0.0802 -0.1591 239 PRO A CB 1839 C CG . PRO A 239 ? 0.6127 0.7782 0.5464 0.1202 -0.0871 -0.1525 239 PRO A CG 1840 C CD . PRO A 239 ? 0.5997 0.7500 0.5226 0.1181 -0.0797 -0.1231 239 PRO A CD 1841 N N . ASN A 240 ? 0.6059 0.6944 0.5990 0.0971 -0.0681 -0.1534 240 ASN A N 1842 C CA . ASN A 240 ? 0.6134 0.6809 0.6350 0.0859 -0.0684 -0.1647 240 ASN A CA 1843 C C . ASN A 240 ? 0.6340 0.7131 0.6680 0.0889 -0.0744 -0.1972 240 ASN A C 1844 O O . ASN A 240 ? 0.6422 0.7413 0.6606 0.1011 -0.0766 -0.2095 240 ASN A O 1845 C CB . ASN A 240 ? 0.6156 0.6521 0.6467 0.0831 -0.0625 -0.1511 240 ASN A CB 1846 C CG . ASN A 240 ? 0.5997 0.6236 0.6194 0.0777 -0.0581 -0.1217 240 ASN A CG 1847 O OD1 . ASN A 240 ? 0.5946 0.6163 0.6137 0.0682 -0.0570 -0.1138 240 ASN A OD1 1848 N ND2 . ASN A 240 ? 0.5959 0.6131 0.6082 0.0835 -0.0556 -0.1070 240 ASN A ND2 1849 N N . ALA A 241 ? 0.6451 0.7114 0.7064 0.0767 -0.0762 -0.2117 241 ALA A N 1850 C CA . ALA A 241 ? 0.6676 0.7440 0.7448 0.0764 -0.0830 -0.2457 241 ALA A CA 1851 C C . ALA A 241 ? 0.6888 0.7522 0.7699 0.0850 -0.0808 -0.2610 241 ALA A C 1852 O O . ALA A 241 ? 0.7087 0.7874 0.7915 0.0901 -0.0865 -0.2910 241 ALA A O 1853 C CB . ALA A 241 ? 0.6752 0.7386 0.7850 0.0584 -0.0836 -0.2561 241 ALA A CB 1854 N N . ASP A 242 ? 0.6874 0.7242 0.7704 0.0874 -0.0733 -0.2418 242 ASP A N 1855 C CA . ASP A 242 ? 0.7086 0.7319 0.8000 0.0976 -0.0704 -0.2545 242 ASP A CA 1856 C C . ASP A 242 ? 0.7036 0.7512 0.7697 0.1144 -0.0669 -0.2500 242 ASP A C 1857 O O . ASP A 242 ? 0.7150 0.7538 0.7882 0.1244 -0.0621 -0.2537 242 ASP A O 1858 C CB . ASP A 242 ? 0.7153 0.6960 0.8274 0.0923 -0.0657 -0.2375 242 ASP A CB 1859 C CG . ASP A 242 ? 0.6938 0.6692 0.7908 0.0930 -0.0619 -0.2013 242 ASP A CG 1860 O OD1 . ASP A 242 ? 0.6996 0.6488 0.8065 0.0960 -0.0597 -0.1874 242 ASP A OD1 1861 O OD2 . ASP A 242 ? 0.6751 0.6718 0.7510 0.0910 -0.0621 -0.1874 242 ASP A OD2 1862 N N . GLU A 243 ? 0.6902 0.7679 0.7284 0.1174 -0.0686 -0.2415 243 GLU A N 1863 C CA . GLU A 243 ? 0.6877 0.7912 0.6980 0.1308 -0.0639 -0.2357 243 GLU A CA 1864 C C . GLU A 243 ? 0.6708 0.7653 0.6774 0.1328 -0.0561 -0.2054 243 GLU A C 1865 O O . GLU A 243 ? 0.6719 0.7836 0.6647 0.1429 -0.0494 -0.2019 243 GLU A O 1866 C CB . GLU A 243 ? 0.7154 0.8322 0.7244 0.1427 -0.0619 -0.2659 243 GLU A CB 1867 C CG . GLU A 243 ? 0.7343 0.8655 0.7424 0.1413 -0.0712 -0.2991 243 GLU A CG 1868 C CD . GLU A 243 ? 0.7610 0.9023 0.7678 0.1526 -0.0685 -0.3321 243 GLU A CD 1869 O OE1 . GLU A 243 ? 0.7633 0.8857 0.7897 0.1581 -0.0607 -0.3359 243 GLU A OE1 1870 O OE2 . GLU A 243 ? 0.7813 0.9500 0.7673 0.1568 -0.0747 -0.3550 243 GLU A OE2 1871 N N . THR A 244 ? 0.6575 0.7270 0.6763 0.1224 -0.0567 -0.1845 244 THR A N 1872 C CA . THR A 244 ? 0.6431 0.7059 0.6563 0.1222 -0.0521 -0.1555 244 THR A CA 1873 C C . THR A 244 ? 0.6265 0.6992 0.6176 0.1162 -0.0527 -0.1357 244 THR A C 1874 O O . THR A 244 ? 0.6277 0.7119 0.6104 0.1136 -0.0571 -0.1435 244 THR A O 1875 C CB . THR A 244 ? 0.6448 0.6731 0.6804 0.1157 -0.0528 -0.1432 244 THR A CB 1876 O OG1 . THR A 244 ? 0.6512 0.6608 0.6959 0.1027 -0.0563 -0.1453 244 THR A OG1 1877 C CG2 . THR A 244 ? 0.6632 0.6801 0.7213 0.1255 -0.0517 -0.1579 244 THR A CG2 1878 N N . TRP A 245 ? 0.6158 0.6842 0.5998 0.1144 -0.0491 -0.1113 245 TRP A N 1879 C CA . TRP A 245 ? 0.6044 0.6808 0.5670 0.1104 -0.0484 -0.0935 245 TRP A CA 1880 C C . TRP A 245 ? 0.5932 0.6477 0.5582 0.0990 -0.0490 -0.0733 245 TRP A C 1881 O O . TRP A 245 ? 0.5939 0.6291 0.5716 0.0954 -0.0491 -0.0655 245 TRP A O 1882 C CB . TRP A 245 ? 0.6041 0.7005 0.5488 0.1177 -0.0424 -0.0842 245 TRP A CB 1883 C CG . TRP A 245 ? 0.6219 0.7429 0.5540 0.1280 -0.0409 -0.1023 245 TRP A CG 1884 C CD1 . TRP A 245 ? 0.6383 0.7716 0.5756 0.1370 -0.0358 -0.1170 245 TRP A CD1 1885 C CD2 . TRP A 245 ? 0.6343 0.7716 0.5451 0.1312 -0.0452 -0.1089 245 TRP A CD2 1886 N NE1 . TRP A 245 ? 0.6616 0.8178 0.5784 0.1446 -0.0357 -0.1327 245 TRP A NE1 1887 C CE2 . TRP A 245 ? 0.6565 0.8156 0.5562 0.1415 -0.0427 -0.1272 245 TRP A CE2 1888 C CE3 . TRP A 245 ? 0.6313 0.7683 0.5319 0.1276 -0.0514 -0.1016 245 TRP A CE3 1889 C CZ2 . TRP A 245 ? 0.6729 0.8531 0.5477 0.1478 -0.0478 -0.1370 245 TRP A CZ2 1890 C CZ3 . TRP A 245 ? 0.6452 0.8034 0.5256 0.1351 -0.0571 -0.1109 245 TRP A CZ3 1891 C CH2 . TRP A 245 ? 0.6671 0.8465 0.5330 0.1449 -0.0560 -0.1278 245 TRP A CH2 1892 N N . TYR A 246 ? 0.5875 0.6454 0.5389 0.0946 -0.0497 -0.0656 246 TYR A N 1893 C CA . TYR A 246 ? 0.5831 0.6233 0.5322 0.0842 -0.0487 -0.0487 246 TYR A CA 1894 C C . TYR A 246 ? 0.5775 0.6249 0.5062 0.0851 -0.0462 -0.0333 246 TYR A C 1895 O O . TYR A 246 ? 0.5808 0.6455 0.4966 0.0922 -0.0465 -0.0361 246 TYR A O 1896 C CB . TYR A 246 ? 0.5842 0.6185 0.5425 0.0766 -0.0504 -0.0569 246 TYR A CB 1897 C CG . TYR A 246 ? 0.5863 0.6056 0.5393 0.0662 -0.0472 -0.0418 246 TYR A CG 1898 C CD1 . TYR A 246 ? 0.6019 0.5974 0.5594 0.0569 -0.0452 -0.0318 246 TYR A CD1 1899 C CD2 . TYR A 246 ? 0.5868 0.6150 0.5290 0.0667 -0.0463 -0.0378 246 TYR A CD2 1900 C CE1 . TYR A 246 ? 0.6052 0.5881 0.5538 0.0471 -0.0413 -0.0195 246 TYR A CE1 1901 C CE2 . TYR A 246 ? 0.5930 0.6079 0.5304 0.0578 -0.0420 -0.0269 246 TYR A CE2 1902 C CZ . TYR A 246 ? 0.6015 0.5947 0.5407 0.0475 -0.0390 -0.0185 246 TYR A CZ 1903 O OH . TYR A 246 ? 0.6184 0.5994 0.5488 0.0384 -0.0339 -0.0091 246 TYR A OH 1904 N N . LEU A 247 ? 0.5731 0.6059 0.4982 0.0778 -0.0443 -0.0168 247 LEU A N 1905 C CA . LEU A 247 ? 0.5714 0.6054 0.4798 0.0764 -0.0416 -0.0024 247 LEU A CA 1906 C C . LEU A 247 ? 0.5704 0.5842 0.4763 0.0653 -0.0412 0.0094 247 LEU A C 1907 O O . LEU A 247 ? 0.5728 0.5743 0.4868 0.0602 -0.0432 0.0122 247 LEU A O 1908 C CB . LEU A 247 ? 0.5741 0.6200 0.4792 0.0809 -0.0385 0.0036 247 LEU A CB 1909 C CG . LEU A 247 ? 0.5787 0.6257 0.4686 0.0783 -0.0344 0.0185 247 LEU A CG 1910 C CD1 . LEU A 247 ? 0.5877 0.6505 0.4627 0.0871 -0.0315 0.0171 247 LEU A CD1 1911 C CD2 . LEU A 247 ? 0.5855 0.6355 0.4827 0.0744 -0.0321 0.0273 247 LEU A CD2 1912 N N . GLN A 248 ? 0.5697 0.5791 0.4630 0.0623 -0.0389 0.0163 248 GLN A N 1913 C CA . GLN A 248 ? 0.5718 0.5634 0.4583 0.0519 -0.0378 0.0262 248 GLN A CA 1914 C C . GLN A 248 ? 0.5758 0.5655 0.4502 0.0499 -0.0358 0.0371 248 GLN A C 1915 O O . GLN A 248 ? 0.5770 0.5740 0.4446 0.0561 -0.0335 0.0384 248 GLN A O 1916 C CB . GLN A 248 ? 0.5739 0.5565 0.4599 0.0469 -0.0352 0.0215 248 GLN A CB 1917 C CG . GLN A 248 ? 0.5735 0.5643 0.4563 0.0532 -0.0333 0.0173 248 GLN A CG 1918 C CD . GLN A 248 ? 0.5760 0.5608 0.4627 0.0479 -0.0292 0.0120 248 GLN A CD 1919 O OE1 . GLN A 248 ? 0.5842 0.5650 0.4642 0.0489 -0.0260 0.0139 248 GLN A OE1 1920 N NE2 . GLN A 248 ? 0.5702 0.5536 0.4690 0.0420 -0.0280 0.0050 248 GLN A NE2 1921 N N . ALA A 249 ? 0.5799 0.5590 0.4513 0.0410 -0.0373 0.0451 249 ALA A N 1922 C CA . ALA A 249 ? 0.5862 0.5605 0.4484 0.0356 -0.0357 0.0538 249 ALA A CA 1923 C C . ALA A 249 ? 0.5966 0.5519 0.4470 0.0262 -0.0350 0.0550 249 ALA A C 1924 O O . ALA A 249 ? 0.6015 0.5485 0.4493 0.0191 -0.0384 0.0561 249 ALA A O 1925 C CB . ALA A 249 ? 0.5846 0.5672 0.4551 0.0324 -0.0391 0.0597 249 ALA A CB 1926 N N . THR A 250 ? 0.6046 0.5524 0.4465 0.0272 -0.0303 0.0547 250 THR A N 1927 C CA . THR A 250 ? 0.6178 0.5483 0.4487 0.0199 -0.0275 0.0525 250 THR A CA 1928 C C . THR A 250 ? 0.6307 0.5493 0.4528 0.0109 -0.0279 0.0576 250 THR A C 1929 O O . THR A 250 ? 0.6334 0.5560 0.4590 0.0114 -0.0279 0.0637 250 THR A O 1930 C CB . THR A 250 ? 0.6206 0.5490 0.4516 0.0278 -0.0220 0.0460 250 THR A CB 1931 O OG1 . THR A 250 ? 0.6247 0.5559 0.4556 0.0365 -0.0213 0.0506 250 THR A OG1 1932 C CG2 . THR A 250 ? 0.6094 0.5505 0.4517 0.0333 -0.0220 0.0380 250 THR A CG2 1933 N N . LEU A 251 ? 0.6445 0.5488 0.4546 0.0015 -0.0276 0.0545 251 LEU A N 1934 C CA . LEU A 251 ? 0.6609 0.5520 0.4618 -0.0086 -0.0286 0.0554 251 LEU A CA 1935 C C . LEU A 251 ? 0.6804 0.5535 0.4663 -0.0130 -0.0230 0.0467 251 LEU A C 1936 O O . LEU A 251 ? 0.6835 0.5555 0.4608 -0.0156 -0.0215 0.0424 251 LEU A O 1937 C CB . LEU A 251 ? 0.6630 0.5601 0.4638 -0.0183 -0.0381 0.0597 251 LEU A CB 1938 C CG . LEU A 251 ? 0.6789 0.5662 0.4723 -0.0313 -0.0419 0.0585 251 LEU A CG 1939 C CD1 . LEU A 251 ? 0.6720 0.5631 0.4793 -0.0327 -0.0401 0.0636 251 LEU A CD1 1940 C CD2 . LEU A 251 ? 0.6784 0.5723 0.4672 -0.0396 -0.0538 0.0604 251 LEU A CD2 1941 N N . ASP A 252 ? 0.6969 0.5550 0.4799 -0.0138 -0.0188 0.0441 252 ASP A N 1942 C CA . ASP A 252 ? 0.7199 0.5600 0.4903 -0.0166 -0.0122 0.0332 252 ASP A CA 1943 C C . ASP A 252 ? 0.7433 0.5720 0.4981 -0.0321 -0.0167 0.0289 252 ASP A C 1944 O O . ASP A 252 ? 0.7493 0.5748 0.5078 -0.0395 -0.0221 0.0326 252 ASP A O 1945 C CB . ASP A 252 ? 0.7288 0.5552 0.5056 -0.0074 -0.0058 0.0316 252 ASP A CB 1946 C CG . ASP A 252 ? 0.7528 0.5613 0.5207 -0.0074 0.0023 0.0179 252 ASP A CG 1947 O OD1 . ASP A 252 ? 0.7727 0.5628 0.5292 -0.0181 0.0025 0.0114 252 ASP A OD1 1948 O OD2 . ASP A 252 ? 0.7486 0.5632 0.5228 0.0031 0.0087 0.0119 252 ASP A OD2 1949 N N . VAL A 253 ? 0.7602 0.5843 0.4970 -0.0378 -0.0143 0.0205 253 VAL A N 1950 C CA . VAL A 253 ? 0.7890 0.6040 0.5051 -0.0523 -0.0199 0.0146 253 VAL A CA 1951 C C . VAL A 253 ? 0.8203 0.6195 0.5164 -0.0552 -0.0096 -0.0007 253 VAL A C 1952 O O . VAL A 253 ? 0.8175 0.6188 0.5153 -0.0472 0.0014 -0.0051 253 VAL A O 1953 C CB . VAL A 253 ? 0.7843 0.6127 0.4905 -0.0585 -0.0307 0.0224 253 VAL A CB 1954 C CG1 . VAL A 253 ? 0.7639 0.6077 0.4900 -0.0579 -0.0421 0.0341 253 VAL A CG1 1955 C CG2 . VAL A 253 ? 0.7756 0.6108 0.4785 -0.0526 -0.0245 0.0254 253 VAL A CG2 1956 N N . GLU A 254 ? 0.8548 0.6402 0.5336 -0.0671 -0.0129 -0.0107 254 GLU A N 1957 C CA . GLU A 254 ? 0.8920 0.6637 0.5466 -0.0715 -0.0034 -0.0277 254 GLU A CA 1958 C C . GLU A 254 ? 0.9047 0.6860 0.5318 -0.0789 -0.0061 -0.0254 254 GLU A C 1959 O O . GLU A 254 ? 0.9028 0.6940 0.5239 -0.0854 -0.0207 -0.0146 254 GLU A O 1960 C CB . GLU A 254 ? 0.9236 0.6751 0.5690 -0.0818 -0.0062 -0.0419 254 GLU A CB 1961 C CG . GLU A 254 ? 0.9317 0.6669 0.6022 -0.0752 -0.0020 -0.0427 254 GLU A CG 1962 C CD . GLU A 254 ? 0.9846 0.6915 0.6460 -0.0807 0.0040 -0.0631 254 GLU A CD 1963 O OE1 . GLU A 254 ? 0.9916 0.6807 0.6695 -0.0821 0.0027 -0.0627 254 GLU A OE1 1964 O OE2 . GLU A 254 ? 1.0154 0.7165 0.6529 -0.0837 0.0112 -0.0799 254 GLU A OE2 1965 N N . ALA A 255 ? 0.9222 0.7012 0.5339 -0.0773 0.0084 -0.0344 255 ALA A N 1966 C CA . ALA A 255 ? 0.9420 0.7271 0.5235 -0.0850 0.0094 -0.0306 255 ALA A CA 1967 C C . ALA A 255 ? 0.9735 0.7546 0.5237 -0.0986 -0.0059 -0.0315 255 ALA A C 1968 O O . ALA A 255 ? 1.0023 0.7710 0.5369 -0.1058 -0.0062 -0.0482 255 ALA A O 1969 C CB . ALA A 255 ? 0.9629 0.7446 0.5303 -0.0840 0.0306 -0.0446 255 ALA A CB 1970 N N . GLY A 256 ? 0.9696 0.7615 0.5129 -0.1015 -0.0201 -0.0142 256 GLY A N 1971 C CA . GLY A 256 ? 0.9979 0.7909 0.5144 -0.1126 -0.0390 -0.0124 256 GLY A CA 1972 C C . GLY A 256 ? 0.9748 0.7794 0.5180 -0.1121 -0.0592 -0.0020 256 GLY A C 1973 O O . GLY A 256 ? 0.9938 0.8061 0.5223 -0.1186 -0.0780 0.0040 256 GLY A O 1974 N N . GLU A 257 ? 0.9375 0.7452 0.5199 -0.1041 -0.0555 0.0001 257 GLU A N 1975 C CA . GLU A 257 ? 0.9131 0.7341 0.5244 -0.1038 -0.0707 0.0089 257 GLU A CA 1976 C C . GLU A 257 ? 0.8783 0.7148 0.5115 -0.0931 -0.0745 0.0273 257 GLU A C 1977 O O . GLU A 257 ? 0.8543 0.7040 0.5171 -0.0897 -0.0821 0.0342 257 GLU A O 1978 C CB . GLU A 257 ? 0.9019 0.7155 0.5395 -0.1032 -0.0643 0.0008 257 GLU A CB 1979 N N . GLU A 258 ? 0.8773 0.7119 0.4964 -0.0886 -0.0681 0.0342 258 GLU A N 1980 C CA . GLU A 258 ? 0.8493 0.6943 0.4879 -0.0788 -0.0707 0.0496 258 GLU A CA 1981 C C . GLU A 258 ? 0.8537 0.7096 0.4916 -0.0797 -0.0915 0.0621 258 GLU A C 1982 O O . GLU A 258 ? 0.8278 0.6971 0.4953 -0.0716 -0.0983 0.0708 258 GLU A O 1983 C CB . GLU A 258 ? 0.8550 0.6922 0.4804 -0.0761 -0.0568 0.0525 258 GLU A CB 1984 C CG . GLU A 258 ? 0.8450 0.6790 0.4847 -0.0705 -0.0374 0.0421 258 GLU A CG 1985 C CD . GLU A 258 ? 0.8799 0.7021 0.4928 -0.0770 -0.0230 0.0286 258 GLU A CD 1986 O OE1 . GLU A 258 ? 0.9135 0.7283 0.4987 -0.0865 -0.0278 0.0216 258 GLU A OE1 1987 O OE2 . GLU A 258 ? 0.8715 0.6938 0.4926 -0.0725 -0.0066 0.0233 258 GLU A OE2 1988 N N . ALA A 259 ? 0.8877 0.7390 0.4914 -0.0886 -0.1017 0.0624 259 ALA A N 1989 C CA . ALA A 259 ? 0.8986 0.7601 0.4974 -0.0884 -0.1240 0.0751 259 ALA A CA 1990 C C . ALA A 259 ? 0.8779 0.7599 0.5109 -0.0879 -0.1391 0.0735 259 ALA A C 1991 O O . ALA A 259 ? 0.8754 0.7593 0.5171 -0.0954 -0.1369 0.0602 259 ALA A O 1992 C CB . ALA A 259 ? 0.9471 0.8003 0.4976 -0.0988 -0.1326 0.0735 259 ALA A CB 1993 N N . GLY A 260 ? 0.8647 0.7614 0.5189 -0.0792 -0.1533 0.0869 260 GLY A N 1994 C CA . GLY A 260 ? 0.8422 0.7637 0.5342 -0.0778 -0.1663 0.0862 260 GLY A CA 1995 C C . GLY A 260 ? 0.7987 0.7298 0.5316 -0.0678 -0.1543 0.0873 260 GLY A C 1996 O O . GLY A 260 ? 0.7834 0.7374 0.5508 -0.0631 -0.1630 0.0901 260 GLY A O 1997 N N . LEU A 261 ? 0.7800 0.6959 0.5093 -0.0643 -0.1342 0.0843 261 LEU A N 1998 C CA . LEU A 261 ? 0.7408 0.6647 0.5023 -0.0548 -0.1223 0.0842 261 LEU A CA 1999 C C . LEU A 261 ? 0.7252 0.6545 0.5025 -0.0414 -0.1248 0.0943 261 LEU A C 2000 O O . LEU A 261 ? 0.7421 0.6585 0.5004 -0.0392 -0.1280 0.1017 261 LEU A O 2001 C CB . LEU A 261 ? 0.7331 0.6407 0.4853 -0.0551 -0.1025 0.0762 261 LEU A CB 2002 C CG . LEU A 261 ? 0.7373 0.6401 0.4896 -0.0637 -0.0961 0.0657 261 LEU A CG 2003 C CD1 . LEU A 261 ? 0.7377 0.6208 0.4733 -0.0632 -0.0797 0.0579 261 LEU A CD1 2004 C CD2 . LEU A 261 ? 0.7190 0.6373 0.5042 -0.0603 -0.0933 0.0673 261 LEU A CD2 2005 N N . ALA A 262 ? 0.6955 0.6425 0.5068 -0.0328 -0.1223 0.0942 262 ALA A N 2006 C CA . ALA A 262 ? 0.6818 0.6342 0.5125 -0.0191 -0.1234 0.1002 262 ALA A CA 2007 C C . ALA A 262 ? 0.6537 0.6146 0.5063 -0.0113 -0.1089 0.0943 262 ALA A C 2008 O O . ALA A 262 ? 0.6433 0.6153 0.5063 -0.0147 -0.1028 0.0895 262 ALA A O 2009 C CB . ALA A 262 ? 0.6849 0.6569 0.5372 -0.0137 -0.1411 0.1065 262 ALA A CB 2010 N N . CYS A 263 ? 0.6450 0.5997 0.5032 -0.0014 -0.1036 0.0947 263 CYS A N 2011 C CA . CYS A 263 ? 0.6211 0.5871 0.4993 0.0074 -0.0927 0.0882 263 CYS A CA 2012 C C . CYS A 263 ? 0.6136 0.5984 0.5215 0.0189 -0.0989 0.0891 263 CYS A C 2013 O O . CYS A 263 ? 0.6229 0.6006 0.5360 0.0256 -0.1070 0.0936 263 CYS A O 2014 C CB . CYS A 263 ? 0.6172 0.5680 0.4866 0.0107 -0.0825 0.0838 263 CYS A CB 2015 S SG . CYS A 263 ? 0.5984 0.5652 0.4875 0.0219 -0.0717 0.0741 263 CYS A SG 2016 N N . ARG A 264 ? 0.5986 0.6065 0.5262 0.0212 -0.0940 0.0852 264 ARG A N 2017 C CA . ARG A 264 ? 0.5919 0.6234 0.5510 0.0321 -0.0972 0.0836 264 ARG A CA 2018 C C . ARG A 264 ? 0.5776 0.6186 0.5470 0.0419 -0.0839 0.0747 264 ARG A C 2019 O O . ARG A 264 ? 0.5720 0.6167 0.5325 0.0382 -0.0727 0.0718 264 ARG A O 2020 C CB . ARG A 264 ? 0.5916 0.6478 0.5679 0.0256 -0.1014 0.0854 264 ARG A CB 2021 C CG . ARG A 264 ? 0.5946 0.6794 0.6078 0.0367 -0.1061 0.0837 264 ARG A CG 2022 C CD . ARG A 264 ? 0.6142 0.7215 0.6448 0.0281 -0.1163 0.0869 264 ARG A CD 2023 N NE . ARG A 264 ? 0.6274 0.7563 0.6909 0.0401 -0.1293 0.0878 264 ARG A NE 2024 C CZ . ARG A 264 ? 0.6467 0.7866 0.7204 0.0370 -0.1482 0.0930 264 ARG A CZ 2025 N NH1 . ARG A 264 ? 0.6574 0.7878 0.7082 0.0207 -0.1559 0.0962 264 ARG A NH1 2026 N NH2 . ARG A 264 ? 0.6582 0.8189 0.7651 0.0510 -0.1605 0.0938 264 ARG A NH2 2027 N N . VAL A 265 ? 0.5777 0.6214 0.5646 0.0549 -0.0860 0.0703 265 VAL A N 2028 C CA . VAL A 265 ? 0.5672 0.6200 0.5626 0.0651 -0.0748 0.0589 265 VAL A CA 2029 C C . VAL A 265 ? 0.5673 0.6469 0.5953 0.0770 -0.0746 0.0533 265 VAL A C 2030 O O . VAL A 265 ? 0.5771 0.6561 0.6240 0.0843 -0.0856 0.0558 265 VAL A O 2031 C CB . VAL A 265 ? 0.5719 0.6011 0.5593 0.0698 -0.0747 0.0534 265 VAL A CB 2032 C CG1 . VAL A 265 ? 0.5646 0.6053 0.5607 0.0802 -0.0651 0.0386 265 VAL A CG1 2033 C CG2 . VAL A 265 ? 0.5711 0.5787 0.5304 0.0584 -0.0727 0.0573 265 VAL A CG2 2034 N N . LYS A 266 ? 0.5586 0.6616 0.5923 0.0795 -0.0617 0.0463 266 LYS A N 2035 C CA . LYS A 266 ? 0.5573 0.6894 0.6212 0.0912 -0.0568 0.0379 266 LYS A CA 2036 C C . LYS A 266 ? 0.5572 0.6927 0.6178 0.1020 -0.0457 0.0228 266 LYS A C 2037 O O . LYS A 266 ? 0.5532 0.6864 0.5897 0.0980 -0.0367 0.0206 266 LYS A O 2038 C CB . LYS A 266 ? 0.5535 0.7155 0.6281 0.0835 -0.0489 0.0421 266 LYS A CB 2039 C CG . LYS A 266 ? 0.5567 0.7230 0.6422 0.0730 -0.0610 0.0531 266 LYS A CG 2040 C CD . LYS A 266 ? 0.5620 0.7580 0.6610 0.0628 -0.0508 0.0557 266 LYS A CD 2041 C CE . LYS A 266 ? 0.5659 0.7622 0.6691 0.0478 -0.0628 0.0650 266 LYS A CE 2042 N NZ . LYS A 266 ? 0.5665 0.7805 0.7026 0.0542 -0.0796 0.0652 266 LYS A NZ 2043 N N . HIS A 267 ? 0.5631 0.7033 0.6478 0.1166 -0.0476 0.0116 267 HIS A N 2044 C CA . HIS A 267 ? 0.5671 0.7116 0.6511 0.1276 -0.0381 -0.0066 267 HIS A CA 2045 C C . HIS A 267 ? 0.5766 0.7428 0.6958 0.1438 -0.0349 -0.0199 267 HIS A C 2046 O O . HIS A 267 ? 0.5796 0.7473 0.7263 0.1494 -0.0449 -0.0148 267 HIS A O 2047 C CB . HIS A 267 ? 0.5712 0.6821 0.6408 0.1278 -0.0443 -0.0117 267 HIS A CB 2048 C CG . HIS A 267 ? 0.5698 0.6848 0.6300 0.1343 -0.0355 -0.0309 267 HIS A CG 2049 N ND1 . HIS A 267 ? 0.5753 0.6790 0.6502 0.1451 -0.0374 -0.0481 267 HIS A ND1 2050 C CD2 . HIS A 267 ? 0.5592 0.6881 0.5958 0.1319 -0.0259 -0.0361 267 HIS A CD2 2051 C CE1 . HIS A 267 ? 0.5751 0.6878 0.6360 0.1481 -0.0298 -0.0651 267 HIS A CE1 2052 N NE2 . HIS A 267 ? 0.5657 0.6944 0.6019 0.1409 -0.0233 -0.0572 267 HIS A NE2 2053 N N . SER A 268 ? 0.5849 0.7687 0.7023 0.1521 -0.0215 -0.0375 268 SER A N 2054 C CA . SER A 268 ? 0.5979 0.8058 0.7474 0.1684 -0.0146 -0.0542 268 SER A CA 2055 C C . SER A 268 ? 0.6136 0.7978 0.7878 0.1823 -0.0257 -0.0640 268 SER A C 2056 O O . SER A 268 ? 0.6241 0.8244 0.8334 0.1973 -0.0243 -0.0741 268 SER A O 2057 C CB . SER A 268 ? 0.6062 0.8356 0.7395 0.1732 0.0029 -0.0722 268 SER A CB 2058 O OG . SER A 268 ? 0.6095 0.8146 0.7169 0.1728 0.0000 -0.0824 268 SER A OG 2059 N N . SER A 269 ? 0.6187 0.7645 0.7761 0.1772 -0.0358 -0.0606 269 SER A N 2060 C CA . SER A 269 ? 0.6400 0.7554 0.8171 0.1876 -0.0459 -0.0672 269 SER A CA 2061 C C . SER A 269 ? 0.6467 0.7461 0.8404 0.1882 -0.0620 -0.0465 269 SER A C 2062 O O . SER A 269 ? 0.6671 0.7417 0.8811 0.1991 -0.0713 -0.0479 269 SER A O 2063 C CB . SER A 269 ? 0.6464 0.7286 0.7997 0.1799 -0.0480 -0.0729 269 SER A CB 2064 O OG . SER A 269 ? 0.6316 0.6980 0.7585 0.1631 -0.0539 -0.0528 269 SER A OG 2065 N N . LEU A 270 ? 0.6349 0.7472 0.8190 0.1766 -0.0660 -0.0274 270 LEU A N 2066 C CA . LEU A 270 ? 0.6432 0.7428 0.8360 0.1751 -0.0831 -0.0071 270 LEU A CA 2067 C C . LEU A 270 ? 0.6495 0.7814 0.8827 0.1881 -0.0878 -0.0068 270 LEU A C 2068 O O . LEU A 270 ? 0.6624 0.7841 0.9120 0.1945 -0.1048 0.0058 270 LEU A O 2069 C CB . LEU A 270 ? 0.6284 0.7220 0.7887 0.1549 -0.0869 0.0111 270 LEU A CB 2070 C CG . LEU A 270 ? 0.6263 0.6883 0.7505 0.1423 -0.0843 0.0128 270 LEU A CG 2071 C CD1 . LEU A 270 ? 0.6143 0.6757 0.7101 0.1243 -0.0857 0.0278 270 LEU A CD1 2072 C CD2 . LEU A 270 ? 0.6462 0.6674 0.7699 0.1455 -0.0940 0.0170 270 LEU A CD2 2073 N N . GLY A 271 ? 0.6442 0.8165 0.8931 0.1921 -0.0726 -0.0203 271 GLY A N 2074 C CA . GLY A 271 ? 0.6502 0.8609 0.9438 0.2052 -0.0730 -0.0245 271 GLY A CA 2075 C C . GLY A 271 ? 0.6442 0.8739 0.9482 0.1960 -0.0856 -0.0059 271 GLY A C 2076 O O . GLY A 271 ? 0.6524 0.8980 0.9944 0.2086 -0.0982 -0.0031 271 GLY A O 2077 N N . GLY A 272 ? 0.6322 0.8602 0.9038 0.1746 -0.0834 0.0056 272 GLY A N 2078 C CA . GLY A 272 ? 0.6291 0.8739 0.9068 0.1626 -0.0950 0.0208 272 GLY A CA 2079 C C . GLY A 272 ? 0.6407 0.8496 0.8945 0.1555 -0.1163 0.0385 272 GLY A C 2080 O O . GLY A 272 ? 0.6387 0.8550 0.8844 0.1413 -0.1254 0.0501 272 GLY A O 2081 N N . GLN A 273 ? 0.6578 0.8276 0.8994 0.1645 -0.1235 0.0401 273 GLN A N 2082 C CA . GLN A 273 ? 0.6735 0.8062 0.8885 0.1583 -0.1415 0.0579 273 GLN A CA 2083 C C . GLN A 273 ? 0.6654 0.7694 0.8329 0.1400 -0.1330 0.0614 273 GLN A C 2084 O O . GLN A 273 ? 0.6716 0.7448 0.8230 0.1418 -0.1277 0.0574 273 GLN A O 2085 C CB . GLN A 273 ? 0.7014 0.8043 0.9295 0.1765 -0.1533 0.0607 273 GLN A CB 2086 C CG . GLN A 273 ? 0.7193 0.8455 0.9932 0.1960 -0.1687 0.0627 273 GLN A CG 2087 C CD . GLN A 273 ? 0.7553 0.8453 1.0407 0.2152 -0.1813 0.0681 273 GLN A CD 2088 O OE1 . GLN A 273 ? 0.7753 0.8726 1.0887 0.2306 -0.2002 0.0770 273 GLN A OE1 2089 N NE2 . GLN A 273 ? 0.7643 0.8149 1.0301 0.2143 -0.1717 0.0628 273 GLN A NE2 2090 N N . ASP A 274 ? 0.6528 0.7676 0.8013 0.1225 -0.1319 0.0677 274 ASP A N 2091 C CA . ASP A 274 ? 0.6449 0.7388 0.7530 0.1062 -0.1222 0.0692 274 ASP A CA 2092 C C . ASP A 274 ? 0.6603 0.7134 0.7376 0.1008 -0.1312 0.0802 274 ASP A C 2093 O O . ASP A 274 ? 0.6803 0.7229 0.7571 0.1030 -0.1482 0.0926 274 ASP A O 2094 C CB . ASP A 274 ? 0.6345 0.7472 0.7330 0.0896 -0.1198 0.0732 274 ASP A CB 2095 C CG . ASP A 274 ? 0.6275 0.7807 0.7546 0.0911 -0.1081 0.0646 274 ASP A CG 2096 O OD1 . ASP A 274 ? 0.6352 0.8044 0.7872 0.1057 -0.1003 0.0538 274 ASP A OD1 2097 O OD2 . ASP A 274 ? 0.6262 0.7947 0.7508 0.0768 -0.1057 0.0680 274 ASP A OD2 2098 N N . ILE A 275 ? 0.6529 0.6848 0.7045 0.0937 -0.1197 0.0760 275 ILE A N 2099 C CA . ILE A 275 ? 0.6662 0.6630 0.6865 0.0846 -0.1236 0.0856 275 ILE A CA 2100 C C . ILE A 275 ? 0.6611 0.6593 0.6548 0.0681 -0.1254 0.0931 275 ILE A C 2101 O O . ILE A 275 ? 0.6436 0.6531 0.6295 0.0602 -0.1143 0.0868 275 ILE A O 2102 C CB . ILE A 275 ? 0.6638 0.6413 0.6725 0.0831 -0.1105 0.0761 275 ILE A CB 2103 C CG1 . ILE A 275 ? 0.6725 0.6450 0.7073 0.0985 -0.1093 0.0661 275 ILE A CG1 2104 C CG2 . ILE A 275 ? 0.6799 0.6253 0.6577 0.0710 -0.1115 0.0860 275 ILE A CG2 2105 C CD1 . ILE A 275 ? 0.6667 0.6276 0.6963 0.0972 -0.0972 0.0520 275 ILE A CD1 2106 N N . ILE A 276 ? 0.6792 0.6648 0.6582 0.0635 -0.1398 0.1064 276 ILE A N 2107 C CA . ILE A 276 ? 0.6795 0.6633 0.6306 0.0477 -0.1426 0.1115 276 ILE A CA 2108 C C . ILE A 276 ? 0.7005 0.6506 0.6155 0.0398 -0.1439 0.1207 276 ILE A C 2109 O O . ILE A 276 ? 0.7291 0.6636 0.6373 0.0439 -0.1565 0.1330 276 ILE A O 2110 C CB . ILE A 276 ? 0.6862 0.6928 0.6493 0.0466 -0.1595 0.1170 276 ILE A CB 2111 C CG1 . ILE A 276 ? 0.6706 0.7131 0.6762 0.0557 -0.1574 0.1087 276 ILE A CG1 2112 C CG2 . ILE A 276 ? 0.6880 0.6949 0.6251 0.0288 -0.1598 0.1168 276 ILE A CG2 2113 C CD1 . ILE A 276 ? 0.6862 0.7543 0.7171 0.0604 -0.1767 0.1137 276 ILE A CD1 2114 N N . LEU A 277 ? 0.6895 0.6289 0.5818 0.0289 -0.1302 0.1153 277 LEU A N 2115 C CA . LEU A 277 ? 0.7085 0.6199 0.5668 0.0194 -0.1272 0.1218 277 LEU A CA 2116 C C . LEU A 277 ? 0.7155 0.6278 0.5459 0.0058 -0.1290 0.1224 277 LEU A C 2117 O O . LEU A 277 ? 0.6996 0.6226 0.5308 0.0003 -0.1203 0.1126 277 LEU A O 2118 C CB . LEU A 277 ? 0.6968 0.5967 0.5533 0.0178 -0.1097 0.1131 277 LEU A CB 2119 C CG . LEU A 277 ? 0.6891 0.5871 0.5718 0.0290 -0.1051 0.1070 277 LEU A CG 2120 C CD1 . LEU A 277 ? 0.6811 0.5707 0.5581 0.0238 -0.0897 0.0973 277 LEU A CD1 2121 C CD2 . LEU A 277 ? 0.7219 0.5999 0.6094 0.0356 -0.1150 0.1186 277 LEU A CD2 2122 N N . TYR A 278 ? 0.7457 0.6451 0.5500 0.0007 -0.1406 0.1338 278 TYR A N 2123 C CA . TYR A 278 ? 0.7592 0.6578 0.5329 -0.0124 -0.1441 0.1329 278 TYR A CA 2124 C C . TYR A 278 ? 0.7740 0.6494 0.5130 -0.0226 -0.1296 0.1319 278 TYR A C 2125 O O . TYR A 278 ? 0.7923 0.6480 0.5191 -0.0219 -0.1259 0.1411 278 TYR A O 2126 C CB . TYR A 278 ? 0.7902 0.6917 0.5520 -0.0119 -0.1668 0.1450 278 TYR A CB 2127 C CG . TYR A 278 ? 0.7758 0.7068 0.5745 -0.0037 -0.1817 0.1435 278 TYR A CG 2128 C CD1 . TYR A 278 ? 0.7703 0.7076 0.6002 0.0122 -0.1899 0.1502 278 TYR A CD1 2129 C CD2 . TYR A 278 ? 0.7676 0.7206 0.5731 -0.0123 -0.1867 0.1342 278 TYR A CD2 2130 C CE1 . TYR A 278 ? 0.7580 0.7268 0.6260 0.0203 -0.2019 0.1474 278 TYR A CE1 2131 C CE2 . TYR A 278 ? 0.7547 0.7386 0.5983 -0.0065 -0.1986 0.1322 278 TYR A CE2 2132 C CZ . TYR A 278 ? 0.7513 0.7449 0.6264 0.0102 -0.2058 0.1387 278 TYR A CZ 2133 O OH . TYR A 278 ? 0.7443 0.7724 0.6608 0.0165 -0.2160 0.1353 278 TYR A OH 2134 N N . TRP A 279 ? 0.7687 0.6463 0.4942 -0.0323 -0.1205 0.1206 279 TRP A N 2135 C CA . TRP A 279 ? 0.7872 0.6470 0.4809 -0.0420 -0.1061 0.1171 279 TRP A CA 2136 C C . TRP A 279 ? 0.8321 0.6787 0.4849 -0.0500 -0.1154 0.1273 279 TRP A C 2137 O O . TRP A 279 ? 0.8487 0.7036 0.4910 -0.0530 -0.1319 0.1287 279 TRP A O 2138 C CB . TRP A 279 ? 0.7734 0.6380 0.4657 -0.0480 -0.0950 0.1013 279 TRP A CB 2139 C CG . TRP A 279 ? 0.7932 0.6431 0.4602 -0.0555 -0.0779 0.0948 279 TRP A CG 2140 C CD1 . TRP A 279 ? 0.8280 0.6671 0.4567 -0.0662 -0.0762 0.0928 279 TRP A CD1 2141 C CD2 . TRP A 279 ? 0.7815 0.6289 0.4610 -0.0525 -0.0598 0.0881 279 TRP A CD2 2142 N NE1 . TRP A 279 ? 0.8314 0.6618 0.4497 -0.0698 -0.0563 0.0852 279 TRP A NE1 2143 C CE2 . TRP A 279 ? 0.8036 0.6398 0.4546 -0.0616 -0.0467 0.0823 279 TRP A CE2 2144 C CE3 . TRP A 279 ? 0.7512 0.6069 0.4633 -0.0430 -0.0539 0.0850 279 TRP A CE3 2145 C CZ2 . TRP A 279 ? 0.7952 0.6305 0.4544 -0.0611 -0.0280 0.0740 279 TRP A CZ2 2146 C CZ3 . TRP A 279 ? 0.7442 0.5981 0.4618 -0.0428 -0.0375 0.0767 279 TRP A CZ3 2147 C CH2 . TRP A 279 ? 0.7628 0.6076 0.4565 -0.0517 -0.0247 0.0715 279 TRP A CH2 2148 N N . GLY A 280 ? 0.8560 0.6832 0.4858 -0.0540 -0.1048 0.1345 280 GLY A N 2149 C CA . GLY A 280 ? 0.9070 0.7192 0.4902 -0.0626 -0.1098 0.1455 280 GLY A CA 2150 C C . GLY A 280 ? 0.9374 0.7421 0.5136 -0.0561 -0.1296 0.1668 280 GLY A C 2151 O O . GLY A 280 ? 0.9822 0.7754 0.5163 -0.0620 -0.1377 0.1787 280 GLY A O 2152 N N . SER A 281 ? 0.9156 0.7265 0.5319 -0.0431 -0.1375 0.1715 281 SER A N 2153 C CA . SER A 281 ? 0.9447 0.7473 0.5625 -0.0333 -0.1565 0.1915 281 SER A CA 2154 C C . SER A 281 ? 0.9798 0.7510 0.5787 -0.0354 -0.1463 0.2078 281 SER A C 2155 O O . SER A 281 ? 0.9743 0.7356 0.5692 -0.0439 -0.1236 0.2010 281 SER A O 2156 C CB . SER A 281 ? 0.9087 0.7290 0.5791 -0.0178 -0.1656 0.1880 281 SER A CB 2157 O OG . SER A 281 ? 0.8758 0.6947 0.5754 -0.0148 -0.1470 0.1775 281 SER A OG 2158 N N . LEU A 282 ? 1.0196 0.7753 0.6088 -0.0278 -0.1633 0.2296 282 LEU A N 2159 C CA . LEU A 282 ? 1.0600 0.7813 0.6334 -0.0297 -0.1548 0.2486 282 LEU A CA 2160 C C . LEU A 282 ? 1.0292 0.7439 0.6445 -0.0265 -0.1372 0.2393 282 LEU A C 2161 O O . LEU A 282 ? 1.0441 0.7383 0.6490 -0.0368 -0.1173 0.2418 282 LEU A O 2162 C CB . LEU A 282 ? 1.1057 0.8111 0.6702 -0.0177 -0.1793 0.2743 282 LEU A CB 2163 N N . HIS A 283 ? 0.9906 0.7248 0.6531 -0.0128 -0.1443 0.2273 283 HIS A N 2164 C CA . HIS A 283 ? 0.9608 0.6936 0.6641 -0.0082 -0.1305 0.2147 283 HIS A CA 2165 C C . HIS A 283 ? 0.9330 0.6750 0.6357 -0.0207 -0.1072 0.1960 283 HIS A C 2166 O O . HIS A 283 ? 0.9329 0.6610 0.6459 -0.0259 -0.0911 0.1925 283 HIS A O 2167 C CB . HIS A 283 ? 0.9247 0.6823 0.6733 0.0085 -0.1423 0.2037 283 HIS A CB 2168 C CG . HIS A 283 ? 0.9070 0.6606 0.6949 0.0160 -0.1323 0.1923 283 HIS A CG 2169 N ND1 . HIS A 283 ? 0.8634 0.6384 0.6742 0.0152 -0.1190 0.1700 283 HIS A ND1 2170 C CD2 . HIS A 283 ? 0.9281 0.6576 0.7354 0.0247 -0.1343 0.1994 283 HIS A CD2 2171 C CE1 . HIS A 283 ? 0.8575 0.6244 0.6986 0.0226 -0.1138 0.1625 283 HIS A CE1 2172 N NE2 . HIS A 283 ? 0.8973 0.6359 0.7385 0.0281 -0.1223 0.1790 283 HIS A NE2 2173 N N . HIS A 284 ? 0.9124 0.6774 0.6049 -0.0254 -0.1062 0.1837 284 HIS A N 2174 C CA . HIS A 284 ? 0.8858 0.6614 0.5793 -0.0344 -0.0863 0.1656 284 HIS A CA 2175 C C . HIS A 284 ? 0.9169 0.6736 0.5794 -0.0494 -0.0687 0.1705 284 HIS A C 2176 O O . HIS A 284 ? 0.9031 0.6613 0.5802 -0.0544 -0.0505 0.1591 284 HIS A O 2177 C CB . HIS A 284 ? 0.8644 0.6635 0.5527 -0.0357 -0.0905 0.1534 284 HIS A CB 2178 C CG . HIS A 284 ? 0.8394 0.6469 0.5273 -0.0428 -0.0718 0.1363 284 HIS A CG 2179 N ND1 . HIS A 284 ? 0.8162 0.6257 0.5280 -0.0417 -0.0568 0.1261 284 HIS A ND1 2180 C CD2 . HIS A 284 ? 0.8354 0.6503 0.5040 -0.0500 -0.0671 0.1265 284 HIS A CD2 2181 C CE1 . HIS A 284 ? 0.8004 0.6192 0.5082 -0.0466 -0.0441 0.1124 284 HIS A CE1 2182 N NE2 . HIS A 284 ? 0.8117 0.6321 0.4935 -0.0515 -0.0493 0.1122 284 HIS A NE2 2183 N N . ILE A 285 ? 0.9605 0.7016 0.5807 -0.0563 -0.0742 0.1870 285 ILE A N 2184 C CA . ILE A 285 ? 0.9989 0.7213 0.5844 -0.0714 -0.0563 0.1945 285 ILE A CA 2185 C C . ILE A 285 ? 1.0128 0.7136 0.6165 -0.0741 -0.0445 0.2028 285 ILE A C 2186 O O . ILE A 285 ? 1.0165 0.7137 0.6191 -0.0862 -0.0221 0.1970 285 ILE A O 2187 C CB . ILE A 285 ? 1.0543 0.7627 0.5852 -0.0772 -0.0672 0.2136 285 ILE A CB 2188 C CG1 . ILE A 285 ? 1.0451 0.7750 0.5585 -0.0768 -0.0793 0.2022 285 ILE A CG1 2189 C CG2 . ILE A 285 ? 1.0957 0.7842 0.5872 -0.0937 -0.0459 0.2231 285 ILE A CG2 2190 C CD1 . ILE A 285 ? 1.0154 0.7620 0.5303 -0.0843 -0.0611 0.1778 285 ILE A CD1 2191 N N . LEU A 286 ? 1.0215 0.7086 0.6450 -0.0629 -0.0592 0.2151 286 LEU A N 2192 C CA . LEU A 286 ? 1.0410 0.7023 0.6835 -0.0651 -0.0505 0.2234 286 LEU A CA 2193 C C . LEU A 286 ? 0.9985 0.6742 0.6864 -0.0653 -0.0362 0.2000 286 LEU A C 2194 O O . LEU A 286 ? 1.0135 0.6751 0.7102 -0.0765 -0.0190 0.1995 286 LEU A O 2195 C CB . LEU A 286 ? 1.0621 0.7040 0.7167 -0.0503 -0.0715 0.2407 286 LEU A CB 2196 C CG . LEU A 286 ? 1.1268 0.7411 0.7389 -0.0500 -0.0853 0.2714 286 LEU A CG 2197 C CD1 . LEU A 286 ? 1.1366 0.7410 0.7733 -0.0298 -0.1092 0.2828 286 LEU A CD1 2198 C CD2 . LEU A 286 ? 1.1796 0.7582 0.7632 -0.0666 -0.0671 0.2902 286 LEU A CD2 2199 N N . ASP A 287 ? 0.9500 0.6542 0.6659 -0.0536 -0.0437 0.1811 287 ASP A N 2200 C CA . ASP A 287 ? 0.9101 0.6313 0.6659 -0.0515 -0.0337 0.1586 287 ASP A CA 2201 C C . ASP A 287 ? 0.8975 0.6337 0.6482 -0.0640 -0.0139 0.1447 287 ASP A C 2202 O O . ASP A 287 ? 0.8883 0.6285 0.6649 -0.0691 -0.0010 0.1322 287 ASP A O 2203 C CB . ASP A 287 ? 0.8683 0.6155 0.6501 -0.0353 -0.0468 0.1450 287 ASP A CB 2204 N N . ALA A 288 ? 0.8993 0.6447 0.6186 -0.0686 -0.0122 0.1453 288 ALA A N 2205 C CA . ALA A 288 ? 0.8893 0.6494 0.6029 -0.0783 0.0063 0.1314 288 ALA A CA 2206 C C . ALA A 288 ? 0.9229 0.6679 0.6269 -0.0951 0.0269 0.1372 288 ALA A C 2207 O O . ALA A 288 ? 0.9075 0.6673 0.6323 -0.1011 0.0435 0.1217 288 ALA A O 2208 C CB . ALA A 288 ? 0.8911 0.6604 0.5722 -0.0791 0.0028 0.1300 288 ALA A CB 2209 N N . GLN A 289 ? 0.9691 0.6859 0.6425 -0.1024 0.0258 0.1602 289 GLN A N 2210 C CA . GLN A 289 ? 1.0110 0.7103 0.6711 -0.1204 0.0471 0.1695 289 GLN A CA 2211 C C . GLN A 289 ? 1.0084 0.6976 0.7098 -0.1244 0.0543 0.1667 289 GLN A C 2212 O O . GLN A 289 ? 1.0304 0.7133 0.7359 -0.1409 0.0755 0.1674 289 GLN A O 2213 C CB . GLN A 289 ? 1.0713 0.7416 0.6785 -0.1276 0.0440 0.1975 289 GLN A CB 2214 C CG . GLN A 289 ? 1.0941 0.7387 0.6981 -0.1166 0.0210 0.2190 289 GLN A CG 2215 C CD . GLN A 289 ? 1.1538 0.7758 0.7004 -0.1201 0.0125 0.2459 289 GLN A CD 2216 O OE1 . GLN A 289 ? 1.1661 0.7988 0.6732 -0.1260 0.0162 0.2442 289 GLN A OE1 2217 N NE2 . GLN A 289 ? 1.1910 0.7810 0.7321 -0.1155 0.0001 0.2705 289 GLN A NE2 2218 N N . LYS A 290 ? 0.9836 0.6725 0.7168 -0.1100 0.0375 0.1619 290 LYS A N 2219 C CA . LYS A 290 ? 0.9774 0.6598 0.7538 -0.1118 0.0418 0.1531 290 LYS A CA 2220 C C . LYS A 290 ? 0.9328 0.6505 0.7468 -0.1115 0.0505 0.1239 290 LYS A C 2221 O O . LYS A 290 ? 0.9278 0.6459 0.7783 -0.1164 0.0566 0.1121 290 LYS A O 2222 C CB . LYS A 290 ? 0.9734 0.6415 0.7676 -0.0952 0.0207 0.1576 290 LYS A CB 2223 C CG . LYS A 290 ? 1.0274 0.6554 0.7956 -0.0951 0.0120 0.1872 290 LYS A CG 2224 C CD . LYS A 290 ? 1.0257 0.6442 0.8177 -0.0757 -0.0088 0.1883 290 LYS A CD 2225 C CE . LYS A 290 ? 1.0870 0.6654 0.8547 -0.0723 -0.0201 0.2191 290 LYS A CE 2226 N N . MET A 291 ? 0.9028 0.6492 0.7082 -0.1058 0.0503 0.1121 291 MET A N 2227 C CA . MET A 291 ? 0.8647 0.6450 0.7026 -0.1028 0.0564 0.0865 291 MET A CA 2228 C C . MET A 291 ? 0.8639 0.6636 0.6893 -0.1108 0.0732 0.0786 291 MET A C 2229 O O . MET A 291 ? 0.8339 0.6622 0.6756 -0.1023 0.0727 0.0605 291 MET A O 2230 C CB . MET A 291 ? 0.8244 0.6239 0.6775 -0.0830 0.0381 0.0748 291 MET A CB 2231 C CG . MET A 291 ? 0.8215 0.6234 0.6442 -0.0737 0.0266 0.0827 291 MET A CG 2232 S SD . MET A 291 ? 0.7832 0.6110 0.6264 -0.0538 0.0108 0.0682 291 MET A SD 2233 C CE . MET A 291 ? 0.7595 0.6164 0.6125 -0.0538 0.0226 0.0491 291 MET A CE 2234 N N . VAL A 292 ? 0.9025 0.6863 0.6984 -0.1263 0.0886 0.0921 292 VAL A N 2235 C CA . VAL A 292 ? 0.9064 0.7085 0.6922 -0.1351 0.1084 0.0829 292 VAL A CA 2236 C C . VAL A 292 ? 0.8949 0.7196 0.7251 -0.1436 0.1252 0.0647 292 VAL A C 2237 O O . VAL A 292 ? 0.9073 0.7211 0.7610 -0.1534 0.1296 0.0673 292 VAL A O 2238 C CB . VAL A 292 ? 0.9590 0.7388 0.6951 -0.1500 0.1217 0.1026 292 VAL A CB 2239 C CG1 . VAL A 292 ? 0.9671 0.7368 0.6591 -0.1408 0.1053 0.1134 292 VAL A CG1 2240 C CG2 . VAL A 292 ? 0.9992 0.7473 0.7308 -0.1640 0.1278 0.1232 292 VAL A CG2 2241 N N . TRP A 293 ? 0.8735 0.7295 0.7174 -0.1395 0.1338 0.0456 293 TRP A N 2242 C CA . TRP A 293 ? 0.8603 0.7457 0.7509 -0.1453 0.1478 0.0255 293 TRP A CA 2243 C C . TRP A 293 ? 0.8621 0.7737 0.7521 -0.1464 0.1659 0.0118 293 TRP A C 2244 O O . TRP A 293 ? 0.8705 0.7764 0.7237 -0.1412 0.1660 0.0156 293 TRP A O 2245 C CB . TRP A 293 ? 0.8179 0.7231 0.7502 -0.1302 0.1294 0.0091 293 TRP A CB 2246 C CG . TRP A 293 ? 0.7804 0.7015 0.7078 -0.1090 0.1140 0.0007 293 TRP A CG 2247 C CD1 . TRP A 293 ? 0.7764 0.6813 0.6682 -0.0989 0.1010 0.0122 293 TRP A CD1 2248 C CD2 . TRP A 293 ? 0.7449 0.7004 0.7052 -0.0957 0.1095 -0.0199 293 TRP A CD2 2249 N NE1 . TRP A 293 ? 0.7464 0.6709 0.6465 -0.0819 0.0908 0.0005 293 TRP A NE1 2250 C CE2 . TRP A 293 ? 0.7287 0.6831 0.6687 -0.0785 0.0953 -0.0180 293 TRP A CE2 2251 C CE3 . TRP A 293 ? 0.7287 0.7165 0.7346 -0.0967 0.1154 -0.0395 293 TRP A CE3 2252 C CZ2 . TRP A 293 ? 0.6982 0.6784 0.6584 -0.0618 0.0874 -0.0326 293 TRP A CZ2 2253 C CZ3 . TRP A 293 ? 0.6975 0.7143 0.7240 -0.0785 0.1054 -0.0549 293 TRP A CZ3 2254 C CH2 . TRP A 293 ? 0.6888 0.6995 0.6906 -0.0610 0.0918 -0.0501 293 TRP A CH2 2255 N N . ASN A 294 ? 0.8576 0.7988 0.7908 -0.1529 0.1807 -0.0056 294 ASN A N 2256 C CA . ASN A 294 ? 0.8655 0.8341 0.8055 -0.1546 0.2013 -0.0202 294 ASN A CA 2257 C C . ASN A 294 ? 0.8367 0.8296 0.7882 -0.1318 0.1901 -0.0372 294 ASN A C 2258 O O . ASN A 294 ? 0.8422 0.8557 0.7991 -0.1298 0.2057 -0.0502 294 ASN A O 2259 C CB . ASN A 294 ? 0.8723 0.8668 0.8587 -0.1712 0.2228 -0.0326 294 ASN A CB 2260 C CG . ASN A 294 ? 0.8328 0.8575 0.8780 -0.1621 0.2087 -0.0521 294 ASN A CG 2261 O OD1 . ASN A 294 ? 0.7987 0.8251 0.8477 -0.1426 0.1838 -0.0559 294 ASN A OD1 2262 N ND2 . ASN A 294 ? 0.8330 0.8833 0.9240 -0.1771 0.2249 -0.0650 294 ASN A ND2 2263 N N . HIS A 295 ? 0.8130 0.8021 0.7684 -0.1146 0.1643 -0.0368 295 HIS A N 2264 C CA . HIS A 295 ? 0.7911 0.7960 0.7528 -0.0924 0.1511 -0.0482 295 HIS A CA 2265 C C . HIS A 295 ? 0.7759 0.8218 0.7876 -0.0832 0.1552 -0.0708 295 HIS A C 2266 O O . HIS A 295 ? 0.7685 0.8270 0.7830 -0.0678 0.1538 -0.0804 295 HIS A O 2267 C CB . HIS A 295 ? 0.8074 0.7953 0.7248 -0.0887 0.1548 -0.0428 295 HIS A CB 2268 C CG . HIS A 295 ? 0.8233 0.7774 0.6971 -0.0900 0.1407 -0.0231 295 HIS A CG 2269 N ND1 . HIS A 295 ? 0.8588 0.7886 0.7047 -0.1063 0.1459 -0.0056 295 HIS A ND1 2270 C CD2 . HIS A 295 ? 0.8144 0.7565 0.6700 -0.0769 0.1214 -0.0177 295 HIS A CD2 2271 C CE1 . HIS A 295 ? 0.8608 0.7672 0.6748 -0.1016 0.1287 0.0087 295 HIS A CE1 2272 N NE2 . HIS A 295 ? 0.8313 0.7459 0.6517 -0.0849 0.1144 0.0009 295 HIS A NE2 2273 N N . ARG A 296 ? 0.7769 0.8427 0.8294 -0.0925 0.1591 -0.0793 296 ARG A N 2274 C CA . ARG A 296 ? 0.7605 0.8693 0.8665 -0.0830 0.1570 -0.1011 296 ARG A CA 2275 C C . ARG A 296 ? 0.7432 0.8591 0.8724 -0.0754 0.1333 -0.1050 296 ARG A C 2276 O O . ARG A 296 ? 0.7522 0.8494 0.8783 -0.0884 0.1306 -0.0972 296 ARG A O 2277 C CB . ARG A 296 ? 0.7753 0.9086 0.9163 -0.1024 0.1820 -0.1120 296 ARG A CB 2278 C CG . ARG A 296 ? 0.8057 0.9331 0.9225 -0.1139 0.2100 -0.1089 296 ARG A CG 2279 C CD . ARG A 296 ? 0.8220 0.9699 0.9707 -0.1380 0.2373 -0.1158 296 ARG A CD 2280 N NE . ARG A 296 ? 0.8024 1.0022 1.0134 -0.1311 0.2418 -0.1411 296 ARG A NE 2281 C CZ . ARG A 296 ? 0.7821 1.0102 1.0458 -0.1341 0.2325 -0.1540 296 ARG A CZ 2282 N NH1 . ARG A 296 ? 0.7833 0.9901 1.0449 -0.1443 0.2197 -0.1451 296 ARG A NH1 2283 N NH2 . ARG A 296 ? 0.7640 1.0427 1.0843 -0.1263 0.2353 -0.1773 296 ARG A NH2 2284 N N . HIS A 297 ? 0.7257 0.8664 0.8759 -0.0540 0.1158 -0.1167 297 HIS A N 2285 C CA . HIS A 297 ? 0.7228 0.8792 0.8751 -0.0351 0.1157 -0.1236 297 HIS A CA 2286 C C . HIS A 297 ? 0.7186 0.8502 0.8339 -0.0178 0.0966 -0.1109 297 HIS A C 2287 O O . HIS A 297 ? 0.7009 0.8458 0.8277 -0.0003 0.0768 -0.1148 297 HIS A O 2288 C CB . HIS A 297 ? 0.7072 0.9103 0.9127 -0.0221 0.1073 -0.1443 297 HIS A CB 2289 C CG . HIS A 297 ? 0.7058 0.9393 0.9579 -0.0402 0.1210 -0.1591 297 HIS A CG 2290 N ND1 . HIS A 297 ? 0.7032 0.9289 0.9639 -0.0594 0.1207 -0.1577 297 HIS A ND1 2291 C CD2 . HIS A 297 ? 0.7062 0.9790 1.0028 -0.0420 0.1355 -0.1767 297 HIS A CD2 2292 C CE1 . HIS A 297 ? 0.7109 0.9682 1.0183 -0.0745 0.1350 -0.1730 297 HIS A CE1 2293 N NE2 . HIS A 297 ? 0.7094 0.9982 1.0404 -0.0643 0.1444 -0.1850 297 HIS A NE2 2294 N N . HIS A 298 ? 0.7383 0.8353 0.8090 -0.0235 0.1025 -0.0957 298 HIS A N 2295 C CA . HIS A 298 ? 0.7378 0.8096 0.7734 -0.0114 0.0867 -0.0826 298 HIS A CA 2296 C C . HIS A 298 ? 0.7301 0.8148 0.7750 0.0122 0.0743 -0.0885 298 HIS A C 2297 O O . HIS A 298 ? 0.7343 0.8410 0.8039 0.0207 0.0813 -0.1013 298 HIS A O 2298 C CB . HIS A 298 ? 0.7572 0.7972 0.7490 -0.0210 0.0971 -0.0702 298 HIS A CB 2299 C CG . HIS A 298 ? 0.7743 0.8179 0.7620 -0.0167 0.1114 -0.0788 298 HIS A CG 2300 N ND1 . HIS A 298 ? 0.7934 0.8535 0.7972 -0.0268 0.1335 -0.0898 298 HIS A ND1 2301 C CD2 . HIS A 298 ? 0.7803 0.8127 0.7513 -0.0036 0.1078 -0.0792 298 HIS A CD2 2302 C CE1 . HIS A 298 ? 0.8088 0.8686 0.8055 -0.0187 0.1428 -0.0979 298 HIS A CE1 2303 N NE2 . HIS A 298 ? 0.8054 0.8467 0.7823 -0.0046 0.1270 -0.0918 298 HIS A NE2 2304 N N . HIS A 299 ? 0.7246 0.7955 0.7504 0.0231 0.0567 -0.0783 299 HIS A N 2305 C CA . HIS A 299 ? 0.7234 0.7998 0.7514 0.0450 0.0441 -0.0788 299 HIS A CA 2306 C C . HIS A 299 ? 0.7393 0.8019 0.7545 0.0509 0.0540 -0.0792 299 HIS A C 2307 O O . HIS A 299 ? 0.7515 0.7885 0.7371 0.0396 0.0633 -0.0725 299 HIS A O 2308 C CB . HIS A 299 ? 0.7160 0.7767 0.7206 0.0514 0.0274 -0.0654 299 HIS A CB 2309 C CG . HIS A 299 ? 0.7076 0.7867 0.7284 0.0530 0.0148 -0.0694 299 HIS A CG 2310 N ND1 . HIS A 299 ? 0.7076 0.7912 0.7219 0.0675 -0.0016 -0.0651 299 HIS A ND1 2311 C CD2 . HIS A 299 ? 0.7061 0.7993 0.7485 0.0413 0.0170 -0.0784 299 HIS A CD2 2312 C CE1 . HIS A 299 ? 0.7002 0.8012 0.7301 0.0654 -0.0097 -0.0730 299 HIS A CE1 2313 N NE2 . HIS A 299 ? 0.6990 0.8051 0.7479 0.0494 0.0009 -0.0815 299 HIS A NE2 2314 N N . HIS A 300 ? 0.7439 0.8234 0.7818 0.0695 0.0506 -0.0879 300 HIS A N 2315 C CA . HIS A 300 ? 0.7638 0.8326 0.7983 0.0782 0.0604 -0.0927 300 HIS A CA 2316 C C . HIS A 300 ? 0.7770 0.8065 0.7713 0.0776 0.0585 -0.0799 300 HIS A C 2317 O O . HIS A 300 ? 0.7685 0.7843 0.7444 0.0794 0.0446 -0.0662 300 HIS A O 2318 C CB . HIS A 300 ? 0.7648 0.8561 0.8315 0.1028 0.0515 -0.1010 300 HIS A CB 2319 N N . HIS A 301 ? 0.7995 0.8131 0.7820 0.0742 0.0731 -0.0861 301 HIS A N 2320 C CA . HIS A 301 ? 0.8172 0.7942 0.7642 0.0715 0.0721 -0.0776 301 HIS A CA 2321 C C . HIS A 301 ? 0.8406 0.8048 0.7921 0.0850 0.0790 -0.0877 301 HIS A C 2322 O O . HIS A 301 ? 0.8545 0.8265 0.8156 0.0835 0.0959 -0.1034 301 HIS A O 2323 C CB . HIS A 301 ? 0.8260 0.7871 0.7411 0.0485 0.0814 -0.0739 301 HIS A CB 2324 C CG . HIS A 301 ? 0.8109 0.7781 0.7209 0.0365 0.0741 -0.0628 301 HIS A CG 2325 N ND1 . HIS A 301 ? 0.7953 0.7567 0.6988 0.0402 0.0571 -0.0495 301 HIS A ND1 2326 C CD2 . HIS A 301 ? 0.8106 0.7876 0.7217 0.0211 0.0825 -0.0632 301 HIS A CD2 2327 C CE1 . HIS A 301 ? 0.7861 0.7535 0.6885 0.0290 0.0546 -0.0439 301 HIS A CE1 2328 N NE2 . HIS A 301 ? 0.7965 0.7715 0.7033 0.0171 0.0693 -0.0510 301 HIS A NE2 2329 N N . HIS A 302 ? 0.8476 0.7911 0.7923 0.0983 0.0668 -0.0785 302 HIS A N 2330 C CA . HIS A 302 ? 0.8734 0.7973 0.8227 0.1130 0.0709 -0.0859 302 HIS A CA 2331 C C . HIS A 302 ? 0.8849 0.7735 0.8115 0.1161 0.0595 -0.0706 302 HIS A C 2332 O O . HIS A 302 ? 0.8719 0.7625 0.7992 0.1238 0.0447 -0.0552 302 HIS A O 2333 C CB . HIS A 302 ? 0.8734 0.8227 0.8632 0.1370 0.0679 -0.0943 302 HIS A CB 2334 N N . GLN B 2 ? 0.8444 0.8823 0.7471 0.2345 0.0276 0.0442 2 GLN B N 2335 C CA . GLN B 2 ? 0.8066 0.8783 0.7338 0.2287 0.0309 0.0247 2 GLN B CA 2336 C C . GLN B 2 ? 0.8229 0.8228 0.7301 0.2192 0.0357 0.0123 2 GLN B C 2337 O O . GLN B 2 ? 0.8735 0.8198 0.7515 0.2440 0.0430 0.0165 2 GLN B O 2338 C CB . GLN B 2 ? 0.8109 0.9390 0.7502 0.2635 0.0365 0.0315 2 GLN B CB 2339 C CG . GLN B 2 ? 0.7640 0.9610 0.7374 0.2490 0.0365 0.0161 2 GLN B CG 2340 C CD . GLN B 2 ? 0.7725 1.0436 0.7604 0.2804 0.0412 0.0262 2 GLN B CD 2341 O OE1 . GLN B 2 ? 0.8065 1.0584 0.7780 0.3161 0.0508 0.0329 2 GLN B OE1 2342 N NE2 . GLN B 2 ? 0.7388 1.0984 0.7555 0.2673 0.0344 0.0270 2 GLN B NE2 2343 N N . LYS B 3 ? 0.7843 0.7838 0.7044 0.1851 0.0318 -0.0032 3 LYS B N 2344 C CA . LYS B 3 ? 0.7969 0.7353 0.6988 0.1705 0.0344 -0.0141 3 LYS B CA 2345 C C . LYS B 3 ? 0.7617 0.7245 0.6832 0.1644 0.0381 -0.0308 3 LYS B C 2346 O O . LYS B 3 ? 0.7190 0.7429 0.6705 0.1559 0.0357 -0.0371 3 LYS B O 2347 C CB . LYS B 3 ? 0.7917 0.7069 0.6876 0.1379 0.0274 -0.0151 3 LYS B CB 2348 C CG . LYS B 3 ? 0.8462 0.7217 0.7137 0.1376 0.0242 0.0030 3 LYS B CG 2349 C CD . LYS B 3 ? 0.8550 0.7231 0.7197 0.1027 0.0175 0.0031 3 LYS B CD 2350 C CE . LYS B 3 ? 0.9114 0.7400 0.7452 0.0958 0.0138 0.0235 3 LYS B CE 2351 N NZ . LYS B 3 ? 0.9012 0.7360 0.7339 0.0597 0.0075 0.0252 3 LYS B NZ 2352 N N . THR B 4 ? 0.7834 0.6944 0.6835 0.1663 0.0435 -0.0376 4 THR B N 2353 C CA . THR B 4 ? 0.7602 0.6883 0.6725 0.1645 0.0486 -0.0506 4 THR B CA 2354 C C . THR B 4 ? 0.7228 0.6505 0.6472 0.1307 0.0438 -0.0626 4 THR B C 2355 O O . THR B 4 ? 0.7321 0.6196 0.6404 0.1130 0.0398 -0.0630 4 THR B O 2356 C CB . THR B 4 ? 0.8108 0.6835 0.6899 0.1860 0.0576 -0.0528 4 THR B CB 2357 O OG1 . THR B 4 ? 0.8622 0.7175 0.7198 0.2215 0.0621 -0.0399 4 THR B OG1 2358 C CG2 . THR B 4 ? 0.7903 0.6980 0.6841 0.1925 0.0646 -0.0622 4 THR B CG2 2359 N N . PRO B 5 ? 0.6843 0.6577 0.6345 0.1215 0.0441 -0.0710 5 PRO B N 2360 C CA . PRO B 5 ? 0.6578 0.6277 0.6160 0.0952 0.0406 -0.0812 5 PRO B CA 2361 C C . PRO B 5 ? 0.6758 0.5994 0.6139 0.0900 0.0442 -0.0867 5 PRO B C 2362 O O . PRO B 5 ? 0.7013 0.6085 0.6255 0.1062 0.0514 -0.0875 5 PRO B O 2363 C CB . PRO B 5 ? 0.6306 0.6510 0.6128 0.0898 0.0415 -0.0864 5 PRO B CB 2364 C CG . PRO B 5 ? 0.6316 0.6970 0.6246 0.1065 0.0421 -0.0784 5 PRO B CG 2365 C CD . PRO B 5 ? 0.6695 0.7038 0.6412 0.1337 0.0470 -0.0691 5 PRO B CD 2366 N N . GLN B 6 ? 0.6645 0.5719 0.5999 0.0690 0.0393 -0.0904 6 GLN B N 2367 C CA . GLN B 6 ? 0.6765 0.5512 0.5956 0.0591 0.0411 -0.0957 6 GLN B CA 2368 C C . GLN B 6 ? 0.6435 0.5414 0.5797 0.0464 0.0402 -0.1019 6 GLN B C 2369 O O . GLN B 6 ? 0.6234 0.5402 0.5728 0.0370 0.0350 -0.1023 6 GLN B O 2370 C CB . GLN B 6 ? 0.6964 0.5379 0.5952 0.0440 0.0356 -0.0920 6 GLN B CB 2371 C CG . GLN B 6 ? 0.7468 0.5551 0.6227 0.0519 0.0352 -0.0835 6 GLN B CG 2372 C CD . GLN B 6 ? 0.8029 0.5762 0.6556 0.0748 0.0431 -0.0851 6 GLN B CD 2373 O OE1 . GLN B 6 ? 0.8353 0.5749 0.6660 0.0731 0.0467 -0.0925 6 GLN B OE1 2374 N NE2 . GLN B 6 ? 0.8167 0.6005 0.6723 0.0989 0.0460 -0.0780 6 GLN B NE2 2375 N N . ILE B 7 ? 0.6440 0.5378 0.5763 0.0477 0.0456 -0.1064 7 ILE B N 2376 C CA . ILE B 7 ? 0.6189 0.5301 0.5639 0.0363 0.0454 -0.1098 7 ILE B CA 2377 C C . ILE B 7 ? 0.6243 0.5127 0.5549 0.0256 0.0448 -0.1117 7 ILE B C 2378 O O . ILE B 7 ? 0.6474 0.5138 0.5590 0.0285 0.0488 -0.1140 7 ILE B O 2379 C CB . ILE B 7 ? 0.6162 0.5547 0.5716 0.0422 0.0517 -0.1106 7 ILE B CB 2380 C CG1 . ILE B 7 ? 0.6066 0.5768 0.5748 0.0541 0.0523 -0.1069 7 ILE B CG1 2381 C CG2 . ILE B 7 ? 0.6008 0.5524 0.5666 0.0259 0.0500 -0.1118 7 ILE B CG2 2382 C CD1 . ILE B 7 ? 0.6166 0.6215 0.5915 0.0652 0.0599 -0.1049 7 ILE B CD1 2383 N N . GLN B 8 ? 0.6057 0.5002 0.5425 0.0150 0.0398 -0.1108 8 GLN B N 2384 C CA . GLN B 8 ? 0.6063 0.4914 0.5327 0.0059 0.0383 -0.1101 8 GLN B CA 2385 C C . GLN B 8 ? 0.5961 0.4912 0.5312 0.0030 0.0388 -0.1095 8 GLN B C 2386 O O . GLN B 8 ? 0.5880 0.4901 0.5319 0.0037 0.0357 -0.1092 8 GLN B O 2387 C CB . GLN B 8 ? 0.6042 0.4906 0.5258 -0.0009 0.0317 -0.1061 8 GLN B CB 2388 C CG . GLN B 8 ? 0.6242 0.4906 0.5280 -0.0062 0.0301 -0.1047 8 GLN B CG 2389 C CD . GLN B 8 ? 0.6250 0.5050 0.5283 -0.0160 0.0231 -0.0979 8 GLN B CD 2390 O OE1 . GLN B 8 ? 0.6148 0.5104 0.5300 -0.0106 0.0212 -0.0952 8 GLN B OE1 2391 N NE2 . GLN B 8 ? 0.6336 0.5139 0.5225 -0.0318 0.0191 -0.0945 8 GLN B NE2 2392 N N . VAL B 9 ? 0.6012 0.4927 0.5295 0.0000 0.0428 -0.1092 9 VAL B N 2393 C CA . VAL B 9 ? 0.6009 0.4948 0.5321 -0.0043 0.0435 -0.1059 9 VAL B CA 2394 C C . VAL B 9 ? 0.6089 0.4985 0.5288 -0.0072 0.0413 -0.1010 9 VAL B C 2395 O O . VAL B 9 ? 0.6183 0.5065 0.5264 -0.0105 0.0423 -0.1016 9 VAL B O 2396 C CB . VAL B 9 ? 0.6052 0.5084 0.5391 -0.0071 0.0500 -0.1058 9 VAL B CB 2397 C CG1 . VAL B 9 ? 0.6113 0.5112 0.5455 -0.0164 0.0495 -0.1005 9 VAL B CG1 2398 C CG2 . VAL B 9 ? 0.5980 0.5180 0.5434 -0.0022 0.0523 -0.1089 9 VAL B CG2 2399 N N . TYR B 10 ? 0.6108 0.4980 0.5311 -0.0045 0.0382 -0.0962 10 TYR B N 2400 C CA . TYR B 10 ? 0.6179 0.5095 0.5288 -0.0022 0.0356 -0.0887 10 TYR B CA 2401 C C . TYR B 10 ? 0.6348 0.5131 0.5409 0.0058 0.0349 -0.0825 10 TYR B C 2402 O O . TYR B 10 ? 0.6412 0.5050 0.5493 0.0097 0.0342 -0.0863 10 TYR B O 2403 C CB . TYR B 10 ? 0.6091 0.5181 0.5197 -0.0007 0.0305 -0.0876 10 TYR B CB 2404 C CG . TYR B 10 ? 0.6001 0.5135 0.5197 0.0069 0.0279 -0.0901 10 TYR B CG 2405 C CD1 . TYR B 10 ? 0.5919 0.5023 0.5184 0.0037 0.0282 -0.0965 10 TYR B CD1 2406 C CD2 . TYR B 10 ? 0.6045 0.5262 0.5230 0.0204 0.0255 -0.0856 10 TYR B CD2 2407 C CE1 . TYR B 10 ? 0.5842 0.5025 0.5178 0.0100 0.0257 -0.0984 10 TYR B CE1 2408 C CE2 . TYR B 10 ? 0.6007 0.5286 0.5245 0.0288 0.0238 -0.0892 10 TYR B CE2 2409 C CZ . TYR B 10 ? 0.5890 0.5165 0.5211 0.0217 0.0236 -0.0956 10 TYR B CZ 2410 O OH . TYR B 10 ? 0.5799 0.5173 0.5165 0.0292 0.0217 -0.0987 10 TYR B OH 2411 N N . SER B 11 ? 0.6492 0.5290 0.5450 0.0087 0.0349 -0.0731 11 SER B N 2412 C CA . SER B 11 ? 0.6763 0.5343 0.5603 0.0199 0.0348 -0.0649 11 SER B CA 2413 C C . SER B 11 ? 0.6809 0.5507 0.5608 0.0404 0.0313 -0.0601 11 SER B C 2414 O O . SER B 11 ? 0.6652 0.5721 0.5512 0.0416 0.0284 -0.0579 11 SER B O 2415 C CB . SER B 11 ? 0.6951 0.5495 0.5677 0.0159 0.0371 -0.0539 11 SER B CB 2416 O OG . SER B 11 ? 0.6859 0.5737 0.5582 0.0146 0.0355 -0.0497 11 SER B OG 2417 N N . ARG B 12 ? 0.7093 0.5475 0.5758 0.0561 0.0316 -0.0585 12 ARG B N 2418 C CA . ARG B 12 ? 0.7224 0.5702 0.5806 0.0834 0.0300 -0.0536 12 ARG B CA 2419 C C . ARG B 12 ? 0.7323 0.6084 0.5837 0.0975 0.0293 -0.0373 12 ARG B C 2420 O O . ARG B 12 ? 0.7199 0.6432 0.5770 0.1110 0.0270 -0.0316 12 ARG B O 2421 C CB . ARG B 12 ? 0.7653 0.5578 0.6014 0.0984 0.0314 -0.0579 12 ARG B CB 2422 C CG . ARG B 12 ? 0.7935 0.5856 0.6120 0.1357 0.0318 -0.0522 12 ARG B CG 2423 C CD . ARG B 12 ? 0.7536 0.5990 0.5887 0.1462 0.0301 -0.0569 12 ARG B CD 2424 N NE . ARG B 12 ? 0.7829 0.6363 0.6010 0.1859 0.0318 -0.0516 12 ARG B NE 2425 C CZ . ARG B 12 ? 0.7840 0.6818 0.6007 0.2090 0.0320 -0.0352 12 ARG B CZ 2426 N NH1 . ARG B 12 ? 0.7523 0.6877 0.5823 0.1925 0.0297 -0.0235 12 ARG B NH1 2427 N NH2 . ARG B 12 ? 0.8120 0.7199 0.6120 0.2505 0.0347 -0.0307 12 ARG B NH2 2428 N N . HIS B 13 ? 0.7560 0.6098 0.5954 0.0930 0.0311 -0.0282 13 HIS B N 2429 C CA . HIS B 13 ? 0.7720 0.6527 0.6029 0.1065 0.0304 -0.0108 13 HIS B CA 2430 C C . HIS B 13 ? 0.7529 0.6596 0.5915 0.0808 0.0299 -0.0085 13 HIS B C 2431 O O . HIS B 13 ? 0.7392 0.6315 0.5855 0.0573 0.0318 -0.0195 13 HIS B O 2432 C CB . HIS B 13 ? 0.8288 0.6566 0.6314 0.1273 0.0330 0.0009 13 HIS B CB 2433 C CG . HIS B 13 ? 0.8648 0.6547 0.6498 0.1559 0.0342 -0.0029 13 HIS B CG 2434 N ND1 . HIS B 13 ? 0.8762 0.6990 0.6566 0.1918 0.0339 0.0042 13 HIS B ND1 2435 C CD2 . HIS B 13 ? 0.8999 0.6234 0.6676 0.1539 0.0357 -0.0141 13 HIS B CD2 2436 C CE1 . HIS B 13 ? 0.9213 0.6951 0.6806 0.2144 0.0361 -0.0034 13 HIS B CE1 2437 N NE2 . HIS B 13 ? 0.9367 0.6464 0.6865 0.1900 0.0366 -0.0154 13 HIS B NE2 2438 N N . PRO B 14 ? 0.7570 0.7057 0.5917 0.0867 0.0275 0.0054 14 PRO B N 2439 C CA . PRO B 14 ? 0.7471 0.7165 0.5824 0.0631 0.0272 0.0065 14 PRO B CA 2440 C C . PRO B 14 ? 0.7653 0.6895 0.5921 0.0513 0.0323 0.0064 14 PRO B C 2441 O O . PRO B 14 ? 0.8016 0.6892 0.6128 0.0647 0.0344 0.0178 14 PRO B O 2442 C CB . PRO B 14 ? 0.7602 0.7746 0.5866 0.0777 0.0239 0.0258 14 PRO B CB 2443 C CG . PRO B 14 ? 0.7619 0.8024 0.5915 0.1046 0.0215 0.0316 14 PRO B CG 2444 C CD . PRO B 14 ? 0.7720 0.7572 0.6004 0.1166 0.0252 0.0211 14 PRO B CD 2445 N N . PRO B 15 ? 0.7471 0.6728 0.5811 0.0269 0.0346 -0.0057 15 PRO B N 2446 C CA . PRO B 15 ? 0.7621 0.6596 0.5907 0.0137 0.0400 -0.0051 15 PRO B CA 2447 C C . PRO B 15 ? 0.7905 0.6930 0.6026 0.0157 0.0411 0.0131 15 PRO B C 2448 O O . PRO B 15 ? 0.7858 0.7269 0.5945 0.0116 0.0394 0.0165 15 PRO B O 2449 C CB . PRO B 15 ? 0.7365 0.6511 0.5745 -0.0052 0.0425 -0.0210 15 PRO B CB 2450 C CG . PRO B 15 ? 0.7152 0.6437 0.5635 -0.0032 0.0382 -0.0323 15 PRO B CG 2451 C CD . PRO B 15 ? 0.7187 0.6702 0.5633 0.0116 0.0327 -0.0204 15 PRO B CD 2452 N N . GLU B 16 ? 0.8279 0.6891 0.6262 0.0203 0.0434 0.0253 16 GLU B N 2453 C CA . GLU B 16 ? 0.8625 0.7211 0.6423 0.0208 0.0450 0.0455 16 GLU B CA 2454 C C . GLU B 16 ? 0.8858 0.7084 0.6581 0.0006 0.0499 0.0490 16 GLU B C 2455 O O . GLU B 16 ? 0.9098 0.6845 0.6760 -0.0016 0.0501 0.0472 16 GLU B O 2456 C CB . GLU B 16 ? 0.9009 0.7424 0.6622 0.0503 0.0421 0.0645 16 GLU B CB 2457 C CG . GLU B 16 ? 0.8886 0.7884 0.6552 0.0681 0.0373 0.0697 16 GLU B CG 2458 C CD . GLU B 16 ? 0.9355 0.8253 0.6838 0.1048 0.0356 0.0902 16 GLU B CD 2459 O OE1 . GLU B 16 ? 0.9826 0.8329 0.7064 0.1141 0.0378 0.1091 16 GLU B OE1 2460 O OE2 . GLU B 16 ? 0.9229 0.8455 0.6791 0.1256 0.0323 0.0887 16 GLU B OE2 2461 N N . ASN B 17 ? 0.8823 0.7318 0.6533 -0.0160 0.0537 0.0536 17 ASN B N 2462 C CA . ASN B 17 ? 0.9038 0.7351 0.6687 -0.0384 0.0588 0.0600 17 ASN B CA 2463 C C . ASN B 17 ? 0.9642 0.7379 0.7022 -0.0363 0.0577 0.0816 17 ASN B C 2464 O O . ASN B 17 ? 0.9942 0.7620 0.7132 -0.0207 0.0562 0.1010 17 ASN B O 2465 C CB . ASN B 17 ? 0.8938 0.7721 0.6589 -0.0516 0.0637 0.0632 17 ASN B CB 2466 C CG . ASN B 17 ? 0.8494 0.7691 0.6323 -0.0545 0.0659 0.0398 17 ASN B CG 2467 O OD1 . ASN B 17 ? 0.8304 0.7452 0.6288 -0.0584 0.0672 0.0236 17 ASN B OD1 2468 N ND2 . ASN B 17 ? 0.8393 0.7966 0.6158 -0.0526 0.0663 0.0382 17 ASN B ND2 2469 N N . GLY B 18 ? 0.9866 0.7156 0.7197 -0.0521 0.0580 0.0785 18 GLY B N 2470 C CA . GLY B 18 ? 1.0565 0.7150 0.7559 -0.0563 0.0566 0.0970 18 GLY B CA 2471 C C . GLY B 18 ? 1.0897 0.6873 0.7709 -0.0310 0.0523 0.0935 18 GLY B C 2472 O O . GLY B 18 ? 1.1573 0.6803 0.8052 -0.0363 0.0510 0.1030 18 GLY B O 2473 N N . LYS B 19 ? 1.0468 0.6745 0.7464 -0.0044 0.0502 0.0799 19 LYS B N 2474 C CA . LYS B 19 ? 1.0730 0.6567 0.7570 0.0258 0.0471 0.0759 19 LYS B CA 2475 C C . LYS B 19 ? 1.0498 0.6219 0.7478 0.0170 0.0456 0.0517 19 LYS B C 2476 O O . LYS B 19 ? 0.9880 0.6137 0.7193 0.0051 0.0460 0.0360 19 LYS B O 2477 C CB . LYS B 19 ? 1.0477 0.6798 0.7410 0.0613 0.0454 0.0801 19 LYS B CB 2478 N N . PRO B 20 ? 1.1059 0.6039 0.7743 0.0238 0.0439 0.0487 20 PRO B N 2479 C CA . PRO B 20 ? 1.0926 0.5762 0.7687 0.0163 0.0419 0.0262 20 PRO B CA 2480 C C . PRO B 20 ? 1.0321 0.5704 0.7375 0.0409 0.0409 0.0117 20 PRO B C 2481 O O . PRO B 20 ? 1.0289 0.5885 0.7330 0.0739 0.0409 0.0194 20 PRO B O 2482 C CB . PRO B 20 ? 1.1826 0.5685 0.8090 0.0283 0.0403 0.0286 20 PRO B CB 2483 C CG . PRO B 20 ? 1.2448 0.5863 0.8387 0.0212 0.0415 0.0531 20 PRO B CG 2484 C CD . PRO B 20 ? 1.1958 0.6112 0.8149 0.0363 0.0438 0.0670 20 PRO B CD 2485 N N . ASN B 21 ? 0.9863 0.5507 0.7171 0.0236 0.0399 -0.0070 21 ASN B N 2486 C CA . ASN B 21 ? 0.9255 0.5442 0.6855 0.0384 0.0389 -0.0200 21 ASN B CA 2487 C C . ASN B 21 ? 0.9133 0.5236 0.6819 0.0259 0.0370 -0.0392 21 ASN B C 2488 O O . ASN B 21 ? 0.9530 0.5152 0.7026 0.0069 0.0360 -0.0430 21 ASN B O 2489 C CB . ASN B 21 ? 0.8665 0.5533 0.6568 0.0271 0.0403 -0.0186 21 ASN B CB 2490 C CG . ASN B 21 ? 0.8250 0.5631 0.6334 0.0466 0.0385 -0.0222 21 ASN B CG 2491 O OD1 . ASN B 21 ? 0.8098 0.5520 0.6236 0.0594 0.0365 -0.0320 21 ASN B OD1 2492 N ND2 . ASN B 21 ? 0.8044 0.5847 0.6203 0.0457 0.0387 -0.0141 21 ASN B ND2 2493 N N . ILE B 22 ? 0.8625 0.5200 0.6571 0.0344 0.0360 -0.0501 22 ILE B N 2494 C CA . ILE B 22 ? 0.8434 0.5061 0.6503 0.0237 0.0342 -0.0669 22 ILE B CA 2495 C C . ILE B 22 ? 0.7809 0.5051 0.6225 0.0141 0.0349 -0.0719 22 ILE B C 2496 O O . ILE B 22 ? 0.7526 0.5128 0.6057 0.0270 0.0348 -0.0688 22 ILE B O 2497 C CB . ILE B 22 ? 0.8604 0.5073 0.6552 0.0503 0.0323 -0.0755 22 ILE B CB 2498 C CG1 . ILE B 22 ? 0.9381 0.5119 0.6895 0.0660 0.0324 -0.0719 22 ILE B CG1 2499 C CG2 . ILE B 22 ? 0.8378 0.4948 0.6451 0.0378 0.0300 -0.0921 22 ILE B CG2 2500 C CD1 . ILE B 22 ? 0.9650 0.5288 0.6999 0.1042 0.0326 -0.0770 22 ILE B CD1 2501 N N . LEU B 23 ? 0.7658 0.5009 0.6204 -0.0086 0.0355 -0.0788 23 LEU B N 2502 C CA . LEU B 23 ? 0.7187 0.5019 0.5998 -0.0141 0.0370 -0.0836 23 LEU B CA 2503 C C . LEU B 23 ? 0.7004 0.4965 0.5933 -0.0103 0.0344 -0.0953 23 LEU B C 2504 O O . LEU B 23 ? 0.7195 0.4976 0.6063 -0.0183 0.0322 -0.1018 23 LEU B O 2505 C CB . LEU B 23 ? 0.7145 0.5130 0.6032 -0.0357 0.0407 -0.0812 23 LEU B CB 2506 C CG . LEU B 23 ? 0.6766 0.5175 0.5843 -0.0360 0.0445 -0.0842 23 LEU B CG 2507 C CD1 . LEU B 23 ? 0.6664 0.5167 0.5699 -0.0276 0.0464 -0.0790 23 LEU B CD1 2508 C CD2 . LEU B 23 ? 0.6811 0.5424 0.5956 -0.0537 0.0487 -0.0822 23 LEU B CD2 2509 N N . ASN B 24 ? 0.6683 0.4945 0.5749 -0.0007 0.0340 -0.0972 24 ASN B N 2510 C CA . ASN B 24 ? 0.6526 0.4938 0.5694 0.0040 0.0315 -0.1053 24 ASN B CA 2511 C C . ASN B 24 ? 0.6293 0.4970 0.5626 -0.0032 0.0333 -0.1082 24 ASN B C 2512 O O . ASN B 24 ? 0.6185 0.4972 0.5544 -0.0040 0.0360 -0.1051 24 ASN B O 2513 C CB . ASN B 24 ? 0.6443 0.4987 0.5600 0.0206 0.0291 -0.1031 24 ASN B CB 2514 C CG . ASN B 24 ? 0.6768 0.5096 0.5743 0.0370 0.0282 -0.0998 24 ASN B CG 2515 O OD1 . ASN B 24 ? 0.7121 0.5097 0.5942 0.0381 0.0280 -0.1043 24 ASN B OD1 2516 N ND2 . ASN B 24 ? 0.6774 0.5310 0.5735 0.0503 0.0276 -0.0915 24 ASN B ND2 2517 N N . CYS B 25 ? 0.6265 0.5027 0.5674 -0.0070 0.0318 -0.1143 25 CYS B N 2518 C CA . CYS B 25 ? 0.6070 0.5092 0.5618 -0.0065 0.0333 -0.1157 25 CYS B CA 2519 C C . CYS B 25 ? 0.5953 0.5065 0.5538 0.0018 0.0294 -0.1187 25 CYS B C 2520 O O . CYS B 25 ? 0.6026 0.5143 0.5604 0.0006 0.0262 -0.1239 25 CYS B O 2521 C CB . CYS B 25 ? 0.6099 0.5293 0.5726 -0.0176 0.0352 -0.1167 25 CYS B CB 2522 S SG . CYS B 25 ? 0.6033 0.5566 0.5798 -0.0077 0.0389 -0.1155 25 CYS B SG 2523 N N . TYR B 26 ? 0.5839 0.5012 0.5431 0.0079 0.0295 -0.1153 26 TYR B N 2524 C CA . TYR B 26 ? 0.5740 0.5025 0.5354 0.0137 0.0259 -0.1148 26 TYR B CA 2525 C C . TYR B 26 ? 0.5685 0.5060 0.5348 0.0157 0.0271 -0.1127 26 TYR B C 2526 O O . TYR B 26 ? 0.5742 0.5010 0.5335 0.0159 0.0293 -0.1094 26 TYR B O 2527 C CB . TYR B 26 ? 0.5740 0.5034 0.5282 0.0155 0.0239 -0.1096 26 TYR B CB 2528 C CG . TYR B 26 ? 0.5691 0.5175 0.5246 0.0189 0.0202 -0.1066 26 TYR B CG 2529 C CD1 . TYR B 26 ? 0.5672 0.5269 0.5259 0.0259 0.0183 -0.1109 26 TYR B CD1 2530 C CD2 . TYR B 26 ? 0.5689 0.5246 0.5193 0.0123 0.0182 -0.0991 26 TYR B CD2 2531 C CE1 . TYR B 26 ? 0.5631 0.5468 0.5228 0.0294 0.0155 -0.1070 26 TYR B CE1 2532 C CE2 . TYR B 26 ? 0.5642 0.5428 0.5155 0.0118 0.0147 -0.0936 26 TYR B CE2 2533 C CZ . TYR B 26 ? 0.5593 0.5546 0.5166 0.0219 0.0139 -0.0971 26 TYR B CZ 2534 O OH . TYR B 26 ? 0.5636 0.5878 0.5217 0.0219 0.0110 -0.0907 26 TYR B OH 2535 N N . VAL B 27 ? 0.5619 0.5161 0.5364 0.0180 0.0256 -0.1148 27 VAL B N 2536 C CA . VAL B 27 ? 0.5595 0.5256 0.5383 0.0248 0.0271 -0.1108 27 VAL B CA 2537 C C . VAL B 27 ? 0.5567 0.5296 0.5338 0.0287 0.0232 -0.1062 27 VAL B C 2538 O O . VAL B 27 ? 0.5523 0.5408 0.5331 0.0277 0.0193 -0.1091 27 VAL B O 2539 C CB . VAL B 27 ? 0.5567 0.5494 0.5470 0.0240 0.0279 -0.1132 27 VAL B CB 2540 C CG1 . VAL B 27 ? 0.5608 0.5690 0.5542 0.0375 0.0313 -0.1066 27 VAL B CG1 2541 C CG2 . VAL B 27 ? 0.5607 0.5509 0.5519 0.0139 0.0307 -0.1165 27 VAL B CG2 2542 N N . THR B 28 ? 0.5646 0.5227 0.5320 0.0326 0.0242 -0.0989 28 THR B N 2543 C CA . THR B 28 ? 0.5660 0.5261 0.5275 0.0316 0.0202 -0.0912 28 THR B CA 2544 C C . THR B 28 ? 0.5849 0.5338 0.5375 0.0412 0.0216 -0.0823 28 THR B C 2545 O O . THR B 28 ? 0.5986 0.5336 0.5463 0.0521 0.0265 -0.0825 28 THR B O 2546 C CB . THR B 28 ? 0.5753 0.5203 0.5242 0.0195 0.0180 -0.0875 28 THR B CB 2547 O OG1 . THR B 28 ? 0.5919 0.5031 0.5253 0.0162 0.0211 -0.0877 28 THR B OG1 2548 C CG2 . THR B 28 ? 0.5572 0.5189 0.5132 0.0161 0.0165 -0.0929 28 THR B CG2 2549 N N . GLN B 29 ? 0.5876 0.5430 0.5359 0.0392 0.0176 -0.0734 29 GLN B N 2550 C CA . GLN B 29 ? 0.6159 0.5502 0.5483 0.0472 0.0180 -0.0612 29 GLN B CA 2551 C C . GLN B 29 ? 0.6147 0.5684 0.5555 0.0682 0.0207 -0.0584 29 GLN B C 2552 O O . GLN B 29 ? 0.6471 0.5757 0.5712 0.0829 0.0233 -0.0487 29 GLN B O 2553 C CB . GLN B 29 ? 0.6573 0.5352 0.5612 0.0431 0.0204 -0.0588 29 GLN B CB 2554 C CG . GLN B 29 ? 0.6671 0.5308 0.5589 0.0182 0.0162 -0.0582 29 GLN B CG 2555 C CD . GLN B 29 ? 0.6679 0.5558 0.5608 0.0041 0.0101 -0.0472 29 GLN B CD 2556 O OE1 . GLN B 29 ? 0.6474 0.5703 0.5531 -0.0065 0.0071 -0.0492 29 GLN B OE1 2557 N NE2 . GLN B 29 ? 0.6944 0.5661 0.5725 0.0063 0.0086 -0.0341 29 GLN B NE2 2558 N N . PHE B 30 ? 0.5824 0.5802 0.5459 0.0696 0.0200 -0.0662 30 PHE B N 2559 C CA . PHE B 30 ? 0.5772 0.6094 0.5520 0.0857 0.0215 -0.0631 30 PHE B CA 2560 C C . PHE B 30 ? 0.5682 0.6400 0.5512 0.0870 0.0161 -0.0571 30 PHE B C 2561 O O . PHE B 30 ? 0.5557 0.6360 0.5399 0.0744 0.0115 -0.0599 30 PHE B O 2562 C CB . PHE B 30 ? 0.5563 0.6143 0.5471 0.0824 0.0239 -0.0741 30 PHE B CB 2563 C CG . PHE B 30 ? 0.5299 0.6057 0.5313 0.0633 0.0192 -0.0859 30 PHE B CG 2564 C CD1 . PHE B 30 ? 0.5194 0.5674 0.5157 0.0510 0.0194 -0.0940 30 PHE B CD1 2565 C CD2 . PHE B 30 ? 0.5168 0.6350 0.5289 0.0587 0.0145 -0.0891 30 PHE B CD2 2566 C CE1 . PHE B 30 ? 0.5117 0.5667 0.5112 0.0387 0.0158 -0.1046 30 PHE B CE1 2567 C CE2 . PHE B 30 ? 0.5060 0.6278 0.5188 0.0423 0.0104 -0.1021 30 PHE B CE2 2568 C CZ . PHE B 30 ? 0.5073 0.5939 0.5125 0.0344 0.0115 -0.1096 30 PHE B CZ 2569 N N . HIS B 31 ? 0.5766 0.6774 0.5642 0.1049 0.0172 -0.0483 31 HIS B N 2570 C CA . HIS B 31 ? 0.5719 0.7160 0.5660 0.1095 0.0123 -0.0401 31 HIS B CA 2571 C C . HIS B 31 ? 0.5826 0.7641 0.5838 0.1324 0.0151 -0.0307 31 HIS B C 2572 O O . HIS B 31 ? 0.6088 0.7618 0.5972 0.1542 0.0214 -0.0218 31 HIS B O 2573 C CB . HIS B 31 ? 0.5923 0.7085 0.5681 0.1119 0.0103 -0.0253 31 HIS B CB 2574 C CG . HIS B 31 ? 0.5831 0.7450 0.5646 0.1118 0.0046 -0.0180 31 HIS B CG 2575 N ND1 . HIS B 31 ? 0.5679 0.7406 0.5491 0.0951 0.0000 -0.0217 31 HIS B ND1 2576 C CD2 . HIS B 31 ? 0.5826 0.7874 0.5692 0.1279 0.0029 -0.0064 31 HIS B CD2 2577 C CE1 . HIS B 31 ? 0.5607 0.7779 0.5454 0.0996 -0.0041 -0.0141 31 HIS B CE1 2578 N NE2 . HIS B 31 ? 0.5706 0.8083 0.5590 0.1184 -0.0029 -0.0044 31 HIS B NE2 2579 N N . PRO B 32 ? 0.5682 0.8153 0.5871 0.1286 0.0106 -0.0327 32 PRO B N 2580 C CA . PRO B 32 ? 0.5500 0.8328 0.5783 0.1055 0.0030 -0.0449 32 PRO B CA 2581 C C . PRO B 32 ? 0.5388 0.8056 0.5705 0.0815 0.0024 -0.0653 32 PRO B C 2582 O O . PRO B 32 ? 0.5396 0.7846 0.5725 0.0817 0.0076 -0.0686 32 PRO B O 2583 C CB . PRO B 32 ? 0.5481 0.9049 0.5903 0.1115 -0.0002 -0.0390 32 PRO B CB 2584 C CG . PRO B 32 ? 0.5676 0.9278 0.6064 0.1449 0.0055 -0.0184 32 PRO B CG 2585 C CD . PRO B 32 ? 0.5781 0.8735 0.6054 0.1519 0.0134 -0.0210 32 PRO B CD 2586 N N . PRO B 33 ? 0.5357 0.8109 0.5652 0.0629 -0.0034 -0.0786 33 PRO B N 2587 C CA . PRO B 33 ? 0.5370 0.7832 0.5620 0.0436 -0.0038 -0.0968 33 PRO B CA 2588 C C . PRO B 33 ? 0.5437 0.8049 0.5758 0.0294 -0.0036 -0.1043 33 PRO B C 2589 O O . PRO B 33 ? 0.5471 0.7723 0.5746 0.0193 -0.0010 -0.1128 33 PRO B O 2590 C CB . PRO B 33 ? 0.5417 0.7981 0.5571 0.0334 -0.0100 -0.1083 33 PRO B CB 2591 C CG . PRO B 33 ? 0.5377 0.8482 0.5587 0.0396 -0.0143 -0.0987 33 PRO B CG 2592 C CD . PRO B 33 ? 0.5363 0.8456 0.5631 0.0617 -0.0096 -0.0772 33 PRO B CD 2593 N N . HIS B 34 ? 0.5494 0.8683 0.5923 0.0275 -0.0064 -0.0992 34 HIS B N 2594 C CA . HIS B 34 ? 0.5588 0.9056 0.6088 0.0082 -0.0073 -0.1042 34 HIS B CA 2595 C C . HIS B 34 ? 0.5572 0.8828 0.6124 0.0162 0.0011 -0.0990 34 HIS B C 2596 O O . HIS B 34 ? 0.5563 0.8890 0.6173 0.0427 0.0074 -0.0854 34 HIS B O 2597 C CB . HIS B 34 ? 0.5608 0.9886 0.6240 0.0075 -0.0115 -0.0951 34 HIS B CB 2598 C CG . HIS B 34 ? 0.5767 1.0455 0.6476 -0.0176 -0.0134 -0.0980 34 HIS B CG 2599 N ND1 . HIS B 34 ? 0.6037 1.0708 0.6625 -0.0562 -0.0215 -0.1140 34 HIS B ND1 2600 C CD2 . HIS B 34 ? 0.5816 1.0947 0.6683 -0.0109 -0.0080 -0.0862 34 HIS B CD2 2601 C CE1 . HIS B 34 ? 0.6158 1.1255 0.6835 -0.0771 -0.0219 -0.1105 34 HIS B CE1 2602 N NE2 . HIS B 34 ? 0.5968 1.1412 0.6837 -0.0489 -0.0135 -0.0934 34 HIS B NE2 2603 N N . ILE B 35 ? 0.5653 0.8615 0.6143 -0.0058 0.0012 -0.1100 35 ILE B N 2604 C CA . ILE B 35 ? 0.5634 0.8346 0.6142 -0.0011 0.0090 -0.1070 35 ILE B CA 2605 C C . ILE B 35 ? 0.5757 0.8453 0.6232 -0.0322 0.0073 -0.1147 35 ILE B C 2606 O O . ILE B 35 ? 0.5933 0.8434 0.6271 -0.0568 0.0005 -0.1267 35 ILE B O 2607 C CB . ILE B 35 ? 0.5609 0.7663 0.6000 0.0124 0.0129 -0.1088 35 ILE B CB 2608 C CG1 . ILE B 35 ? 0.5634 0.7535 0.6037 0.0290 0.0218 -0.1013 35 ILE B CG1 2609 C CG2 . ILE B 35 ? 0.5681 0.7273 0.5927 -0.0061 0.0096 -0.1223 35 ILE B CG2 2610 C CD1 . ILE B 35 ? 0.5649 0.7047 0.5930 0.0447 0.0246 -0.0989 35 ILE B CD1 2611 N N . GLU B 36 ? 0.5741 0.8618 0.6301 -0.0309 0.0138 -0.1074 36 GLU B N 2612 C CA . GLU B 36 ? 0.5890 0.8715 0.6402 -0.0614 0.0131 -0.1113 36 GLU B CA 2613 C C . GLU B 36 ? 0.5891 0.8202 0.6332 -0.0529 0.0205 -0.1110 36 GLU B C 2614 O O . GLU B 36 ? 0.5795 0.8188 0.6306 -0.0278 0.0286 -0.1034 36 GLU B O 2615 C CB . GLU B 36 ? 0.5895 0.9535 0.6574 -0.0732 0.0139 -0.1012 36 GLU B CB 2616 N N . ILE B 37 ? 0.6065 0.7824 0.6331 -0.0720 0.0177 -0.1196 37 ILE B N 2617 C CA . ILE B 37 ? 0.6079 0.7365 0.6262 -0.0650 0.0236 -0.1188 37 ILE B CA 2618 C C . ILE B 37 ? 0.6329 0.7481 0.6413 -0.0940 0.0233 -0.1181 37 ILE B C 2619 O O . ILE B 37 ? 0.6633 0.7513 0.6546 -0.1192 0.0166 -0.1249 37 ILE B O 2620 C CB . ILE B 37 ? 0.6068 0.6776 0.6112 -0.0522 0.0218 -0.1258 37 ILE B CB 2621 C CG1 . ILE B 37 ? 0.5861 0.6688 0.5984 -0.0268 0.0225 -0.1232 37 ILE B CG1 2622 C CG2 . ILE B 37 ? 0.6099 0.6397 0.6052 -0.0479 0.0266 -0.1238 37 ILE B CG2 2623 C CD1 . ILE B 37 ? 0.5898 0.6370 0.5909 -0.0197 0.0189 -0.1292 37 ILE B CD1 2624 N N . GLN B 38 ? 0.6288 0.7590 0.6435 -0.0901 0.0308 -0.1097 38 GLN B N 2625 C CA . GLN B 38 ? 0.6527 0.7723 0.6578 -0.1168 0.0317 -0.1054 38 GLN B CA 2626 C C . GLN B 38 ? 0.6501 0.7282 0.6466 -0.1026 0.0378 -0.1031 38 GLN B C 2627 O O . GLN B 38 ? 0.6303 0.7181 0.6347 -0.0759 0.0442 -0.1013 38 GLN B O 2628 C CB . GLN B 38 ? 0.6511 0.8465 0.6727 -0.1295 0.0354 -0.0948 38 GLN B CB 2629 C CG . GLN B 38 ? 0.6652 0.9155 0.6948 -0.1530 0.0283 -0.0942 38 GLN B CG 2630 C CD . GLN B 38 ? 0.6690 1.0104 0.7181 -0.1624 0.0329 -0.0807 38 GLN B CD 2631 O OE1 . GLN B 38 ? 0.6592 1.0224 0.7159 -0.1451 0.0428 -0.0727 38 GLN B OE1 2632 N NE2 . GLN B 38 ? 0.6813 1.0816 0.7373 -0.1898 0.0258 -0.0779 38 GLN B NE2 2633 N N . MET B 39 ? 0.6759 0.7052 0.6525 -0.1208 0.0354 -0.1030 39 MET B N 2634 C CA . MET B 39 ? 0.6780 0.6785 0.6461 -0.1127 0.0408 -0.0977 39 MET B CA 2635 C C . MET B 39 ? 0.6956 0.7193 0.6617 -0.1380 0.0441 -0.0868 39 MET B C 2636 O O . MET B 39 ? 0.7262 0.7465 0.6823 -0.1704 0.0390 -0.0843 39 MET B O 2637 C CB . MET B 39 ? 0.6991 0.6308 0.6447 -0.1086 0.0367 -0.1020 39 MET B CB 2638 C CG . MET B 39 ? 0.6856 0.6038 0.6339 -0.0833 0.0344 -0.1105 39 MET B CG 2639 S SD . MET B 39 ? 0.7224 0.5755 0.6454 -0.0720 0.0310 -0.1135 39 MET B SD 2640 C CE . MET B 39 ? 0.7065 0.5607 0.6316 -0.0571 0.0369 -0.1044 39 MET B CE 2641 N N . LEU B 40 ? 0.6813 0.7287 0.6541 -0.1251 0.0524 -0.0803 40 LEU B N 2642 C CA . LEU B 40 ? 0.6920 0.7802 0.6673 -0.1455 0.0573 -0.0683 40 LEU B CA 2643 C C . LEU B 40 ? 0.7080 0.7640 0.6675 -0.1470 0.0612 -0.0609 40 LEU B C 2644 O O . LEU B 40 ? 0.6958 0.7275 0.6512 -0.1220 0.0641 -0.0648 40 LEU B O 2645 C CB . LEU B 40 ? 0.6662 0.8301 0.6632 -0.1268 0.0657 -0.0657 40 LEU B CB 2646 C CG . LEU B 40 ? 0.6463 0.8488 0.6604 -0.1122 0.0638 -0.0711 40 LEU B CG 2647 C CD1 . LEU B 40 ? 0.6321 0.8813 0.6577 -0.0765 0.0742 -0.0699 40 LEU B CD1 2648 C CD2 . LEU B 40 ? 0.6567 0.9061 0.6789 -0.1453 0.0577 -0.0661 40 LEU B CD2 2649 N N . LYS B 41 ? 0.7397 0.7972 0.6885 -0.1795 0.0605 -0.0491 41 LYS B N 2650 C CA . LYS B 41 ? 0.7561 0.7995 0.6915 -0.1836 0.0652 -0.0379 41 LYS B CA 2651 C C . LYS B 41 ? 0.7551 0.8744 0.7025 -0.1987 0.0727 -0.0257 41 LYS B C 2652 O O . LYS B 41 ? 0.7749 0.9247 0.7238 -0.2333 0.0697 -0.0172 41 LYS B O 2653 C CB . LYS B 41 ? 0.8050 0.7765 0.7107 -0.2076 0.0585 -0.0310 41 LYS B CB 2654 C CG . LYS B 41 ? 0.8267 0.7828 0.7167 -0.2111 0.0629 -0.0164 41 LYS B CG 2655 C CD . LYS B 41 ? 0.8896 0.7689 0.7450 -0.2334 0.0565 -0.0070 41 LYS B CD 2656 C CE . LYS B 41 ? 0.9153 0.7858 0.7550 -0.2379 0.0609 0.0110 41 LYS B CE 2657 N NZ . LYS B 41 ? 0.9904 0.7845 0.7915 -0.2629 0.0552 0.0241 41 LYS B NZ 2658 N N . ASN B 42 ? 0.7359 0.8875 0.6896 -0.1734 0.0823 -0.0252 42 ASN B N 2659 C CA . ASN B 42 ? 0.7325 0.9645 0.6974 -0.1771 0.0920 -0.0150 42 ASN B CA 2660 C C . ASN B 42 ? 0.7181 1.0259 0.7065 -0.1766 0.0937 -0.0156 42 ASN B C 2661 O O . ASN B 42 ? 0.7251 1.1061 0.7230 -0.1970 0.0978 -0.0024 42 ASN B O 2662 C CB . ASN B 42 ? 0.7661 1.0012 0.7171 -0.2152 0.0919 0.0040 42 ASN B CB 2663 C CG . ASN B 42 ? 0.7807 0.9571 0.7094 -0.2086 0.0925 0.0078 42 ASN B CG 2664 O OD1 . ASN B 42 ? 0.7608 0.9405 0.6889 -0.1775 0.0988 0.0009 42 ASN B OD1 2665 N ND2 . ASN B 42 ? 0.8229 0.9435 0.7297 -0.2381 0.0855 0.0192 42 ASN B ND2 2666 N N . GLY B 43 ? 0.6995 0.9945 0.6969 -0.1532 0.0904 -0.0292 43 GLY B N 2667 C CA . GLY B 43 ? 0.6879 1.0528 0.7069 -0.1462 0.0914 -0.0296 43 GLY B CA 2668 C C . GLY B 43 ? 0.7026 1.0753 0.7256 -0.1848 0.0803 -0.0266 43 GLY B C 2669 O O . GLY B 43 ? 0.6883 1.1098 0.7281 -0.1786 0.0783 -0.0287 43 GLY B O 2670 N N . LYS B 44 ? 0.7383 1.0601 0.7418 -0.2245 0.0728 -0.0215 44 LYS B N 2671 C CA . LYS B 44 ? 0.7686 1.0821 0.7651 -0.2675 0.0613 -0.0203 44 LYS B CA 2672 C C . LYS B 44 ? 0.7769 1.0043 0.7583 -0.2598 0.0521 -0.0364 44 LYS B C 2673 O O . LYS B 44 ? 0.7773 0.9339 0.7445 -0.2382 0.0528 -0.0426 44 LYS B O 2674 C CB . LYS B 44 ? 0.8158 1.1128 0.7909 -0.3175 0.0581 -0.0053 44 LYS B CB 2675 C CG . LYS B 44 ? 0.8145 1.2122 0.8050 -0.3355 0.0659 0.0133 44 LYS B CG 2676 N N . LYS B 45 ? 0.7864 1.0275 0.7703 -0.2776 0.0436 -0.0424 45 LYS B N 2677 C CA . LYS B 45 ? 0.7960 0.9671 0.7655 -0.2701 0.0352 -0.0583 45 LYS B CA 2678 C C . LYS B 45 ? 0.8492 0.9195 0.7804 -0.2909 0.0294 -0.0604 45 LYS B C 2679 O O . LYS B 45 ? 0.8983 0.9539 0.8087 -0.3337 0.0255 -0.0512 45 LYS B O 2680 C CB . LYS B 45 ? 0.7988 1.0147 0.7760 -0.2910 0.0269 -0.0631 45 LYS B CB 2681 C CG . LYS B 45 ? 0.7989 0.9636 0.7668 -0.2749 0.0200 -0.0802 45 LYS B CG 2682 N N . ILE B 46 ? 0.8454 0.8474 0.7651 -0.2598 0.0290 -0.0709 46 ILE B N 2683 C CA . ILE B 46 ? 0.8989 0.8035 0.7798 -0.2689 0.0240 -0.0737 46 ILE B CA 2684 C C . ILE B 46 ? 0.9386 0.8048 0.7972 -0.2886 0.0139 -0.0872 46 ILE B C 2685 O O . ILE B 46 ? 0.9099 0.7894 0.7808 -0.2670 0.0118 -0.0999 46 ILE B O 2686 C CB . ILE B 46 ? 0.8797 0.7377 0.7571 -0.2258 0.0282 -0.0775 46 ILE B CB 2687 C CG1 . ILE B 46 ? 0.8460 0.7411 0.7408 -0.2097 0.0374 -0.0661 46 ILE B CG1 2688 C CG2 . ILE B 46 ? 0.9395 0.7013 0.7750 -0.2290 0.0239 -0.0783 46 ILE B CG2 2689 C CD1 . ILE B 46 ? 0.8091 0.6861 0.7091 -0.1688 0.0411 -0.0708 46 ILE B CD1 2690 N N . PRO B 47 ? 1.0109 0.8274 0.8329 -0.3318 0.0073 -0.0844 47 PRO B N 2691 C CA . PRO B 47 ? 1.0621 0.8381 0.8548 -0.3575 -0.0030 -0.0988 47 PRO B CA 2692 C C . PRO B 47 ? 1.0867 0.7766 0.8511 -0.3248 -0.0050 -0.1153 47 PRO B C 2693 O O . PRO B 47 ? 1.0915 0.7789 0.8503 -0.3228 -0.0106 -0.1313 47 PRO B O 2694 C CB . PRO B 47 ? 1.1430 0.8740 0.8959 -0.4134 -0.0087 -0.0891 47 PRO B CB 2695 C CG . PRO B 47 ? 1.1178 0.9014 0.8929 -0.4202 -0.0009 -0.0672 47 PRO B CG 2696 C CD . PRO B 47 ? 1.0534 0.8497 0.8562 -0.3628 0.0088 -0.0669 47 PRO B CD 2697 N N . LYS B 48 ? 1.1042 0.7310 0.8507 -0.2980 -0.0003 -0.1104 48 LYS B N 2698 C CA . LYS B 48 ? 1.1324 0.6839 0.8506 -0.2628 -0.0010 -0.1233 48 LYS B CA 2699 C C . LYS B 48 ? 1.0564 0.6541 0.8124 -0.2131 0.0049 -0.1263 48 LYS B C 2700 O O . LYS B 48 ? 1.0404 0.6267 0.8006 -0.1838 0.0106 -0.1179 48 LYS B O 2701 C CB . LYS B 48 ? 1.2050 0.6608 0.8770 -0.2595 0.0001 -0.1148 48 LYS B CB 2702 N N . VAL B 49 ? 1.0122 0.6639 0.7937 -0.2066 0.0029 -0.1370 49 VAL B N 2703 C CA . VAL B 49 ? 0.9456 0.6380 0.7587 -0.1655 0.0073 -0.1397 49 VAL B CA 2704 C C . VAL B 49 ? 0.9576 0.6294 0.7566 -0.1498 0.0030 -0.1566 49 VAL B C 2705 O O . VAL B 49 ? 0.9680 0.6577 0.7644 -0.1705 -0.0027 -0.1663 49 VAL B O 2706 C CB . VAL B 49 ? 0.8783 0.6621 0.7377 -0.1656 0.0107 -0.1331 49 VAL B CB 2707 C CG1 . VAL B 49 ? 0.8241 0.6394 0.7076 -0.1298 0.0131 -0.1376 49 VAL B CG1 2708 C CG2 . VAL B 49 ? 0.8621 0.6679 0.7347 -0.1695 0.0171 -0.1175 49 VAL B CG2 2709 N N . GLU B 50 ? 0.9578 0.5978 0.7467 -0.1134 0.0058 -0.1593 50 GLU B N 2710 C CA . GLU B 50 ? 0.9662 0.5931 0.7421 -0.0922 0.0035 -0.1741 50 GLU B CA 2711 C C . GLU B 50 ? 0.8919 0.5894 0.7084 -0.0698 0.0058 -0.1724 50 GLU B C 2712 O O . GLU B 50 ? 0.8483 0.5764 0.6902 -0.0550 0.0106 -0.1610 50 GLU B O 2713 C CB . GLU B 50 ? 1.0170 0.5741 0.7553 -0.0628 0.0057 -0.1768 50 GLU B CB 2714 N N . MET B 51 ? 0.8858 0.6052 0.7039 -0.0697 0.0019 -0.1839 51 MET B N 2715 C CA . MET B 51 ? 0.8257 0.6080 0.6775 -0.0527 0.0031 -0.1813 51 MET B CA 2716 C C . MET B 51 ? 0.8343 0.6057 0.6711 -0.0258 0.0028 -0.1908 51 MET B C 2717 O O . MET B 51 ? 0.8844 0.6154 0.6872 -0.0278 -0.0004 -0.2052 51 MET B O 2718 C CB . MET B 51 ? 0.8095 0.6422 0.6791 -0.0757 -0.0011 -0.1832 51 MET B CB 2719 C CG . MET B 51 ? 0.7537 0.6514 0.6615 -0.0629 0.0015 -0.1730 51 MET B CG 2720 S SD . MET B 51 ? 0.7374 0.6650 0.6712 -0.0695 0.0071 -0.1573 51 MET B SD 2721 C CE . MET B 51 ? 0.7630 0.7143 0.6945 -0.1078 0.0026 -0.1584 51 MET B CE 2722 N N . SER B 52 ? 0.7885 0.5957 0.6475 -0.0020 0.0062 -0.1828 52 SER B N 2723 C CA . SER B 52 ? 0.7881 0.6047 0.6391 0.0230 0.0065 -0.1885 52 SER B CA 2724 C C . SER B 52 ? 0.7679 0.6277 0.6308 0.0161 0.0026 -0.1939 52 SER B C 2725 O O . SER B 52 ? 0.7458 0.6350 0.6281 -0.0035 0.0003 -0.1901 52 SER B O 2726 C CB . SER B 52 ? 0.7525 0.5970 0.6216 0.0451 0.0107 -0.1752 52 SER B CB 2727 O OG . SER B 52 ? 0.7009 0.5932 0.6019 0.0377 0.0107 -0.1650 52 SER B OG 2728 N N . ASP B 53 ? 0.7765 0.6451 0.6272 0.0347 0.0023 -0.2015 53 ASP B N 2729 C CA . ASP B 53 ? 0.7559 0.6709 0.6177 0.0314 -0.0010 -0.2042 53 ASP B CA 2730 C C . ASP B 53 ? 0.6996 0.6673 0.5977 0.0343 0.0004 -0.1862 53 ASP B C 2731 O O . ASP B 53 ? 0.6792 0.6530 0.5868 0.0474 0.0042 -0.1751 53 ASP B O 2732 C CB . ASP B 53 ? 0.7821 0.6960 0.6196 0.0530 -0.0007 -0.2160 53 ASP B CB 2733 C CG . ASP B 53 ? 0.8547 0.7043 0.6461 0.0522 -0.0022 -0.2366 53 ASP B CG 2734 O OD1 . ASP B 53 ? 0.8828 0.7038 0.6620 0.0235 -0.0070 -0.2444 53 ASP B OD1 2735 O OD2 . ASP B 53 ? 0.8901 0.7175 0.6542 0.0803 0.0013 -0.2447 53 ASP B OD2 2736 N N . MET B 54 ? 0.6795 0.6831 0.5941 0.0215 -0.0027 -0.1828 54 MET B N 2737 C CA . MET B 54 ? 0.6394 0.6826 0.5802 0.0261 -0.0014 -0.1660 54 MET B CA 2738 C C . MET B 54 ? 0.6304 0.7008 0.5703 0.0415 -0.0013 -0.1617 54 MET B C 2739 O O . MET B 54 ? 0.6496 0.7297 0.5747 0.0463 -0.0035 -0.1724 54 MET B O 2740 C CB . MET B 54 ? 0.6278 0.7035 0.5836 0.0137 -0.0044 -0.1617 54 MET B CB 2741 C CG . MET B 54 ? 0.6033 0.7030 0.5797 0.0214 -0.0019 -0.1433 54 MET B CG 2742 S SD . MET B 54 ? 0.6078 0.7466 0.6010 0.0157 -0.0033 -0.1353 54 MET B SD 2743 C CE . MET B 54 ? 0.6154 0.7341 0.6095 0.0000 -0.0011 -0.1408 54 MET B CE 2744 N N . SER B 55 ? 0.6065 0.6894 0.5596 0.0471 0.0011 -0.1460 55 SER B N 2745 C CA . SER B 55 ? 0.5978 0.7127 0.5520 0.0564 0.0011 -0.1370 55 SER B CA 2746 C C . SER B 55 ? 0.5773 0.7053 0.5459 0.0506 0.0010 -0.1180 55 SER B C 2747 O O . SER B 55 ? 0.5719 0.6846 0.5482 0.0445 0.0017 -0.1143 55 SER B O 2748 C CB . SER B 55 ? 0.6044 0.7148 0.5497 0.0685 0.0042 -0.1371 55 SER B CB 2749 O OG . SER B 55 ? 0.6035 0.7556 0.5503 0.0753 0.0042 -0.1270 55 SER B OG 2750 N N . PHE B 56 ? 0.5698 0.7247 0.5385 0.0528 0.0005 -0.1056 56 PHE B N 2751 C CA . PHE B 56 ? 0.5644 0.7186 0.5378 0.0452 0.0001 -0.0868 56 PHE B CA 2752 C C . PHE B 56 ? 0.5679 0.7367 0.5372 0.0400 0.0002 -0.0740 56 PHE B C 2753 O O . PHE B 56 ? 0.5674 0.7638 0.5339 0.0469 0.0008 -0.0777 56 PHE B O 2754 C CB . PHE B 56 ? 0.5650 0.7391 0.5410 0.0463 -0.0023 -0.0784 56 PHE B CB 2755 C CG . PHE B 56 ? 0.5562 0.7726 0.5288 0.0513 -0.0046 -0.0799 56 PHE B CG 2756 C CD1 . PHE B 56 ? 0.5501 0.7937 0.5191 0.0485 -0.0053 -0.0639 56 PHE B CD1 2757 C CD2 . PHE B 56 ? 0.5541 0.7841 0.5241 0.0561 -0.0062 -0.0969 56 PHE B CD2 2758 C CE1 . PHE B 56 ? 0.5484 0.8367 0.5134 0.0543 -0.0067 -0.0648 56 PHE B CE1 2759 C CE2 . PHE B 56 ? 0.5563 0.8247 0.5192 0.0616 -0.0081 -0.1002 56 PHE B CE2 2760 C CZ . PHE B 56 ? 0.5536 0.8537 0.5151 0.0626 -0.0078 -0.0839 56 PHE B CZ 2761 N N . SER B 57 ? 0.5777 0.7282 0.5437 0.0278 -0.0004 -0.0589 57 SER B N 2762 C CA . SER B 57 ? 0.5880 0.7515 0.5478 0.0144 -0.0017 -0.0453 57 SER B CA 2763 C C . SER B 57 ? 0.6011 0.7848 0.5542 0.0038 -0.0047 -0.0262 57 SER B C 2764 O O . SER B 57 ? 0.6046 0.7956 0.5589 0.0112 -0.0054 -0.0239 57 SER B O 2765 C CB . SER B 57 ? 0.5985 0.7205 0.5515 0.0017 -0.0013 -0.0428 57 SER B CB 2766 O OG . SER B 57 ? 0.6235 0.7029 0.5682 -0.0008 -0.0010 -0.0382 57 SER B OG 2767 N N . LYS B 58 ? 0.6138 0.8092 0.5586 -0.0156 -0.0069 -0.0112 58 LYS B N 2768 C CA . LYS B 58 ? 0.6317 0.8489 0.5668 -0.0317 -0.0103 0.0102 58 LYS B CA 2769 C C . LYS B 58 ? 0.6590 0.8275 0.5797 -0.0360 -0.0117 0.0214 58 LYS B C 2770 O O . LYS B 58 ? 0.6754 0.8603 0.5882 -0.0427 -0.0141 0.0386 58 LYS B O 2771 C CB . LYS B 58 ? 0.6458 0.8823 0.5720 -0.0590 -0.0133 0.0247 58 LYS B CB 2772 C CG . LYS B 58 ? 0.6275 0.9389 0.5666 -0.0519 -0.0120 0.0231 58 LYS B CG 2773 N N . ASP B 59 ? 0.6674 0.7780 0.5828 -0.0296 -0.0098 0.0132 59 ASP B N 2774 C CA . ASP B 59 ? 0.6992 0.7611 0.5985 -0.0244 -0.0096 0.0227 59 ASP B CA 2775 C C . ASP B 59 ? 0.6757 0.7514 0.5909 0.0030 -0.0071 0.0131 59 ASP B C 2776 O O . ASP B 59 ? 0.6980 0.7398 0.6041 0.0158 -0.0055 0.0183 59 ASP B O 2777 C CB . ASP B 59 ? 0.7350 0.7256 0.6122 -0.0327 -0.0085 0.0217 59 ASP B CB 2778 C CG . ASP B 59 ? 0.7208 0.6979 0.6113 -0.0164 -0.0039 0.0008 59 ASP B CG 2779 O OD1 . ASP B 59 ? 0.6922 0.7114 0.6068 -0.0076 -0.0027 -0.0128 59 ASP B OD1 2780 O OD2 . ASP B 59 ? 0.7508 0.6719 0.6241 -0.0122 -0.0012 -0.0016 59 ASP B OD2 2781 N N . TRP B 60 ? 0.6363 0.7627 0.5721 0.0120 -0.0068 -0.0006 60 TRP B N 2782 C CA . TRP B 60 ? 0.6153 0.7655 0.5651 0.0310 -0.0061 -0.0114 60 TRP B CA 2783 C C . TRP B 60 ? 0.6082 0.7310 0.5649 0.0417 -0.0029 -0.0249 60 TRP B C 2784 O O . TRP B 60 ? 0.6001 0.7447 0.5671 0.0533 -0.0031 -0.0316 60 TRP B O 2785 C CB . TRP B 60 ? 0.6287 0.7964 0.5734 0.0378 -0.0084 0.0052 60 TRP B CB 2786 C CG . TRP B 60 ? 0.6303 0.8326 0.5685 0.0264 -0.0113 0.0201 60 TRP B CG 2787 C CD1 . TRP B 60 ? 0.6575 0.8398 0.5767 0.0104 -0.0132 0.0429 60 TRP B CD1 2788 C CD2 . TRP B 60 ? 0.6033 0.8666 0.5504 0.0291 -0.0125 0.0136 60 TRP B CD2 2789 N NE1 . TRP B 60 ? 0.6505 0.8858 0.5702 0.0015 -0.0154 0.0531 60 TRP B NE1 2790 C CE2 . TRP B 60 ? 0.6152 0.9022 0.5520 0.0154 -0.0145 0.0347 60 TRP B CE2 2791 C CE3 . TRP B 60 ? 0.5781 0.8748 0.5364 0.0407 -0.0120 -0.0084 60 TRP B CE3 2792 C CZ2 . TRP B 60 ? 0.6018 0.9529 0.5422 0.0169 -0.0151 0.0346 60 TRP B CZ2 2793 C CZ3 . TRP B 60 ? 0.5715 0.9215 0.5288 0.0432 -0.0128 -0.0108 60 TRP B CZ3 2794 C CH2 . TRP B 60 ? 0.5813 0.9622 0.5314 0.0332 -0.0138 0.0105 60 TRP B CH2 2795 N N . SER B 61 ? 0.6117 0.6933 0.5620 0.0358 -0.0004 -0.0282 61 SER B N 2796 C CA . SER B 61 ? 0.6034 0.6640 0.5597 0.0447 0.0032 -0.0401 61 SER B CA 2797 C C . SER B 61 ? 0.5742 0.6531 0.5441 0.0426 0.0036 -0.0587 61 SER B C 2798 O O . SER B 61 ? 0.5666 0.6538 0.5358 0.0351 0.0026 -0.0624 61 SER B O 2799 C CB . SER B 61 ? 0.6285 0.6351 0.5676 0.0402 0.0061 -0.0365 61 SER B CB 2800 O OG . SER B 61 ? 0.6252 0.6244 0.5592 0.0225 0.0047 -0.0387 61 SER B OG 2801 N N . PHE B 62 ? 0.5619 0.6473 0.5418 0.0493 0.0051 -0.0689 62 PHE B N 2802 C CA . PHE B 62 ? 0.5465 0.6413 0.5333 0.0453 0.0048 -0.0858 62 PHE B CA 2803 C C . PHE B 62 ? 0.5459 0.6093 0.5306 0.0404 0.0081 -0.0922 62 PHE B C 2804 O O . PHE B 62 ? 0.5557 0.5944 0.5366 0.0412 0.0113 -0.0870 62 PHE B O 2805 C CB . PHE B 62 ? 0.5408 0.6609 0.5366 0.0474 0.0035 -0.0927 62 PHE B CB 2806 C CG . PHE B 62 ? 0.5397 0.6982 0.5370 0.0510 -0.0006 -0.0887 62 PHE B CG 2807 C CD1 . PHE B 62 ? 0.5416 0.7169 0.5416 0.0611 -0.0007 -0.0738 62 PHE B CD1 2808 C CD2 . PHE B 62 ? 0.5358 0.7127 0.5283 0.0470 -0.0040 -0.0995 62 PHE B CD2 2809 C CE1 . PHE B 62 ? 0.5434 0.7584 0.5443 0.0646 -0.0050 -0.0682 62 PHE B CE1 2810 C CE2 . PHE B 62 ? 0.5359 0.7515 0.5278 0.0498 -0.0080 -0.0964 62 PHE B CE2 2811 C CZ . PHE B 62 ? 0.5372 0.7744 0.5347 0.0573 -0.0088 -0.0800 62 PHE B CZ 2812 N N . TYR B 63 ? 0.5398 0.6020 0.5232 0.0373 0.0076 -0.1035 63 TYR B N 2813 C CA . TYR B 63 ? 0.5401 0.5758 0.5208 0.0336 0.0103 -0.1088 63 TYR B CA 2814 C C . TYR B 63 ? 0.5469 0.5765 0.5240 0.0321 0.0097 -0.1226 63 TYR B C 2815 O O . TYR B 63 ? 0.5535 0.5948 0.5250 0.0353 0.0071 -0.1299 63 TYR B O 2816 C CB . TYR B 63 ? 0.5397 0.5681 0.5138 0.0317 0.0105 -0.1022 63 TYR B CB 2817 C CG . TYR B 63 ? 0.5423 0.5924 0.5127 0.0369 0.0087 -0.1039 63 TYR B CG 2818 C CD1 . TYR B 63 ? 0.5521 0.5940 0.5166 0.0436 0.0099 -0.1127 63 TYR B CD1 2819 C CD2 . TYR B 63 ? 0.5398 0.6191 0.5099 0.0374 0.0064 -0.0953 63 TYR B CD2 2820 C CE1 . TYR B 63 ? 0.5574 0.6208 0.5153 0.0553 0.0095 -0.1143 63 TYR B CE1 2821 C CE2 . TYR B 63 ? 0.5443 0.6524 0.5107 0.0455 0.0059 -0.0965 63 TYR B CE2 2822 C CZ . TYR B 63 ? 0.5547 0.6552 0.5148 0.0566 0.0078 -0.1066 63 TYR B CZ 2823 O OH . TYR B 63 ? 0.5678 0.6982 0.5211 0.0712 0.0086 -0.1078 63 TYR B OH 2824 N N . ILE B 64 ? 0.5506 0.5575 0.5265 0.0269 0.0122 -0.1262 64 ILE B N 2825 C CA . ILE B 64 ? 0.5662 0.5548 0.5327 0.0218 0.0115 -0.1374 64 ILE B CA 2826 C C . ILE B 64 ? 0.5711 0.5316 0.5330 0.0188 0.0148 -0.1359 64 ILE B C 2827 O O . ILE B 64 ? 0.5602 0.5211 0.5296 0.0163 0.0178 -0.1290 64 ILE B O 2828 C CB . ILE B 64 ? 0.5714 0.5744 0.5417 0.0102 0.0090 -0.1432 64 ILE B CB 2829 C CG1 . ILE B 64 ? 0.6067 0.5826 0.5589 -0.0009 0.0066 -0.1559 64 ILE B CG1 2830 C CG2 . ILE B 64 ? 0.5606 0.5775 0.5450 0.0055 0.0121 -0.1354 64 ILE B CG2 2831 C CD1 . ILE B 64 ? 0.6205 0.6166 0.5703 -0.0158 0.0015 -0.1639 64 ILE B CD1 2832 N N . LEU B 65 ? 0.5916 0.5257 0.5376 0.0216 0.0145 -0.1419 65 LEU B N 2833 C CA . LEU B 65 ? 0.6007 0.5076 0.5395 0.0198 0.0173 -0.1388 65 LEU B CA 2834 C C . LEU B 65 ? 0.6296 0.5080 0.5562 0.0053 0.0167 -0.1450 65 LEU B C 2835 O O . LEU B 65 ? 0.6603 0.5187 0.5694 0.0031 0.0137 -0.1550 65 LEU B O 2836 C CB . LEU B 65 ? 0.6095 0.5069 0.5363 0.0367 0.0180 -0.1363 65 LEU B CB 2837 C CG . LEU B 65 ? 0.6222 0.4952 0.5397 0.0388 0.0205 -0.1306 65 LEU B CG 2838 C CD1 . LEU B 65 ? 0.5981 0.4893 0.5290 0.0328 0.0223 -0.1208 65 LEU B CD1 2839 C CD2 . LEU B 65 ? 0.6425 0.5066 0.5431 0.0610 0.0209 -0.1294 65 LEU B CD2 2840 N N . ALA B 66 ? 0.6261 0.5021 0.5586 -0.0063 0.0194 -0.1392 66 ALA B N 2841 C CA . ALA B 66 ? 0.6564 0.5070 0.5761 -0.0249 0.0190 -0.1411 66 ALA B CA 2842 C C . ALA B 66 ? 0.6744 0.4948 0.5822 -0.0213 0.0220 -0.1339 66 ALA B C 2843 O O . ALA B 66 ? 0.6500 0.4859 0.5686 -0.0131 0.0253 -0.1261 66 ALA B O 2844 C CB . ALA B 66 ? 0.6394 0.5247 0.5766 -0.0421 0.0201 -0.1377 66 ALA B CB 2845 N N . HIS B 67 ? 0.7227 0.4965 0.6041 -0.0279 0.0206 -0.1362 67 HIS B N 2846 C CA . HIS B 67 ? 0.7483 0.4903 0.6147 -0.0229 0.0233 -0.1271 67 HIS B CA 2847 C C . HIS B 67 ? 0.8002 0.4973 0.6419 -0.0460 0.0222 -0.1255 67 HIS B C 2848 O O . HIS B 67 ? 0.8363 0.5055 0.6589 -0.0611 0.0180 -0.1349 67 HIS B O 2849 C CB . HIS B 67 ? 0.7627 0.4849 0.6137 0.0067 0.0236 -0.1267 67 HIS B CB 2850 C CG . HIS B 67 ? 0.8163 0.4931 0.6365 0.0149 0.0210 -0.1377 67 HIS B CG 2851 N ND1 . HIS B 67 ? 0.8109 0.5028 0.6334 0.0187 0.0183 -0.1500 67 HIS B ND1 2852 C CD2 . HIS B 67 ? 0.8830 0.4945 0.6644 0.0212 0.0208 -0.1388 67 HIS B CD2 2853 C CE1 . HIS B 67 ? 0.8724 0.5114 0.6582 0.0270 0.0168 -0.1602 67 HIS B CE1 2854 N NE2 . HIS B 67 ? 0.9200 0.5051 0.6785 0.0295 0.0184 -0.1538 67 HIS B NE2 2855 N N . THR B 68 ? 0.8086 0.4981 0.6477 -0.0513 0.0254 -0.1131 68 THR B N 2856 C CA . THR B 68 ? 0.8636 0.5074 0.6761 -0.0748 0.0245 -0.1073 68 THR B CA 2857 C C . THR B 68 ? 0.8880 0.5021 0.6841 -0.0620 0.0277 -0.0933 68 THR B C 2858 O O . THR B 68 ? 0.8505 0.4996 0.6652 -0.0445 0.0311 -0.0864 68 THR B O 2859 C CB . THR B 68 ? 0.8502 0.5332 0.6798 -0.1093 0.0250 -0.1033 68 THR B CB 2860 O OG1 . THR B 68 ? 0.9141 0.5508 0.7137 -0.1386 0.0229 -0.0968 68 THR B OG1 2861 C CG2 . THR B 68 ? 0.7975 0.5348 0.6558 -0.1033 0.0310 -0.0937 68 THR B CG2 2862 N N . GLU B 69 ? 0.9574 0.5041 0.7150 -0.0722 0.0261 -0.0887 69 GLU B N 2863 C CA . GLU B 69 ? 0.9917 0.5049 0.7287 -0.0633 0.0288 -0.0721 69 GLU B CA 2864 C C . GLU B 69 ? 0.9674 0.5212 0.7233 -0.0892 0.0319 -0.0591 69 GLU B C 2865 O O . GLU B 69 ? 0.9745 0.5398 0.7338 -0.1241 0.0307 -0.0595 69 GLU B O 2866 C CB . GLU B 69 ? 1.0853 0.5038 0.7687 -0.0688 0.0259 -0.0709 69 GLU B CB 2867 C CG . GLU B 69 ? 1.1393 0.5085 0.7919 -0.0401 0.0285 -0.0554 69 GLU B CG 2868 C CD . GLU B 69 ? 1.2481 0.5084 0.8387 -0.0398 0.0260 -0.0560 69 GLU B CD 2869 O OE1 . GLU B 69 ? 1.2788 0.5014 0.8488 -0.0470 0.0223 -0.0740 69 GLU B OE1 2870 O OE2 . GLU B 69 ? 1.3048 0.5131 0.8631 -0.0319 0.0277 -0.0384 69 GLU B OE2 2871 N N . PHE B 70 ? 0.9403 0.5228 0.7081 -0.0725 0.0359 -0.0477 70 PHE B N 2872 C CA . PHE B 70 ? 0.9186 0.5432 0.7021 -0.0920 0.0400 -0.0363 70 PHE B CA 2873 C C . PHE B 70 ? 0.9310 0.5495 0.7028 -0.0774 0.0428 -0.0192 70 PHE B C 2874 O O . PHE B 70 ? 0.9458 0.5416 0.7044 -0.0479 0.0418 -0.0161 70 PHE B O 2875 C CB . PHE B 70 ? 0.8506 0.5490 0.6736 -0.0918 0.0428 -0.0457 70 PHE B CB 2876 C CG . PHE B 70 ? 0.8104 0.5425 0.6484 -0.0659 0.0452 -0.0456 70 PHE B CG 2877 C CD1 . PHE B 70 ? 0.8059 0.5263 0.6401 -0.0390 0.0424 -0.0493 70 PHE B CD1 2878 C CD2 . PHE B 70 ? 0.7803 0.5588 0.6338 -0.0700 0.0501 -0.0423 70 PHE B CD2 2879 C CE1 . PHE B 70 ? 0.7715 0.5275 0.6177 -0.0224 0.0432 -0.0482 70 PHE B CE1 2880 C CE2 . PHE B 70 ? 0.7535 0.5575 0.6145 -0.0518 0.0511 -0.0439 70 PHE B CE2 2881 C CZ . PHE B 70 ? 0.7475 0.5411 0.6053 -0.0309 0.0471 -0.0463 70 PHE B CZ 2882 N N . THR B 71 ? 0.9258 0.5720 0.7028 -0.0972 0.0466 -0.0074 71 THR B N 2883 C CA . THR B 71 ? 0.9321 0.5845 0.7002 -0.0868 0.0495 0.0092 71 THR B CA 2884 C C . THR B 71 ? 0.8791 0.6037 0.6747 -0.0910 0.0546 0.0077 71 THR B C 2885 O O . THR B 71 ? 0.8739 0.6280 0.6784 -0.1153 0.0583 0.0097 71 THR B O 2886 C CB . THR B 71 ? 1.0003 0.6011 0.7342 -0.1070 0.0494 0.0291 71 THR B CB 2887 O OG1 . THR B 71 ? 1.0642 0.5846 0.7638 -0.0998 0.0449 0.0285 71 THR B OG1 2888 C CG2 . THR B 71 ? 1.0085 0.6194 0.7325 -0.0946 0.0522 0.0484 71 THR B CG2 2889 N N . PRO B 72 ? 0.8438 0.5983 0.6500 -0.0676 0.0549 0.0038 72 PRO B N 2890 C CA . PRO B 72 ? 0.8044 0.6154 0.6276 -0.0701 0.0597 -0.0002 72 PRO B CA 2891 C C . PRO B 72 ? 0.8256 0.6490 0.6359 -0.0809 0.0638 0.0169 72 PRO B C 2892 O O . PRO B 72 ? 0.8618 0.6556 0.6508 -0.0758 0.0618 0.0334 72 PRO B O 2893 C CB . PRO B 72 ? 0.7775 0.6050 0.6061 -0.0471 0.0568 -0.0073 72 PRO B CB 2894 C CG . PRO B 72 ? 0.7927 0.5840 0.6137 -0.0306 0.0513 -0.0072 72 PRO B CG 2895 C CD . PRO B 72 ? 0.8454 0.5849 0.6446 -0.0389 0.0509 0.0039 72 PRO B CD 2896 N N . THR B 73 ? 0.8082 0.6760 0.6294 -0.0934 0.0700 0.0139 73 THR B N 2897 C CA . THR B 73 ? 0.8245 0.7171 0.6350 -0.1026 0.0751 0.0285 73 THR B CA 2898 C C . THR B 73 ? 0.7939 0.7376 0.6134 -0.0943 0.0807 0.0158 73 THR B C 2899 O O . THR B 73 ? 0.7655 0.7163 0.5964 -0.0818 0.0799 -0.0025 73 THR B O 2900 C CB . THR B 73 ? 0.8518 0.7480 0.6581 -0.1315 0.0787 0.0421 73 THR B CB 2901 O OG1 . THR B 73 ? 0.8252 0.7548 0.6526 -0.1406 0.0820 0.0290 73 THR B OG1 2902 C CG2 . THR B 73 ? 0.8998 0.7305 0.6844 -0.1435 0.0728 0.0563 73 THR B CG2 2903 N N . GLU B 74 ? 0.8057 0.7804 0.6157 -0.1012 0.0865 0.0257 74 GLU B N 2904 C CA . GLU B 74 ? 0.7903 0.8078 0.6003 -0.0928 0.0928 0.0126 74 GLU B CA 2905 C C . GLU B 74 ? 0.7770 0.8265 0.6022 -0.0940 0.1004 0.0003 74 GLU B C 2906 O O . GLU B 74 ? 0.7642 0.8316 0.5887 -0.0792 0.1048 -0.0173 74 GLU B O 2907 C CB . GLU B 74 ? 0.8106 0.8550 0.6030 -0.0985 0.0972 0.0272 74 GLU B CB 2908 C CG . GLU B 74 ? 0.8278 0.8536 0.6036 -0.0923 0.0902 0.0400 74 GLU B CG 2909 C CD . GLU B 74 ? 0.8461 0.9068 0.6036 -0.0960 0.0944 0.0516 74 GLU B CD 2910 O OE1 . GLU B 74 ? 0.8571 0.9516 0.6133 -0.1065 0.1031 0.0552 74 GLU B OE1 2911 O OE2 . GLU B 74 ? 0.8508 0.9116 0.5950 -0.0881 0.0890 0.0581 74 GLU B OE2 2912 N N . THR B 75 ? 0.7863 0.8415 0.6217 -0.1115 0.1016 0.0102 75 THR B N 2913 C CA . THR B 75 ? 0.7769 0.8813 0.6271 -0.1146 0.1098 0.0050 75 THR B CA 2914 C C . THR B 75 ? 0.7648 0.8634 0.6342 -0.1199 0.1062 -0.0010 75 THR B C 2915 O O . THR B 75 ? 0.7504 0.8898 0.6337 -0.1107 0.1121 -0.0105 75 THR B O 2916 C CB . THR B 75 ? 0.7988 0.9476 0.6448 -0.1362 0.1167 0.0248 75 THR B CB 2917 O OG1 . THR B 75 ? 0.8289 0.9393 0.6644 -0.1616 0.1100 0.0457 75 THR B OG1 2918 C CG2 . THR B 75 ? 0.8049 0.9846 0.6350 -0.1249 0.1243 0.0251 75 THR B CG2 2919 N N . ASP B 76 ? 0.7751 0.8244 0.6422 -0.1324 0.0970 0.0045 76 ASP B N 2920 C CA . ASP B 76 ? 0.7653 0.8060 0.6466 -0.1400 0.0923 -0.0020 76 ASP B CA 2921 C C . ASP B 76 ? 0.7323 0.7695 0.6257 -0.1135 0.0911 -0.0224 76 ASP B C 2922 O O . ASP B 76 ? 0.7254 0.7285 0.6115 -0.0973 0.0870 -0.0295 76 ASP B O 2923 C CB . ASP B 76 ? 0.7952 0.7735 0.6627 -0.1568 0.0830 0.0063 76 ASP B CB 2924 C CG . ASP B 76 ? 0.8401 0.8150 0.6934 -0.1914 0.0829 0.0270 76 ASP B CG 2925 O OD1 . ASP B 76 ? 0.8434 0.8632 0.7078 -0.2145 0.0855 0.0311 76 ASP B OD1 2926 O OD2 . ASP B 76 ? 0.8787 0.8066 0.7082 -0.1964 0.0800 0.0408 76 ASP B OD2 2927 N N . THR B 77 ? 0.7158 0.7922 0.6266 -0.1099 0.0946 -0.0298 77 THR B N 2928 C CA . THR B 77 ? 0.6929 0.7643 0.6128 -0.0855 0.0937 -0.0467 77 THR B CA 2929 C C . THR B 77 ? 0.6882 0.7318 0.6163 -0.0927 0.0848 -0.0505 77 THR B C 2930 O O . THR B 77 ? 0.7019 0.7511 0.6335 -0.1168 0.0816 -0.0430 77 THR B O 2931 C CB . THR B 77 ? 0.6822 0.8104 0.6134 -0.0691 0.1031 -0.0525 77 THR B CB 2932 O OG1 . THR B 77 ? 0.6813 0.8518 0.6298 -0.0859 0.1028 -0.0453 77 THR B OG1 2933 C CG2 . THR B 77 ? 0.6946 0.8563 0.6147 -0.0614 0.1135 -0.0493 77 THR B CG2 2934 N N . TYR B 78 ? 0.6729 0.6873 0.6012 -0.0742 0.0807 -0.0622 78 TYR B N 2935 C CA . TYR B 78 ? 0.6654 0.6582 0.6008 -0.0760 0.0731 -0.0678 78 TYR B CA 2936 C C . TYR B 78 ? 0.6448 0.6506 0.5907 -0.0546 0.0741 -0.0793 78 TYR B C 2937 O O . TYR B 78 ? 0.6388 0.6376 0.5776 -0.0366 0.0771 -0.0853 78 TYR B O 2938 C CB . TYR B 78 ? 0.6754 0.6154 0.5972 -0.0755 0.0658 -0.0670 78 TYR B CB 2939 C CG . TYR B 78 ? 0.7082 0.6218 0.6148 -0.0956 0.0636 -0.0547 78 TYR B CG 2940 C CD1 . TYR B 78 ? 0.7236 0.6300 0.6164 -0.0967 0.0662 -0.0439 78 TYR B CD1 2941 C CD2 . TYR B 78 ? 0.7315 0.6230 0.6329 -0.1147 0.0583 -0.0534 78 TYR B CD2 2942 C CE1 . TYR B 78 ? 0.7622 0.6375 0.6366 -0.1144 0.0642 -0.0300 78 TYR B CE1 2943 C CE2 . TYR B 78 ? 0.7759 0.6296 0.6552 -0.1346 0.0560 -0.0416 78 TYR B CE2 2944 C CZ . TYR B 78 ? 0.7915 0.6361 0.6576 -0.1334 0.0591 -0.0289 78 TYR B CZ 2945 O OH . TYR B 78 ? 0.8453 0.6459 0.6853 -0.1522 0.0568 -0.0148 78 TYR B OH 2946 N N . ALA B 79 ? 0.6382 0.6602 0.5973 -0.0583 0.0711 -0.0818 79 ALA B N 2947 C CA . ALA B 79 ? 0.6221 0.6594 0.5906 -0.0377 0.0722 -0.0895 79 ALA B CA 2948 C C . ALA B 79 ? 0.6157 0.6466 0.5926 -0.0431 0.0644 -0.0931 79 ALA B C 2949 O O . ALA B 79 ? 0.6250 0.6499 0.6013 -0.0651 0.0591 -0.0906 79 ALA B O 2950 C CB . ALA B 79 ? 0.6204 0.7138 0.5983 -0.0279 0.0810 -0.0866 79 ALA B CB 2951 N N . CYS B 80 ? 0.6056 0.6342 0.5863 -0.0238 0.0635 -0.0990 80 CYS B N 2952 C CA . CYS B 80 ? 0.5994 0.6322 0.5887 -0.0255 0.0570 -0.1022 80 CYS B CA 2953 C C . CYS B 80 ? 0.5914 0.6683 0.5930 -0.0089 0.0609 -0.1008 80 CYS B C 2954 O O . CYS B 80 ? 0.5934 0.6648 0.5892 0.0144 0.0663 -0.1019 80 CYS B O 2955 C CB . CYS B 80 ? 0.5951 0.5872 0.5765 -0.0171 0.0517 -0.1075 80 CYS B CB 2956 S SG . CYS B 80 ? 0.5988 0.5932 0.5865 -0.0208 0.0435 -0.1120 80 CYS B SG 2957 N N . ARG B 81 ? 0.5897 0.7088 0.6045 -0.0212 0.0582 -0.0980 81 ARG B N 2958 C CA . ARG B 81 ? 0.5833 0.7569 0.6116 -0.0040 0.0616 -0.0937 81 ARG B CA 2959 C C . ARG B 81 ? 0.5759 0.7548 0.6106 -0.0038 0.0538 -0.0962 81 ARG B C 2960 O O . ARG B 81 ? 0.5774 0.7530 0.6125 -0.0288 0.0459 -0.0996 81 ARG B O 2961 C CB . ARG B 81 ? 0.5867 0.8274 0.6276 -0.0184 0.0652 -0.0853 81 ARG B CB 2962 C CG . ARG B 81 ? 0.5849 0.8963 0.6408 0.0044 0.0700 -0.0782 81 ARG B CG 2963 C CD . ARG B 81 ? 0.5959 0.9868 0.6658 -0.0121 0.0738 -0.0678 81 ARG B CD 2964 N NE . ARG B 81 ? 0.6122 1.0101 0.6757 -0.0002 0.0847 -0.0646 81 ARG B NE 2965 C CZ . ARG B 81 ? 0.6193 1.0812 0.6914 -0.0163 0.0895 -0.0546 81 ARG B CZ 2966 N NH1 . ARG B 81 ? 0.6225 1.1469 0.7097 -0.0493 0.0835 -0.0463 81 ARG B NH1 2967 N NH2 . ARG B 81 ? 0.6260 1.0919 0.6898 -0.0021 0.1000 -0.0527 81 ARG B NH2 2968 N N . VAL B 82 ? 0.5742 0.7568 0.6095 0.0247 0.0562 -0.0946 82 VAL B N 2969 C CA . VAL B 82 ? 0.5682 0.7537 0.6073 0.0287 0.0494 -0.0954 82 VAL B CA 2970 C C . VAL B 82 ? 0.5682 0.8143 0.6196 0.0497 0.0521 -0.0863 82 VAL B C 2971 O O . VAL B 82 ? 0.5812 0.8323 0.6277 0.0798 0.0606 -0.0810 82 VAL B O 2972 C CB . VAL B 82 ? 0.5697 0.6958 0.5941 0.0418 0.0478 -0.0990 82 VAL B CB 2973 C CG1 . VAL B 82 ? 0.5670 0.7032 0.5946 0.0509 0.0426 -0.0965 82 VAL B CG1 2974 C CG2 . VAL B 82 ? 0.5672 0.6482 0.5825 0.0222 0.0435 -0.1063 82 VAL B CG2 2975 N N . LYS B 83 ? 0.5609 0.8520 0.6246 0.0350 0.0450 -0.0848 83 LYS B N 2976 C CA . LYS B 83 ? 0.5601 0.9193 0.6371 0.0539 0.0459 -0.0744 83 LYS B CA 2977 C C . LYS B 83 ? 0.5578 0.9029 0.6316 0.0644 0.0397 -0.0740 83 LYS B C 2978 O O . LYS B 83 ? 0.5534 0.8837 0.6252 0.0408 0.0308 -0.0820 83 LYS B O 2979 C CB . LYS B 83 ? 0.5566 0.9924 0.6500 0.0250 0.0415 -0.0709 83 LYS B CB 2980 C CG . LYS B 83 ? 0.5591 1.0872 0.6695 0.0472 0.0452 -0.0564 83 LYS B CG 2981 N N . HIS B 84 ? 0.5676 0.9138 0.6370 0.1014 0.0447 -0.0644 84 HIS B N 2982 C CA . HIS B 84 ? 0.5706 0.9016 0.6343 0.1138 0.0398 -0.0604 84 HIS B CA 2983 C C . HIS B 84 ? 0.5887 0.9624 0.6541 0.1525 0.0448 -0.0443 84 HIS B C 2984 O O . HIS B 84 ? 0.6053 0.9953 0.6686 0.1782 0.0543 -0.0382 84 HIS B O 2985 C CB . HIS B 84 ? 0.5791 0.8247 0.6218 0.1169 0.0403 -0.0656 84 HIS B CB 2986 C CG . HIS B 84 ? 0.5753 0.8049 0.6121 0.1183 0.0338 -0.0624 84 HIS B CG 2987 N ND1 . HIS B 84 ? 0.5913 0.7980 0.6136 0.1458 0.0362 -0.0504 84 HIS B ND1 2988 C CD2 . HIS B 84 ? 0.5573 0.7894 0.5975 0.0962 0.0252 -0.0691 84 HIS B CD2 2989 C CE1 . HIS B 84 ? 0.5837 0.7854 0.6039 0.1379 0.0292 -0.0482 84 HIS B CE1 2990 N NE2 . HIS B 84 ? 0.5587 0.7784 0.5902 0.1095 0.0229 -0.0602 84 HIS B NE2 2991 N N . ALA B 85 ? 0.5902 0.9831 0.6572 0.1596 0.0388 -0.0368 85 ALA B N 2992 C CA . ALA B 85 ? 0.6094 1.0492 0.6778 0.1981 0.0424 -0.0187 85 ALA B CA 2993 C C . ALA B 85 ? 0.6488 1.0219 0.6893 0.2394 0.0514 -0.0102 85 ALA B C 2994 O O . ALA B 85 ? 0.6751 1.0776 0.7108 0.2802 0.0581 0.0045 85 ALA B O 2995 C CB . ALA B 85 ? 0.6014 1.0825 0.6779 0.1914 0.0326 -0.0123 85 ALA B CB 2996 N N . SER B 86 ? 0.6580 0.9416 0.6771 0.2287 0.0515 -0.0193 86 SER B N 2997 C CA . SER B 86 ? 0.7061 0.9107 0.6906 0.2585 0.0587 -0.0141 86 SER B CA 2998 C C . SER B 86 ? 0.7287 0.9179 0.7011 0.2793 0.0701 -0.0189 86 SER B C 2999 O O . SER B 86 ? 0.7776 0.8999 0.7151 0.3077 0.0773 -0.0164 86 SER B O 3000 C CB . SER B 86 ? 0.7097 0.8341 0.6754 0.2332 0.0533 -0.0215 86 SER B CB 3001 O OG . SER B 86 ? 0.6848 0.7955 0.6586 0.2018 0.0520 -0.0378 86 SER B OG 3002 N N . MET B 87 ? 0.6982 0.9469 0.6956 0.2634 0.0716 -0.0258 87 MET B N 3003 C CA . MET B 87 ? 0.7150 0.9684 0.7058 0.2806 0.0826 -0.0298 87 MET B CA 3004 C C . MET B 87 ? 0.7026 1.0652 0.7202 0.2957 0.0869 -0.0198 87 MET B C 3005 O O . MET B 87 ? 0.6676 1.1020 0.7150 0.2680 0.0788 -0.0176 87 MET B O 3006 C CB . MET B 87 ? 0.6916 0.9162 0.6859 0.2424 0.0808 -0.0457 87 MET B CB 3007 C CG . MET B 87 ? 0.7217 0.8460 0.6822 0.2405 0.0825 -0.0550 87 MET B CG 3008 S SD . MET B 87 ? 0.6964 0.7850 0.6643 0.1890 0.0731 -0.0688 87 MET B SD 3009 C CE . MET B 87 ? 0.6507 0.8222 0.6553 0.1615 0.0706 -0.0710 87 MET B CE 3010 N N . ALA B 88 ? 0.7374 1.1139 0.7413 0.3392 0.0997 -0.0141 88 ALA B N 3011 C CA . ALA B 88 ? 0.7286 1.2200 0.7574 0.3577 0.1055 -0.0026 88 ALA B CA 3012 C C . ALA B 88 ? 0.6918 1.2345 0.7452 0.3161 0.1045 -0.0106 88 ALA B C 3013 O O . ALA B 88 ? 0.6609 1.2984 0.7460 0.2906 0.0988 -0.0042 88 ALA B O 3014 C CB . ALA B 88 ? 0.7826 1.2704 0.7849 0.4221 0.1210 0.0054 88 ALA B CB 3015 N N . GLU B 89 ? 0.7001 1.1783 0.7357 0.3071 0.1095 -0.0238 89 GLU B N 3016 C CA . GLU B 89 ? 0.6719 1.1800 0.7245 0.2664 0.1086 -0.0309 89 GLU B CA 3017 C C . GLU B 89 ? 0.6521 1.0809 0.6995 0.2212 0.0983 -0.0449 89 GLU B C 3018 O O . GLU B 89 ? 0.6671 1.0110 0.6920 0.2279 0.0958 -0.0511 89 GLU B O 3019 C CB . GLU B 89 ? 0.6977 1.2057 0.7342 0.2929 0.1230 -0.0335 89 GLU B CB 3020 C CG . GLU B 89 ? 0.7092 1.3266 0.7591 0.3294 0.1339 -0.0187 89 GLU B CG 3021 N N . PRO B 90 ? 0.6240 1.0810 0.6900 0.1752 0.0922 -0.0487 90 PRO B N 3022 C CA . PRO B 90 ? 0.6106 0.9950 0.6694 0.1381 0.0838 -0.0610 90 PRO B CA 3023 C C . PRO B 90 ? 0.6276 0.9367 0.6612 0.1469 0.0901 -0.0700 90 PRO B C 3024 O O . PRO B 90 ? 0.6434 0.9684 0.6692 0.1662 0.1007 -0.0689 90 PRO B O 3025 C CB . PRO B 90 ? 0.5930 1.0268 0.6707 0.0937 0.0784 -0.0604 90 PRO B CB 3026 C CG . PRO B 90 ? 0.5952 1.1222 0.6872 0.1066 0.0869 -0.0487 90 PRO B CG 3027 C CD . PRO B 90 ? 0.6085 1.1667 0.7004 0.1539 0.0919 -0.0401 90 PRO B CD 3028 N N . LYS B 91 ? 0.6261 0.8598 0.6460 0.1328 0.0835 -0.0785 91 LYS B N 3029 C CA . LYS B 91 ? 0.6432 0.8071 0.6377 0.1361 0.0873 -0.0869 91 LYS B CA 3030 C C . LYS B 91 ? 0.6251 0.7787 0.6241 0.1016 0.0840 -0.0920 91 LYS B C 3031 O O . LYS B 91 ? 0.6059 0.7547 0.6153 0.0738 0.0749 -0.0936 91 LYS B O 3032 C CB . LYS B 91 ? 0.6573 0.7510 0.6320 0.1414 0.0822 -0.0905 91 LYS B CB 3033 C CG . LYS B 91 ? 0.6916 0.7158 0.6344 0.1461 0.0858 -0.0984 91 LYS B CG 3034 C CD . LYS B 91 ? 0.7133 0.6751 0.6372 0.1412 0.0789 -0.1000 91 LYS B CD 3035 C CE . LYS B 91 ? 0.7577 0.6912 0.6584 0.1732 0.0827 -0.0947 91 LYS B CE 3036 N NZ . LYS B 91 ? 0.7726 0.6487 0.6542 0.1622 0.0751 -0.0935 91 LYS B NZ 3037 N N . THR B 92 ? 0.6368 0.7841 0.6239 0.1062 0.0918 -0.0945 92 THR B N 3038 C CA . THR B 92 ? 0.6252 0.7610 0.6125 0.0775 0.0899 -0.0969 92 THR B CA 3039 C C . THR B 92 ? 0.6391 0.7090 0.6002 0.0802 0.0905 -0.1049 92 THR B C 3040 O O . THR B 92 ? 0.6664 0.7182 0.6060 0.1032 0.0984 -0.1090 92 THR B O 3041 C CB . THR B 92 ? 0.6278 0.8239 0.6243 0.0738 0.0978 -0.0906 92 THR B CB 3042 O OG1 . THR B 92 ? 0.6161 0.8838 0.6356 0.0715 0.0972 -0.0818 92 THR B OG1 3043 C CG2 . THR B 92 ? 0.6193 0.8044 0.6162 0.0399 0.0944 -0.0895 92 THR B CG2 3044 N N . VAL B 93 ? 0.6245 0.6599 0.5849 0.0573 0.0821 -0.1072 93 VAL B N 3045 C CA . VAL B 93 ? 0.6336 0.6194 0.5722 0.0534 0.0809 -0.1128 93 VAL B CA 3046 C C . VAL B 93 ? 0.6231 0.6120 0.5650 0.0308 0.0790 -0.1101 93 VAL B C 3047 O O . VAL B 93 ? 0.6088 0.5998 0.5628 0.0134 0.0725 -0.1067 93 VAL B O 3048 C CB . VAL B 93 ? 0.6332 0.5789 0.5648 0.0505 0.0726 -0.1153 93 VAL B CB 3049 C CG1 . VAL B 93 ? 0.6415 0.5501 0.5540 0.0393 0.0695 -0.1188 93 VAL B CG1 3050 C CG2 . VAL B 93 ? 0.6496 0.5805 0.5699 0.0727 0.0748 -0.1161 93 VAL B CG2 3051 N N . TYR B 94 ? 0.6373 0.6231 0.5642 0.0329 0.0850 -0.1115 94 TYR B N 3052 C CA . TYR B 94 ? 0.6336 0.6224 0.5599 0.0141 0.0842 -0.1064 94 TYR B CA 3053 C C . TYR B 94 ? 0.6348 0.5851 0.5493 0.0049 0.0770 -0.1078 94 TYR B C 3054 O O . TYR B 94 ? 0.6444 0.5677 0.5442 0.0116 0.0749 -0.1141 94 TYR B O 3055 C CB . TYR B 94 ? 0.6489 0.6590 0.5637 0.0209 0.0942 -0.1063 94 TYR B CB 3056 C CG . TYR B 94 ? 0.6421 0.7091 0.5723 0.0249 0.1017 -0.1001 94 TYR B CG 3057 C CD1 . TYR B 94 ? 0.6434 0.7333 0.5744 0.0512 0.1084 -0.1035 94 TYR B CD1 3058 C CD2 . TYR B 94 ? 0.6281 0.7284 0.5698 0.0024 0.1021 -0.0891 94 TYR B CD2 3059 C CE1 . TYR B 94 ? 0.6338 0.7905 0.5811 0.0563 0.1155 -0.0957 94 TYR B CE1 3060 C CE2 . TYR B 94 ? 0.6203 0.7837 0.5769 0.0012 0.1083 -0.0814 94 TYR B CE2 3061 C CZ . TYR B 94 ? 0.6195 0.8168 0.5807 0.0290 0.1151 -0.0847 94 TYR B CZ 3062 O OH . TYR B 94 ? 0.6155 0.8886 0.5933 0.0294 0.1214 -0.0752 94 TYR B OH 3063 N N . TRP B 95 ? 0.6316 0.5804 0.5501 -0.0106 0.0731 -0.1004 95 TRP B N 3064 C CA . TRP B 95 ? 0.6347 0.5588 0.5430 -0.0159 0.0670 -0.0985 95 TRP B CA 3065 C C . TRP B 95 ? 0.6493 0.5708 0.5380 -0.0153 0.0702 -0.0999 95 TRP B C 3066 O O . TRP B 95 ? 0.6574 0.5951 0.5418 -0.0188 0.0758 -0.0955 95 TRP B O 3067 C CB . TRP B 95 ? 0.6377 0.5556 0.5503 -0.0274 0.0630 -0.0891 95 TRP B CB 3068 C CG . TRP B 95 ? 0.6469 0.5472 0.5487 -0.0268 0.0576 -0.0842 95 TRP B CG 3069 C CD1 . TRP B 95 ? 0.6411 0.5337 0.5411 -0.0205 0.0520 -0.0870 95 TRP B CD1 3070 C CD2 . TRP B 95 ? 0.6668 0.5620 0.5582 -0.0318 0.0575 -0.0731 95 TRP B CD2 3071 N NE1 . TRP B 95 ? 0.6501 0.5399 0.5410 -0.0195 0.0485 -0.0785 95 TRP B NE1 3072 C CE2 . TRP B 95 ? 0.6677 0.5556 0.5522 -0.0247 0.0518 -0.0698 95 TRP B CE2 3073 C CE3 . TRP B 95 ? 0.6812 0.5806 0.5675 -0.0418 0.0617 -0.0636 95 TRP B CE3 3074 C CZ2 . TRP B 95 ? 0.6846 0.5688 0.5572 -0.0232 0.0503 -0.0574 95 TRP B CZ2 3075 C CZ3 . TRP B 95 ? 0.7017 0.5903 0.5743 -0.0428 0.0600 -0.0511 95 TRP B CZ3 3076 C CH2 . TRP B 95 ? 0.7014 0.5820 0.5671 -0.0315 0.0544 -0.0481 95 TRP B CH2 3077 N N . ASP B 96 ? 0.6555 0.5589 0.5307 -0.0134 0.0661 -0.1057 96 ASP B N 3078 C CA . ASP B 96 ? 0.6741 0.5721 0.5262 -0.0174 0.0665 -0.1085 96 ASP B CA 3079 C C . ASP B 96 ? 0.6687 0.5658 0.5192 -0.0262 0.0576 -0.1017 96 ASP B C 3080 O O . ASP B 96 ? 0.6667 0.5558 0.5177 -0.0280 0.0514 -0.1036 96 ASP B O 3081 C CB . ASP B 96 ? 0.6975 0.5730 0.5278 -0.0111 0.0688 -0.1216 96 ASP B CB 3082 C CG . ASP B 96 ? 0.7316 0.5975 0.5306 -0.0169 0.0700 -0.1281 96 ASP B CG 3083 O OD1 . ASP B 96 ? 0.7308 0.6077 0.5255 -0.0297 0.0646 -0.1219 96 ASP B OD1 3084 O OD2 . ASP B 96 ? 0.7643 0.6111 0.5397 -0.0070 0.0765 -0.1397 96 ASP B OD2 3085 N N . ARG B 97 ? 0.6704 0.5803 0.5186 -0.0305 0.0572 -0.0918 97 ARG B N 3086 C CA . ARG B 97 ? 0.6661 0.5840 0.5132 -0.0332 0.0496 -0.0819 97 ARG B CA 3087 C C . ARG B 97 ? 0.6787 0.6030 0.5077 -0.0426 0.0440 -0.0862 97 ARG B C 3088 O O . ARG B 97 ? 0.6739 0.6135 0.5051 -0.0447 0.0367 -0.0791 97 ARG B O 3089 C CB . ARG B 97 ? 0.6728 0.5999 0.5181 -0.0328 0.0510 -0.0678 97 ARG B CB 3090 C CG . ARG B 97 ? 0.6826 0.6219 0.5119 -0.0388 0.0561 -0.0678 97 ARG B CG 3091 C CD . ARG B 97 ? 0.6870 0.6322 0.5153 -0.0392 0.0583 -0.0511 97 ARG B CD 3092 N NE . ARG B 97 ? 0.6882 0.6255 0.5271 -0.0415 0.0641 -0.0488 97 ARG B NE 3093 C CZ . ARG B 97 ? 0.6999 0.6355 0.5361 -0.0471 0.0666 -0.0340 97 ARG B CZ 3094 N NH1 . ARG B 97 ? 0.7155 0.6536 0.5384 -0.0464 0.0644 -0.0192 97 ARG B NH1 3095 N NH2 . ARG B 97 ? 0.6997 0.6325 0.5447 -0.0551 0.0709 -0.0324 97 ARG B NH2 3096 N N . ASP B 98 ? 0.7013 0.6149 0.5097 -0.0484 0.0475 -0.0979 98 ASP B N 3097 C CA . ASP B 98 ? 0.7282 0.6393 0.5109 -0.0635 0.0418 -0.1045 98 ASP B CA 3098 C C . ASP B 98 ? 0.7342 0.6244 0.5130 -0.0698 0.0368 -0.1115 98 ASP B C 3099 O O . ASP B 98 ? 0.7464 0.6433 0.5113 -0.0874 0.0285 -0.1108 98 ASP B O 3100 C CB . ASP B 98 ? 0.7617 0.6595 0.5150 -0.0666 0.0478 -0.1165 98 ASP B CB 3101 C CG . ASP B 98 ? 0.7614 0.6839 0.5178 -0.0616 0.0534 -0.1080 98 ASP B CG 3102 O OD1 . ASP B 98 ? 0.7540 0.7029 0.5215 -0.0635 0.0490 -0.0923 98 ASP B OD1 3103 O OD2 . ASP B 98 ? 0.7807 0.6973 0.5266 -0.0542 0.0628 -0.1158 98 ASP B OD2 3104 N N . MET B 99 ? 0.7286 0.5976 0.5189 -0.0573 0.0416 -0.1165 99 MET B N 3105 C CA . MET B 99 ? 0.7323 0.5825 0.5225 -0.0605 0.0374 -0.1196 99 MET B CA 3106 C C . MET B 99 ? 0.7032 0.5833 0.5182 -0.0614 0.0306 -0.1073 99 MET B C 3107 O O . MET B 99 ? 0.7110 0.6048 0.5193 -0.0763 0.0226 -0.1030 99 MET B O 3108 C CB . MET B 99 ? 0.7311 0.5591 0.5288 -0.0429 0.0448 -0.1257 99 MET B CB 3109 C CG . MET B 99 ? 0.7699 0.5678 0.5400 -0.0343 0.0530 -0.1383 99 MET B CG 3110 S SD . MET B 99 ? 0.8315 0.5732 0.5541 -0.0475 0.0490 -0.1500 99 MET B SD 3111 N N . THR C 1 ? 0.8782 0.8884 0.6546 -0.2459 0.1313 -0.0636 1 THR C N 3112 C CA . THR C 1 ? 0.8043 0.8342 0.6311 -0.2018 0.1103 -0.0734 1 THR C CA 3113 C C . THR C 1 ? 0.8190 0.7896 0.6170 -0.1712 0.0878 -0.0548 1 THR C C 3114 O O . THR C 1 ? 0.8798 0.7788 0.6314 -0.1756 0.0804 -0.0364 1 THR C O 3115 C CB . THR C 1 ? 0.7730 0.8137 0.6404 -0.2023 0.1074 -0.0855 1 THR C CB 3116 O OG1 . THR C 1 ? 0.7679 0.8696 0.6629 -0.2309 0.1263 -0.1063 1 THR C OG1 3117 C CG2 . THR C 1 ? 0.7084 0.7748 0.6211 -0.1629 0.0903 -0.0950 1 THR C CG2 3118 N N . GLN C 2 ? 0.7682 0.7689 0.5939 -0.1399 0.0757 -0.0622 2 GLN C N 3119 C CA . GLN C 2 ? 0.7740 0.7402 0.5828 -0.1107 0.0546 -0.0517 2 GLN C CA 3120 C C . GLN C 2 ? 0.7292 0.6947 0.5752 -0.0859 0.0399 -0.0569 2 GLN C C 3121 O O . GLN C 2 ? 0.7310 0.6803 0.5726 -0.0615 0.0227 -0.0535 2 GLN C O 3122 C CB . GLN C 2 ? 0.7595 0.7595 0.5708 -0.0975 0.0511 -0.0585 2 GLN C CB 3123 C CG . GLN C 2 ? 0.8210 0.8131 0.5796 -0.1170 0.0624 -0.0506 2 GLN C CG 3124 C CD . GLN C 2 ? 0.8065 0.8465 0.5758 -0.1066 0.0626 -0.0656 2 GLN C CD 3125 O OE1 . GLN C 2 ? 0.7703 0.8301 0.5743 -0.0817 0.0481 -0.0769 2 GLN C OE1 3126 N NE2 . GLN C 2 ? 0.8416 0.9005 0.5791 -0.1283 0.0801 -0.0674 2 GLN C NE2 3127 N N . VAL C 3 ? 0.6913 0.6808 0.5735 -0.0923 0.0467 -0.0673 3 VAL C N 3128 C CA . VAL C 3 ? 0.6567 0.6472 0.5678 -0.0736 0.0365 -0.0721 3 VAL C CA 3129 C C . VAL C 3 ? 0.6670 0.6419 0.5793 -0.0884 0.0420 -0.0749 3 VAL C C 3130 O O . VAL C 3 ? 0.6487 0.6576 0.5826 -0.1040 0.0529 -0.0855 3 VAL C O 3131 C CB . VAL C 3 ? 0.5996 0.6386 0.5541 -0.0614 0.0358 -0.0842 3 VAL C CB 3132 C CG1 . VAL C 3 ? 0.5812 0.6209 0.5565 -0.0465 0.0281 -0.0869 3 VAL C CG1 3133 C CG2 . VAL C 3 ? 0.5907 0.6443 0.5456 -0.0513 0.0307 -0.0855 3 VAL C CG2 3134 N N . GLU C 4 ? 0.7005 0.6259 0.5904 -0.0812 0.0321 -0.0688 4 GLU C N 3135 C CA . GLU C 4 ? 0.7200 0.6212 0.6066 -0.0955 0.0349 -0.0735 4 GLU C CA 3136 C C . GLU C 4 ? 0.6906 0.5988 0.6016 -0.0718 0.0244 -0.0837 4 GLU C C 3137 O O . GLU C 4 ? 0.6927 0.5917 0.6021 -0.0451 0.0116 -0.0828 4 GLU C O 3138 C CB . GLU C 4 ? 0.8054 0.6295 0.6361 -0.1109 0.0322 -0.0600 4 GLU C CB 3139 C CG . GLU C 4 ? 0.8550 0.6674 0.6495 -0.1412 0.0462 -0.0475 4 GLU C CG 3140 C CD . GLU C 4 ? 0.8596 0.7067 0.6690 -0.1824 0.0683 -0.0576 4 GLU C CD 3141 O OE1 . GLU C 4 ? 0.7965 0.7169 0.6575 -0.1796 0.0748 -0.0754 4 GLU C OE1 3142 O OE2 . GLU C 4 ? 0.9348 0.7354 0.7020 -0.2182 0.0786 -0.0487 4 GLU C OE2 3143 N N . GLN C 5 ? 0.6655 0.5964 0.5990 -0.0815 0.0299 -0.0962 5 GLN C N 3144 C CA . GLN C 5 ? 0.6400 0.5825 0.5925 -0.0623 0.0226 -0.1075 5 GLN C CA 3145 C C . GLN C 5 ? 0.6825 0.5876 0.6212 -0.0724 0.0197 -0.1167 5 GLN C C 3146 O O . GLN C 5 ? 0.7087 0.6038 0.6401 -0.1019 0.0279 -0.1193 5 GLN C O 3147 C CB . GLN C 5 ? 0.5825 0.5844 0.5692 -0.0592 0.0276 -0.1155 5 GLN C CB 3148 C CG . GLN C 5 ? 0.5399 0.5701 0.5395 -0.0470 0.0276 -0.1089 5 GLN C CG 3149 C CD . GLN C 5 ? 0.4893 0.5592 0.5106 -0.0429 0.0294 -0.1142 5 GLN C CD 3150 O OE1 . GLN C 5 ? 0.4725 0.5621 0.5021 -0.0463 0.0319 -0.1141 5 GLN C OE1 3151 N NE2 . GLN C 5 ? 0.4821 0.5606 0.5077 -0.0335 0.0268 -0.1195 5 GLN C NE2 3152 N N . SER C 6 ? 0.6937 0.5822 0.6304 -0.0489 0.0086 -0.1250 6 SER C N 3153 C CA . SER C 6 ? 0.7353 0.5871 0.6598 -0.0531 0.0030 -0.1386 6 SER C CA 3154 C C . SER C 6 ? 0.7083 0.5951 0.6542 -0.0275 -0.0022 -0.1558 6 SER C C 3155 O O . SER C 6 ? 0.6833 0.5980 0.6408 -0.0029 -0.0049 -0.1551 6 SER C O 3156 C CB . SER C 6 ? 0.8153 0.5813 0.6951 -0.0492 -0.0092 -0.1319 6 SER C CB 3157 O OG . SER C 6 ? 0.8219 0.5816 0.6967 -0.0124 -0.0227 -0.1296 6 SER C OG 3158 N N . PRO C 7 ? 0.7155 0.6064 0.6663 -0.0355 -0.0025 -0.1731 7 PRO C N 3159 C CA . PRO C 7 ? 0.7470 0.6144 0.6901 -0.0687 0.0011 -0.1794 7 PRO C CA 3160 C C . PRO C 7 ? 0.7020 0.6286 0.6707 -0.0902 0.0131 -0.1780 7 PRO C C 3161 O O . PRO C 7 ? 0.6510 0.6248 0.6378 -0.0766 0.0164 -0.1706 7 PRO C O 3162 C CB . PRO C 7 ? 0.7677 0.6319 0.7126 -0.0602 -0.0070 -0.2043 7 PRO C CB 3163 C CG . PRO C 7 ? 0.7192 0.6397 0.6830 -0.0297 -0.0075 -0.2093 7 PRO C CG 3164 C CD . PRO C 7 ? 0.6948 0.6230 0.6602 -0.0135 -0.0056 -0.1906 7 PRO C CD 3165 N N . GLN C 8 ? 0.7270 0.6508 0.6969 -0.1237 0.0188 -0.1872 8 GLN C N 3166 C CA . GLN C 8 ? 0.6898 0.6800 0.6892 -0.1400 0.0275 -0.1938 8 GLN C CA 3167 C C . GLN C 8 ? 0.6485 0.6936 0.6708 -0.1161 0.0199 -0.2077 8 GLN C C 3168 O O . GLN C 8 ? 0.6052 0.6963 0.6436 -0.1023 0.0205 -0.2027 8 GLN C O 3169 C CB . GLN C 8 ? 0.7303 0.7165 0.7307 -0.1833 0.0354 -0.2078 8 GLN C CB 3170 C CG . GLN C 8 ? 0.7153 0.7587 0.7379 -0.2063 0.0490 -0.2097 8 GLN C CG 3171 C CD . GLN C 8 ? 0.7614 0.7654 0.7554 -0.2287 0.0619 -0.1883 8 GLN C CD 3172 O OE1 . GLN C 8 ? 0.7497 0.7334 0.7281 -0.2059 0.0596 -0.1676 8 GLN C OE1 3173 N NE2 . GLN C 8 ? 0.8111 0.8066 0.7959 -0.2762 0.0760 -0.1943 8 GLN C NE2 3174 N N . SER C 9 ? 0.6695 0.7027 0.6868 -0.1104 0.0115 -0.2248 9 SER C N 3175 C CA . SER C 9 ? 0.6440 0.7200 0.6703 -0.0862 0.0036 -0.2361 9 SER C CA 3176 C C . SER C 9 ? 0.6720 0.7176 0.6807 -0.0677 -0.0035 -0.2458 9 SER C C 3177 O O . SER C 9 ? 0.7184 0.7091 0.7117 -0.0761 -0.0067 -0.2525 9 SER C O 3178 C CB . SER C 9 ? 0.6393 0.7657 0.6862 -0.0987 -0.0007 -0.2590 9 SER C CB 3179 O OG . SER C 9 ? 0.6804 0.7845 0.7259 -0.1233 -0.0031 -0.2810 9 SER C OG 3180 N N . LEU C 10 ? 0.6510 0.7301 0.6581 -0.0424 -0.0063 -0.2472 10 LEU C N 3181 C CA . LEU C 10 ? 0.6710 0.7378 0.6639 -0.0214 -0.0107 -0.2594 10 LEU C CA 3182 C C . LEU C 10 ? 0.6697 0.7802 0.6581 -0.0095 -0.0155 -0.2759 10 LEU C C 3183 O O . LEU C 10 ? 0.6445 0.7935 0.6311 -0.0021 -0.0133 -0.2644 10 LEU C O 3184 C CB . LEU C 10 ? 0.6539 0.7185 0.6429 -0.0020 -0.0050 -0.2425 10 LEU C CB 3185 C CG . LEU C 10 ? 0.6714 0.7385 0.6517 0.0232 -0.0071 -0.2572 10 LEU C CG 3186 C CD1 . LEU C 10 ? 0.7162 0.7263 0.6859 0.0286 -0.0183 -0.2762 10 LEU C CD1 3187 C CD2 . LEU C 10 ? 0.6433 0.7301 0.6293 0.0363 0.0006 -0.2414 10 LEU C CD2 3188 N N . VAL C 11 ? 0.7063 0.8043 0.6872 -0.0074 -0.0235 -0.3031 11 VAL C N 3189 C CA . VAL C 11 ? 0.7156 0.8529 0.6857 0.0062 -0.0293 -0.3224 11 VAL C CA 3190 C C . VAL C 11 ? 0.7304 0.8693 0.6849 0.0311 -0.0260 -0.3305 11 VAL C C 3191 O O . VAL C 11 ? 0.7634 0.8629 0.7162 0.0381 -0.0301 -0.3456 11 VAL C O 3192 C CB . VAL C 11 ? 0.7512 0.8839 0.7251 -0.0082 -0.0416 -0.3546 11 VAL C CB 3193 C CG1 . VAL C 11 ? 0.7599 0.9395 0.7191 0.0077 -0.0498 -0.3747 11 VAL C CG1 3194 C CG2 . VAL C 11 ? 0.7427 0.8823 0.7391 -0.0374 -0.0423 -0.3521 11 VAL C CG2 3195 N N . VAL C 12 ? 0.7142 0.8974 0.6550 0.0443 -0.0186 -0.3214 12 VAL C N 3196 C CA . VAL C 12 ? 0.7277 0.9322 0.6553 0.0649 -0.0115 -0.3331 12 VAL C CA 3197 C C . VAL C 12 ? 0.7441 0.9941 0.6440 0.0732 -0.0106 -0.3445 12 VAL C C 3198 O O . VAL C 12 ? 0.7363 1.0040 0.6215 0.0668 -0.0129 -0.3293 12 VAL C O 3199 C CB . VAL C 12 ? 0.7021 0.9195 0.6362 0.0689 0.0034 -0.3097 12 VAL C CB 3200 C CG1 . VAL C 12 ? 0.7042 0.8782 0.6584 0.0708 -0.0002 -0.3072 12 VAL C CG1 3201 C CG2 . VAL C 12 ? 0.6725 0.9056 0.6001 0.0553 0.0110 -0.2767 12 VAL C CG2 3202 N N . ARG C 13 ? 0.7715 1.0391 0.6605 0.0905 -0.0089 -0.3725 13 ARG C N 3203 C CA . ARG C 13 ? 0.7943 1.1089 0.6500 0.0993 -0.0051 -0.3846 13 ARG C CA 3204 C C . ARG C 13 ? 0.7815 1.1320 0.6174 0.0951 0.0154 -0.3560 13 ARG C C 3205 O O . ARG C 13 ? 0.7655 1.1254 0.6182 0.0963 0.0293 -0.3498 13 ARG C O 3206 C CB . ARG C 13 ? 0.8334 1.1600 0.6848 0.1200 -0.0081 -0.4275 13 ARG C CB 3207 C CG . ARG C 13 ? 0.8658 1.1533 0.7252 0.1211 -0.0297 -0.4601 13 ARG C CG 3208 C CD . ARG C 13 ? 0.9072 1.2004 0.7599 0.1460 -0.0343 -0.5053 13 ARG C CD 3209 N N . GLN C 14 ? 0.7959 1.1637 0.5938 0.0894 0.0158 -0.3393 14 GLN C N 3210 C CA . GLN C 14 ? 0.8060 1.1977 0.5694 0.0800 0.0354 -0.3108 14 GLN C CA 3211 C C . GLN C 14 ? 0.8171 1.2544 0.5806 0.0835 0.0580 -0.3272 14 GLN C C 3212 O O . GLN C 14 ? 0.8415 1.3080 0.5988 0.0993 0.0574 -0.3629 14 GLN C O 3213 C CB . GLN C 14 ? 0.8502 1.2503 0.5563 0.0810 0.0280 -0.3016 14 GLN C CB 3214 C CG . GLN C 14 ? 0.8890 1.3042 0.5411 0.0676 0.0488 -0.2719 14 GLN C CG 3215 C CD . GLN C 14 ? 0.9568 1.3860 0.5398 0.0742 0.0428 -0.2729 14 GLN C CD 3216 O OE1 . GLN C 14 ? 0.9768 1.4376 0.5513 0.0884 0.0383 -0.3079 14 GLN C OE1 3217 N NE2 . GLN C 14 ? 1.0002 1.4010 0.5280 0.0655 0.0408 -0.2348 14 GLN C NE2 3218 N N . GLY C 15 ? 0.8000 1.2483 0.5734 0.0691 0.0773 -0.3050 15 GLY C N 3219 C CA . GLY C 15 ? 0.8110 1.3179 0.5901 0.0688 0.1013 -0.3218 15 GLY C CA 3220 C C . GLY C 15 ? 0.7802 1.2953 0.6163 0.0853 0.0990 -0.3465 15 GLY C C 3221 O O . GLY C 15 ? 0.7793 1.3483 0.6324 0.0847 0.1179 -0.3586 15 GLY C O 3222 N N . GLU C 16 ? 0.7636 1.2264 0.6267 0.0996 0.0753 -0.3551 16 GLU C N 3223 C CA . GLU C 16 ? 0.7475 1.1970 0.6543 0.1173 0.0673 -0.3725 16 GLU C CA 3224 C C . GLU C 16 ? 0.7091 1.1348 0.6383 0.1015 0.0697 -0.3392 16 GLU C C 3225 O O . GLU C 16 ? 0.6953 1.1081 0.6080 0.0778 0.0757 -0.3050 16 GLU C O 3226 C CB . GLU C 16 ? 0.7633 1.1560 0.6777 0.1352 0.0415 -0.3954 16 GLU C CB 3227 C CG . GLU C 16 ? 0.8111 1.2265 0.7120 0.1583 0.0360 -0.4397 16 GLU C CG 3228 C CD . GLU C 16 ? 0.8420 1.1918 0.7425 0.1667 0.0103 -0.4600 16 GLU C CD 3229 O OE1 . GLU C 16 ? 0.8295 1.1189 0.7414 0.1529 -0.0012 -0.4395 16 GLU C OE1 3230 O OE2 . GLU C 16 ? 0.8833 1.2434 0.7708 0.1845 0.0027 -0.4981 16 GLU C OE2 3231 N N . ASN C 17 ? 0.6992 1.1172 0.6625 0.1177 0.0628 -0.3510 17 ASN C N 3232 C CA . ASN C 17 ? 0.6676 1.0651 0.6526 0.1065 0.0627 -0.3246 17 ASN C CA 3233 C C . ASN C 17 ? 0.6613 0.9815 0.6489 0.1053 0.0425 -0.3103 17 ASN C C 3234 O O . ASN C 17 ? 0.6883 0.9682 0.6737 0.1210 0.0258 -0.3297 17 ASN C O 3235 C CB . ASN C 17 ? 0.6643 1.1015 0.6826 0.1264 0.0643 -0.3457 17 ASN C CB 3236 C CG . ASN C 17 ? 0.6726 1.2016 0.6954 0.1223 0.0885 -0.3636 17 ASN C CG 3237 O OD1 . ASN C 17 ? 0.6836 1.2387 0.6788 0.0962 0.1078 -0.3486 17 ASN C OD1 3238 N ND2 . ASN C 17 ? 0.6790 1.2587 0.7343 0.1483 0.0873 -0.3968 17 ASN C ND2 3239 N N . SER C 18 ? 0.6338 0.9331 0.6242 0.0845 0.0450 -0.2777 18 SER C N 3240 C CA . SER C 18 ? 0.6288 0.8658 0.6228 0.0791 0.0304 -0.2639 18 SER C CA 3241 C C . SER C 18 ? 0.6089 0.8340 0.6215 0.0782 0.0294 -0.2486 18 SER C C 3242 O O . SER C 18 ? 0.5879 0.8477 0.6092 0.0679 0.0416 -0.2356 18 SER C O 3243 C CB . SER C 18 ? 0.6195 0.8408 0.5981 0.0587 0.0300 -0.2446 18 SER C CB 3244 O OG . SER C 18 ? 0.6154 0.8673 0.5822 0.0455 0.0432 -0.2252 18 SER C OG 3245 N N . VAL C 19 ? 0.6246 0.7967 0.6385 0.0870 0.0141 -0.2505 19 VAL C N 3246 C CA . VAL C 19 ? 0.6166 0.7711 0.6410 0.0911 0.0086 -0.2388 19 VAL C CA 3247 C C . VAL C 19 ? 0.6132 0.7158 0.6276 0.0709 0.0044 -0.2155 19 VAL C C 3248 O O . VAL C 19 ? 0.6383 0.6959 0.6383 0.0643 -0.0028 -0.2185 19 VAL C O 3249 C CB . VAL C 19 ? 0.6557 0.7886 0.6809 0.1242 -0.0081 -0.2617 19 VAL C CB 3250 C CG1 . VAL C 19 ? 0.6623 0.7654 0.6886 0.1313 -0.0190 -0.2484 19 VAL C CG1 3251 C CG2 . VAL C 19 ? 0.6546 0.8570 0.6977 0.1464 -0.0024 -0.2901 19 VAL C CG2 3252 N N . LEU C 20 ? 0.5864 0.6995 0.6092 0.0589 0.0102 -0.1951 20 LEU C N 3253 C CA . LEU C 20 ? 0.5822 0.6592 0.5977 0.0403 0.0088 -0.1756 20 LEU C CA 3254 C C . LEU C 20 ? 0.5871 0.6456 0.6024 0.0463 0.0025 -0.1658 20 LEU C C 3255 O O . LEU C 20 ? 0.5716 0.6653 0.6022 0.0552 0.0042 -0.1671 20 LEU C O 3256 C CB . LEU C 20 ? 0.5498 0.6534 0.5703 0.0216 0.0193 -0.1617 20 LEU C CB 3257 C CG . LEU C 20 ? 0.5551 0.6801 0.5697 0.0176 0.0233 -0.1681 20 LEU C CG 3258 C CD1 . LEU C 20 ? 0.5420 0.6876 0.5550 0.0072 0.0300 -0.1524 20 LEU C CD1 3259 C CD2 . LEU C 20 ? 0.5737 0.6742 0.5817 0.0102 0.0167 -0.1767 20 LEU C CD2 3260 N N . GLN C 21 ? 0.6149 0.6202 0.6104 0.0387 -0.0042 -0.1569 21 GLN C N 3261 C CA . GLN C 21 ? 0.6360 0.6131 0.6190 0.0468 -0.0133 -0.1471 21 GLN C CA 3262 C C . GLN C 21 ? 0.6146 0.5927 0.5954 0.0254 -0.0057 -0.1283 21 GLN C C 3263 O O . GLN C 21 ? 0.5988 0.5823 0.5821 0.0033 0.0041 -0.1234 21 GLN C O 3264 C CB . GLN C 21 ? 0.7052 0.6083 0.6532 0.0553 -0.0281 -0.1488 21 GLN C CB 3265 C CG . GLN C 21 ? 0.7431 0.6343 0.6892 0.0800 -0.0390 -0.1718 21 GLN C CG 3266 C CD . GLN C 21 ? 0.7517 0.6789 0.7144 0.1170 -0.0498 -0.1880 21 GLN C CD 3267 O OE1 . GLN C 21 ? 0.7362 0.6911 0.7098 0.1234 -0.0514 -0.1814 21 GLN C OE1 3268 N NE2 . GLN C 21 ? 0.7770 0.7103 0.7441 0.1420 -0.0577 -0.2137 21 GLN C NE2 3269 N N . CYS C 22 ? 0.6164 0.5945 0.5939 0.0350 -0.0121 -0.1218 22 CYS C N 3270 C CA . CYS C 22 ? 0.6079 0.5824 0.5774 0.0188 -0.0074 -0.1069 22 CYS C CA 3271 C C . CYS C 22 ? 0.6507 0.5854 0.5895 0.0320 -0.0216 -0.0995 22 CYS C C 3272 O O . CYS C 22 ? 0.6626 0.6049 0.6053 0.0590 -0.0358 -0.1081 22 CYS C O 3273 C CB . CYS C 22 ? 0.5584 0.5865 0.5574 0.0148 0.0003 -0.1073 22 CYS C CB 3274 S SG . CYS C 22 ? 0.5614 0.5909 0.5544 -0.0034 0.0067 -0.0955 22 CYS C SG 3275 N N . ASN C 23 ? 0.6784 0.5738 0.5844 0.0131 -0.0182 -0.0850 23 ASN C N 3276 C CA . ASN C 23 ? 0.7295 0.5811 0.5940 0.0223 -0.0311 -0.0733 23 ASN C CA 3277 C C . ASN C 23 ? 0.7197 0.5837 0.5740 -0.0004 -0.0192 -0.0620 23 ASN C C 3278 O O . ASN C 23 ? 0.7165 0.5830 0.5696 -0.0294 -0.0024 -0.0586 23 ASN C O 3279 C CB . ASN C 23 ? 0.8124 0.5801 0.6253 0.0209 -0.0405 -0.0651 23 ASN C CB 3280 C CG . ASN C 23 ? 0.8352 0.5846 0.6533 0.0514 -0.0571 -0.0805 23 ASN C CG 3281 O OD1 . ASN C 23 ? 0.8639 0.6047 0.6740 0.0875 -0.0784 -0.0869 23 ASN C OD1 3282 N ND2 . ASN C 23 ? 0.8251 0.5733 0.6575 0.0396 -0.0488 -0.0903 23 ASN C ND2 3283 N N . TYR C 24 ? 0.7163 0.5953 0.5659 0.0138 -0.0284 -0.0604 24 TYR C N 3284 C CA . TYR C 24 ? 0.7025 0.6012 0.5449 -0.0034 -0.0182 -0.0545 24 TYR C CA 3285 C C . TYR C 24 ? 0.7615 0.6247 0.5528 0.0066 -0.0319 -0.0431 24 TYR C C 3286 O O . TYR C 24 ? 0.8018 0.6350 0.5721 0.0346 -0.0539 -0.0424 24 TYR C O 3287 C CB . TYR C 24 ? 0.6332 0.5979 0.5267 -0.0010 -0.0132 -0.0679 24 TYR C CB 3288 C CG . TYR C 24 ? 0.6165 0.6085 0.5316 0.0239 -0.0291 -0.0785 24 TYR C CG 3289 C CD1 . TYR C 24 ? 0.6283 0.6298 0.5313 0.0339 -0.0405 -0.0801 24 TYR C CD1 3290 C CD2 . TYR C 24 ? 0.5868 0.6033 0.5359 0.0358 -0.0317 -0.0901 24 TYR C CD2 3291 C CE1 . TYR C 24 ? 0.6105 0.6477 0.5394 0.0544 -0.0553 -0.0946 24 TYR C CE1 3292 C CE2 . TYR C 24 ? 0.5742 0.6292 0.5487 0.0543 -0.0435 -0.1042 24 TYR C CE2 3293 C CZ . TYR C 24 ? 0.5872 0.6539 0.5540 0.0631 -0.0558 -0.1073 24 TYR C CZ 3294 O OH . TYR C 24 ? 0.5746 0.6893 0.5721 0.0792 -0.0679 -0.1259 24 TYR C OH 3295 N N . SER C 25 ? 0.7707 0.6403 0.5404 -0.0136 -0.0201 -0.0362 25 SER C N 3296 C CA . SER C 25 ? 0.8293 0.6709 0.5449 -0.0063 -0.0312 -0.0251 25 SER C CA 3297 C C . SER C 25 ? 0.7937 0.6924 0.5296 -0.0069 -0.0273 -0.0361 25 SER C C 3298 O O . SER C 25 ? 0.8388 0.7251 0.5299 -0.0049 -0.0330 -0.0292 25 SER C O 3299 C CB . SER C 25 ? 0.9078 0.6868 0.5551 -0.0346 -0.0201 -0.0037 25 SER C CB 3300 O OG . SER C 25 ? 0.8736 0.6876 0.5398 -0.0711 0.0084 -0.0077 25 SER C OG 3301 N N . VAL C 26 ? 0.7206 0.6757 0.5187 -0.0089 -0.0191 -0.0532 26 VAL C N 3302 C CA . VAL C 26 ? 0.6881 0.6915 0.5108 -0.0089 -0.0169 -0.0675 26 VAL C CA 3303 C C . VAL C 26 ? 0.7071 0.7192 0.5213 0.0146 -0.0393 -0.0739 26 VAL C C 3304 O O . VAL C 26 ? 0.7054 0.7196 0.5360 0.0352 -0.0560 -0.0787 26 VAL C O 3305 C CB . VAL C 26 ? 0.6219 0.6658 0.5058 -0.0123 -0.0091 -0.0824 26 VAL C CB 3306 C CG1 . VAL C 26 ? 0.5943 0.6744 0.4999 -0.0112 -0.0104 -0.0984 26 VAL C CG1 3307 C CG2 . VAL C 26 ? 0.6050 0.6486 0.4978 -0.0314 0.0092 -0.0800 26 VAL C CG2 3308 N N . THR C 27 ? 0.7297 0.7538 0.5200 0.0121 -0.0399 -0.0777 27 THR C N 3309 C CA . THR C 27 ? 0.7515 0.7900 0.5321 0.0334 -0.0623 -0.0873 27 THR C CA 3310 C C . THR C 27 ? 0.7263 0.8082 0.5293 0.0263 -0.0576 -0.1072 27 THR C C 3311 O O . THR C 27 ? 0.7427 0.8267 0.5215 0.0120 -0.0429 -0.1064 27 THR C O 3312 C CB . THR C 27 ? 0.8361 0.8275 0.5385 0.0435 -0.0752 -0.0692 27 THR C CB 3313 O OG1 . THR C 27 ? 0.8798 0.8147 0.5529 0.0471 -0.0784 -0.0497 27 THR C OG1 3314 C CG2 . THR C 27 ? 0.8589 0.8671 0.5527 0.0733 -0.1051 -0.0814 27 THR C CG2 3315 N N . PRO C 28 ? 0.6937 0.8116 0.5429 0.0348 -0.0696 -0.1277 28 PRO C N 3316 C CA . PRO C 28 ? 0.6766 0.8090 0.5608 0.0486 -0.0840 -0.1343 28 PRO C CA 3317 C C . PRO C 28 ? 0.6301 0.7679 0.5597 0.0357 -0.0688 -0.1334 28 PRO C C 3318 O O . PRO C 28 ? 0.6095 0.7438 0.5496 0.0184 -0.0512 -0.1316 28 PRO C O 3319 C CB . PRO C 28 ? 0.6681 0.8441 0.5801 0.0531 -0.0988 -0.1599 28 PRO C CB 3320 C CG . PRO C 28 ? 0.6680 0.8473 0.5692 0.0396 -0.0892 -0.1680 28 PRO C CG 3321 C CD . PRO C 28 ? 0.6751 0.8249 0.5467 0.0280 -0.0682 -0.1496 28 PRO C CD 3322 N N . ASP C 29 ? 0.6200 0.7689 0.5736 0.0467 -0.0767 -0.1365 29 ASP C N 3323 C CA . ASP C 29 ? 0.5800 0.7370 0.5711 0.0353 -0.0628 -0.1361 29 ASP C CA 3324 C C . ASP C 29 ? 0.5518 0.7558 0.5921 0.0275 -0.0645 -0.1561 29 ASP C C 3325 O O . ASP C 29 ? 0.5513 0.7884 0.6132 0.0400 -0.0757 -0.1687 29 ASP C O 3326 C CB . ASP C 29 ? 0.5941 0.7281 0.5733 0.0493 -0.0656 -0.1258 29 ASP C CB 3327 C CG . ASP C 29 ? 0.6336 0.7736 0.6015 0.0799 -0.0906 -0.1335 29 ASP C CG 3328 O OD1 . ASP C 29 ? 0.6566 0.8151 0.6171 0.0907 -0.1066 -0.1435 29 ASP C OD1 3329 O OD2 . ASP C 29 ? 0.6478 0.7742 0.6134 0.0967 -0.0968 -0.1322 29 ASP C OD2 3330 N N . ASN C 30 ? 0.5337 0.7401 0.5899 0.0062 -0.0538 -0.1608 30 ASN C N 3331 C CA . ASN C 30 ? 0.5212 0.7603 0.6163 -0.0107 -0.0528 -0.1776 30 ASN C CA 3332 C C . ASN C 30 ? 0.5030 0.7537 0.6226 -0.0217 -0.0400 -0.1740 30 ASN C C 3333 O O . ASN C 30 ? 0.4986 0.7937 0.6479 -0.0241 -0.0424 -0.1885 30 ASN C O 3334 C CB . ASN C 30 ? 0.5247 0.7455 0.6192 -0.0288 -0.0480 -0.1826 30 ASN C CB 3335 C CG . ASN C 30 ? 0.5287 0.7677 0.6555 -0.0540 -0.0454 -0.1973 30 ASN C CG 3336 O OD1 . ASN C 30 ? 0.5277 0.7461 0.6599 -0.0727 -0.0326 -0.1892 30 ASN C OD1 3337 N ND2 . ASN C 30 ? 0.5377 0.8143 0.6827 -0.0566 -0.0582 -0.2191 30 ASN C ND2 3338 N N . HIS C 31 ? 0.4946 0.7116 0.6018 -0.0282 -0.0265 -0.1575 31 HIS C N 3339 C CA . HIS C 31 ? 0.4831 0.7056 0.6039 -0.0387 -0.0136 -0.1521 31 HIS C CA 3340 C C . HIS C 31 ? 0.4762 0.6672 0.5760 -0.0300 -0.0068 -0.1355 31 HIS C C 3341 O O . HIS C 31 ? 0.4783 0.6420 0.5559 -0.0239 -0.0081 -0.1279 31 HIS C O 3342 C CB . HIS C 31 ? 0.4917 0.7056 0.6217 -0.0671 -0.0039 -0.1530 31 HIS C CB 3343 C CG . HIS C 31 ? 0.5074 0.6737 0.6151 -0.0696 -0.0031 -0.1440 31 HIS C CG 3344 N ND1 . HIS C 31 ? 0.5276 0.6806 0.6307 -0.0717 -0.0115 -0.1537 31 HIS C ND1 3345 C CD2 . HIS C 31 ? 0.5105 0.6443 0.6010 -0.0668 0.0028 -0.1306 31 HIS C CD2 3346 C CE1 . HIS C 31 ? 0.5368 0.6518 0.6217 -0.0681 -0.0105 -0.1476 31 HIS C CE1 3347 N NE2 . HIS C 31 ? 0.5292 0.6338 0.6072 -0.0648 -0.0025 -0.1335 31 HIS C NE2 3348 N N . LEU C 32 ? 0.4680 0.6692 0.5760 -0.0313 0.0012 -0.1330 32 LEU C N 3349 C CA . LEU C 32 ? 0.4631 0.6389 0.5549 -0.0262 0.0074 -0.1210 32 LEU C CA 3350 C C . LEU C 32 ? 0.4599 0.6346 0.5545 -0.0421 0.0196 -0.1159 32 LEU C C 3351 O O . LEU C 32 ? 0.4621 0.6656 0.5720 -0.0534 0.0262 -0.1220 32 LEU C O 3352 C CB . LEU C 32 ? 0.4682 0.6486 0.5565 -0.0064 0.0016 -0.1238 32 LEU C CB 3353 C CG . LEU C 32 ? 0.4782 0.6275 0.5472 -0.0019 0.0052 -0.1143 32 LEU C CG 3354 C CD1 . LEU C 32 ? 0.5055 0.6294 0.5530 0.0155 -0.0061 -0.1129 32 LEU C CD1 3355 C CD2 . LEU C 32 ? 0.4678 0.6315 0.5460 -0.0041 0.0139 -0.1172 32 LEU C CD2 3356 N N . ARG C 33 ? 0.4591 0.6038 0.5370 -0.0431 0.0224 -0.1059 33 ARG C N 3357 C CA . ARG C 33 ? 0.4690 0.6015 0.5378 -0.0543 0.0298 -0.0983 33 ARG C CA 3358 C C . ARG C 33 ? 0.4636 0.5871 0.5206 -0.0445 0.0313 -0.0935 33 ARG C C 3359 O O . ARG C 33 ? 0.4561 0.5694 0.5088 -0.0352 0.0269 -0.0940 33 ARG C O 3360 C CB . ARG C 33 ? 0.4868 0.5879 0.5442 -0.0618 0.0259 -0.0945 33 ARG C CB 3361 C CG . ARG C 33 ? 0.5237 0.5997 0.5622 -0.0757 0.0304 -0.0845 33 ARG C CG 3362 C CD . ARG C 33 ? 0.5685 0.6005 0.5907 -0.0775 0.0214 -0.0826 33 ARG C CD 3363 N NE . ARG C 33 ? 0.5934 0.6231 0.6248 -0.0952 0.0208 -0.0895 33 ARG C NE 3364 C CZ . ARG C 33 ? 0.6337 0.6511 0.6574 -0.1232 0.0282 -0.0851 33 ARG C CZ 3365 N NH1 . ARG C 33 ? 0.6524 0.6575 0.6539 -0.1360 0.0378 -0.0712 33 ARG C NH1 3366 N NH2 . ARG C 33 ? 0.6477 0.6670 0.6839 -0.1415 0.0267 -0.0956 33 ARG C NH2 3367 N N . TRP C 34 ? 0.4701 0.6016 0.5213 -0.0494 0.0386 -0.0909 34 TRP C N 3368 C CA . TRP C 34 ? 0.4715 0.5968 0.5101 -0.0411 0.0386 -0.0889 34 TRP C CA 3369 C C . TRP C 34 ? 0.4964 0.5963 0.5115 -0.0445 0.0368 -0.0790 34 TRP C C 3370 O O . TRP C 34 ? 0.5232 0.6122 0.5235 -0.0585 0.0417 -0.0708 34 TRP C O 3371 C CB . TRP C 34 ? 0.4703 0.6221 0.5124 -0.0390 0.0456 -0.0956 34 TRP C CB 3372 C CG . TRP C 34 ? 0.4553 0.6194 0.5120 -0.0251 0.0411 -0.1071 34 TRP C CG 3373 C CD1 . TRP C 34 ? 0.4536 0.6419 0.5278 -0.0203 0.0396 -0.1166 34 TRP C CD1 3374 C CD2 . TRP C 34 ? 0.4520 0.5999 0.5030 -0.0134 0.0351 -0.1114 34 TRP C CD2 3375 N NE1 . TRP C 34 ? 0.4556 0.6356 0.5299 -0.0016 0.0305 -0.1246 34 TRP C NE1 3376 C CE2 . TRP C 34 ? 0.4546 0.6053 0.5129 -0.0003 0.0289 -0.1203 34 TRP C CE2 3377 C CE3 . TRP C 34 ? 0.4516 0.5825 0.4915 -0.0135 0.0332 -0.1103 34 TRP C CE3 3378 C CZ2 . TRP C 34 ? 0.4636 0.5867 0.5110 0.0102 0.0213 -0.1246 34 TRP C CZ2 3379 C CZ3 . TRP C 34 ? 0.4585 0.5727 0.4948 -0.0078 0.0283 -0.1170 34 TRP C CZ3 3380 C CH2 . TRP C 34 ? 0.4667 0.5702 0.5031 0.0028 0.0227 -0.1223 34 TRP C CH2 3381 N N . PHE C 35 ? 0.4963 0.5862 0.5057 -0.0324 0.0288 -0.0808 35 PHE C N 3382 C CA . PHE C 35 ? 0.5266 0.5932 0.5115 -0.0264 0.0210 -0.0745 35 PHE C CA 3383 C C . PHE C 35 ? 0.5318 0.6104 0.5065 -0.0181 0.0193 -0.0779 35 PHE C C 3384 O O . PHE C 35 ? 0.5077 0.6087 0.4988 -0.0158 0.0220 -0.0883 35 PHE C O 3385 C CB . PHE C 35 ? 0.5262 0.5823 0.5164 -0.0139 0.0092 -0.0808 35 PHE C CB 3386 C CG . PHE C 35 ? 0.5421 0.5755 0.5315 -0.0187 0.0066 -0.0784 35 PHE C CG 3387 C CD1 . PHE C 35 ? 0.5905 0.5805 0.5518 -0.0171 -0.0022 -0.0700 35 PHE C CD1 3388 C CD2 . PHE C 35 ? 0.5208 0.5698 0.5320 -0.0239 0.0107 -0.0851 35 PHE C CD2 3389 C CE1 . PHE C 35 ? 0.6107 0.5732 0.5700 -0.0227 -0.0062 -0.0707 35 PHE C CE1 3390 C CE2 . PHE C 35 ? 0.5370 0.5675 0.5478 -0.0281 0.0068 -0.0868 35 PHE C CE2 3391 C CZ . PHE C 35 ? 0.5813 0.5686 0.5684 -0.0284 -0.0013 -0.0808 35 PHE C CZ 3392 N N . LYS C 36 ? 0.5712 0.6287 0.5136 -0.0135 0.0129 -0.0692 36 LYS C N 3393 C CA . LYS C 36 ? 0.5847 0.6531 0.5127 -0.0019 0.0065 -0.0742 36 LYS C CA 3394 C C . LYS C 36 ? 0.6077 0.6615 0.5242 0.0186 -0.0132 -0.0777 36 LYS C C 3395 O O . LYS C 36 ? 0.6502 0.6643 0.5401 0.0239 -0.0224 -0.0663 36 LYS C O 3396 C CB . LYS C 36 ? 0.6229 0.6834 0.5142 -0.0108 0.0144 -0.0620 36 LYS C CB 3397 C CG . LYS C 36 ? 0.6403 0.7122 0.5098 0.0024 0.0064 -0.0680 36 LYS C CG 3398 C CD . LYS C 36 ? 0.6926 0.7491 0.5119 -0.0070 0.0137 -0.0520 36 LYS C CD 3399 C CE . LYS C 36 ? 0.7196 0.7880 0.5120 0.0089 0.0031 -0.0593 36 LYS C CE 3400 N NZ . LYS C 36 ? 0.7813 0.8310 0.5129 -0.0007 0.0103 -0.0413 36 LYS C NZ 3401 N N . GLN C 37 ? 0.5895 0.6752 0.5264 0.0303 -0.0209 -0.0961 37 GLN C N 3402 C CA . GLN C 37 ? 0.6090 0.6988 0.5436 0.0538 -0.0416 -0.1073 37 GLN C CA 3403 C C . GLN C 37 ? 0.6320 0.7409 0.5516 0.0673 -0.0536 -0.1168 37 GLN C C 3404 O O . GLN C 37 ? 0.6035 0.7522 0.5495 0.0616 -0.0498 -0.1348 37 GLN C O 3405 C CB . GLN C 37 ? 0.5696 0.6945 0.5479 0.0546 -0.0412 -0.1275 37 GLN C CB 3406 C CG . GLN C 37 ? 0.5884 0.7264 0.5711 0.0822 -0.0627 -0.1442 37 GLN C CG 3407 C CD . GLN C 37 ? 0.5474 0.7373 0.5757 0.0789 -0.0582 -0.1691 37 GLN C CD 3408 O OE1 . GLN C 37 ? 0.5154 0.7292 0.5671 0.0542 -0.0405 -0.1735 37 GLN C OE1 3409 N NE2 . GLN C 37 ? 0.5561 0.7619 0.5935 0.1041 -0.0747 -0.1865 37 GLN C NE2 3410 N N . ASP C 38 ? 0.6933 0.7681 0.5653 0.0843 -0.0693 -0.1044 38 ASP C N 3411 C CA . ASP C 38 ? 0.7281 0.8192 0.5785 0.1039 -0.0869 -0.1143 38 ASP C CA 3412 C C . ASP C 38 ? 0.7202 0.8531 0.6041 0.1283 -0.1077 -0.1432 38 ASP C C 3413 O O . ASP C 38 ? 0.7180 0.8476 0.6198 0.1389 -0.1143 -0.1489 38 ASP C O 3414 C CB . ASP C 38 ? 0.8076 0.8405 0.5861 0.1164 -0.0999 -0.0895 38 ASP C CB 3415 C CG . ASP C 38 ? 0.8282 0.8396 0.5732 0.0884 -0.0765 -0.0666 38 ASP C CG 3416 O OD1 . ASP C 38 ? 0.7999 0.8520 0.5638 0.0755 -0.0617 -0.0774 38 ASP C OD1 3417 O OD2 . ASP C 38 ? 0.8854 0.8399 0.5845 0.0784 -0.0727 -0.0402 38 ASP C OD2 3418 N N . THR C 39 ? 0.7196 0.8983 0.6146 0.1367 -0.1178 -0.1653 39 THR C N 3419 C CA . THR C 39 ? 0.7107 0.9480 0.6461 0.1557 -0.1359 -0.1997 39 THR C CA 3420 C C . THR C 39 ? 0.7642 0.9816 0.6743 0.1979 -0.1674 -0.2019 39 THR C C 3421 O O . THR C 39 ? 0.8284 1.0038 0.6801 0.2218 -0.1882 -0.1873 39 THR C O 3422 C CB . THR C 39 ? 0.7064 0.9972 0.6562 0.1548 -0.1428 -0.2255 39 THR C CB 3423 O OG1 . THR C 39 ? 0.7609 1.0209 0.6515 0.1711 -0.1566 -0.2112 39 THR C OG1 3424 C CG2 . THR C 39 ? 0.6617 0.9716 0.6449 0.1153 -0.1150 -0.2313 39 THR C CG2 3425 N N . GLY C 40 ? 0.7462 0.9904 0.6956 0.2080 -0.1713 -0.2205 40 GLY C N 3426 C CA . GLY C 40 ? 0.8002 1.0254 0.7312 0.2531 -0.2032 -0.2284 40 GLY C CA 3427 C C . GLY C 40 ? 0.8506 0.9785 0.7277 0.2575 -0.2050 -0.1933 40 GLY C C 3428 O O . GLY C 40 ? 0.9262 1.0023 0.7570 0.2961 -0.2359 -0.1880 40 GLY C O 3429 N N . LYS C 41 ? 0.8161 0.9166 0.6973 0.2181 -0.1737 -0.1707 41 LYS C N 3430 C CA . LYS C 41 ? 0.8581 0.8724 0.6948 0.2118 -0.1707 -0.1396 41 LYS C CA 3431 C C . LYS C 41 ? 0.8042 0.8278 0.6816 0.1849 -0.1461 -0.1405 41 LYS C C 3432 O O . LYS C 41 ? 0.7410 0.8326 0.6746 0.1733 -0.1323 -0.1631 41 LYS C O 3433 C CB . LYS C 41 ? 0.8944 0.8552 0.6742 0.1891 -0.1591 -0.1047 41 LYS C CB 3434 N N . GLY C 42 ? 0.8365 0.7899 0.6813 0.1731 -0.1411 -0.1162 42 GLY C N 3435 C CA . GLY C 42 ? 0.7953 0.7527 0.6720 0.1503 -0.1216 -0.1172 42 GLY C CA 3436 C C . GLY C 42 ? 0.7535 0.7177 0.6390 0.1085 -0.0910 -0.0995 42 GLY C C 3437 O O . GLY C 42 ? 0.7536 0.7236 0.6238 0.0963 -0.0827 -0.0885 42 GLY C O 3438 N N . LEU C 43 ? 0.7222 0.6894 0.6322 0.0900 -0.0762 -0.1002 43 LEU C N 3439 C CA . LEU C 43 ? 0.6877 0.6635 0.6087 0.0561 -0.0513 -0.0874 43 LEU C CA 3440 C C . LEU C 43 ? 0.7355 0.6525 0.6170 0.0377 -0.0469 -0.0634 43 LEU C C 3441 O O . LEU C 43 ? 0.7796 0.6467 0.6410 0.0411 -0.0570 -0.0591 43 LEU C O 3442 C CB . LEU C 43 ? 0.6408 0.6481 0.6018 0.0461 -0.0400 -0.0999 43 LEU C CB 3443 C CG . LEU C 43 ? 0.5903 0.6575 0.5889 0.0436 -0.0314 -0.1174 43 LEU C CG 3444 C CD1 . LEU C 43 ? 0.5980 0.6980 0.6102 0.0673 -0.0457 -0.1399 43 LEU C CD1 3445 C CD2 . LEU C 43 ? 0.5574 0.6380 0.5772 0.0295 -0.0193 -0.1212 43 LEU C CD2 3446 N N . VAL C 44 ? 0.7319 0.6564 0.6019 0.0167 -0.0313 -0.0502 44 VAL C N 3447 C CA . VAL C 44 ? 0.7765 0.6597 0.6118 -0.0094 -0.0208 -0.0291 44 VAL C CA 3448 C C . VAL C 44 ? 0.7273 0.6541 0.5966 -0.0364 0.0025 -0.0320 44 VAL C C 3449 O O . VAL C 44 ? 0.6873 0.6610 0.5773 -0.0362 0.0119 -0.0394 44 VAL C O 3450 C CB . VAL C 44 ? 0.8340 0.6907 0.6157 -0.0100 -0.0229 -0.0120 44 VAL C CB 3451 C CG1 . VAL C 44 ? 0.8944 0.7058 0.6342 -0.0445 -0.0089 0.0107 44 VAL C CG1 3452 C CG2 . VAL C 44 ? 0.8854 0.7037 0.6326 0.0253 -0.0519 -0.0123 44 VAL C CG2 3453 N N . SER C 45 ? 0.7352 0.6459 0.6100 -0.0571 0.0092 -0.0290 45 SER C N 3454 C CA . SER C 45 ? 0.6929 0.6499 0.6033 -0.0780 0.0269 -0.0361 45 SER C CA 3455 C C . SER C 45 ? 0.7013 0.6849 0.6018 -0.0982 0.0451 -0.0300 45 SER C C 3456 O O . SER C 45 ? 0.7595 0.7096 0.6163 -0.1147 0.0500 -0.0137 45 SER C O 3457 C CB . SER C 45 ? 0.7090 0.6461 0.6269 -0.0967 0.0277 -0.0377 45 SER C CB 3458 O OG . SER C 45 ? 0.6677 0.6586 0.6249 -0.1098 0.0399 -0.0495 45 SER C OG 3459 N N . LEU C 46 ? 0.6503 0.6920 0.5873 -0.0957 0.0545 -0.0440 46 LEU C N 3460 C CA . LEU C 46 ? 0.6538 0.7361 0.5906 -0.1099 0.0719 -0.0464 46 LEU C CA 3461 C C . LEU C 46 ? 0.6459 0.7692 0.6131 -0.1325 0.0856 -0.0567 46 LEU C C 3462 O O . LEU C 46 ? 0.6758 0.8182 0.6316 -0.1600 0.1031 -0.0540 46 LEU C O 3463 C CB . LEU C 46 ? 0.6137 0.7319 0.5672 -0.0869 0.0700 -0.0596 46 LEU C CB 3464 C CG . LEU C 46 ? 0.6197 0.7159 0.5493 -0.0670 0.0580 -0.0560 46 LEU C CG 3465 C CD1 . LEU C 46 ? 0.5796 0.7102 0.5310 -0.0504 0.0570 -0.0731 46 LEU C CD1 3466 C CD2 . LEU C 46 ? 0.6788 0.7502 0.5573 -0.0762 0.0613 -0.0401 46 LEU C CD2 3467 N N . THR C 47 ? 0.6109 0.7518 0.6152 -0.1218 0.0776 -0.0697 47 THR C N 3468 C CA . THR C 47 ? 0.6005 0.7892 0.6399 -0.1360 0.0851 -0.0850 47 THR C CA 3469 C C . THR C 47 ? 0.5727 0.7614 0.6384 -0.1220 0.0706 -0.0948 47 THR C C 3470 O O . THR C 47 ? 0.5540 0.7198 0.6166 -0.0985 0.0581 -0.0928 47 THR C O 3471 C CB . THR C 47 ? 0.5823 0.8379 0.6455 -0.1288 0.0950 -0.1027 47 THR C CB 3472 O OG1 . THR C 47 ? 0.5810 0.8923 0.6796 -0.1436 0.1017 -0.1210 47 THR C OG1 3473 C CG2 . THR C 47 ? 0.5454 0.8043 0.6209 -0.0920 0.0812 -0.1118 47 THR C CG2 3474 N N . VAL C 48 ? 0.5763 0.7953 0.6665 -0.1391 0.0734 -0.1068 48 VAL C N 3475 C CA . VAL C 48 ? 0.5584 0.7837 0.6706 -0.1268 0.0592 -0.1182 48 VAL C CA 3476 C C . VAL C 48 ? 0.5380 0.8315 0.6874 -0.1166 0.0574 -0.1407 48 VAL C C 3477 O O . VAL C 48 ? 0.5477 0.8931 0.7172 -0.1356 0.0699 -0.1534 48 VAL C O 3478 C CB . VAL C 48 ? 0.5865 0.7875 0.6965 -0.1528 0.0576 -0.1186 48 VAL C CB 3479 C CG1 . VAL C 48 ? 0.5739 0.7510 0.6847 -0.1327 0.0401 -0.1224 48 VAL C CG1 3480 C CG2 . VAL C 48 ? 0.6360 0.7790 0.7076 -0.1767 0.0650 -0.0993 48 VAL C CG2 3481 N N . LEU C 49 ? 0.5191 0.8130 0.6749 -0.0865 0.0412 -0.1469 49 LEU C N 3482 C CA . LEU C 49 ? 0.5096 0.8583 0.6944 -0.0677 0.0317 -0.1688 49 LEU C CA 3483 C C . LEU C 49 ? 0.5114 0.8586 0.7023 -0.0611 0.0154 -0.1763 49 LEU C C 3484 O O . LEU C 49 ? 0.5121 0.8144 0.6792 -0.0472 0.0054 -0.1649 49 LEU C O 3485 C CB . LEU C 49 ? 0.5027 0.8449 0.6786 -0.0339 0.0236 -0.1693 49 LEU C CB 3486 C CG . LEU C 49 ? 0.5034 0.8588 0.6767 -0.0343 0.0370 -0.1696 49 LEU C CG 3487 C CD1 . LEU C 49 ? 0.5064 0.8157 0.6544 -0.0108 0.0294 -0.1597 49 LEU C CD1 3488 C CD2 . LEU C 49 ? 0.5037 0.9347 0.7106 -0.0266 0.0397 -0.1970 49 LEU C CD2 3489 N N . VAL C 50 ? 0.5162 0.9187 0.7392 -0.0729 0.0135 -0.1979 50 VAL C N 3490 C CA . VAL C 50 ? 0.5235 0.9297 0.7531 -0.0725 -0.0015 -0.2085 50 VAL C CA 3491 C C . VAL C 50 ? 0.5240 0.9789 0.7722 -0.0392 -0.0232 -0.2306 50 VAL C C 3492 O O . VAL C 50 ? 0.5320 0.9638 0.7614 -0.0189 -0.0416 -0.2291 50 VAL C O 3493 C CB . VAL C 50 ? 0.5391 0.9641 0.7883 -0.1159 0.0089 -0.2187 50 VAL C CB 3494 C CG1 . VAL C 50 ? 0.5516 0.9744 0.8046 -0.1155 -0.0080 -0.2314 50 VAL C CG1 3495 C CG2 . VAL C 50 ? 0.5557 0.9201 0.7765 -0.1452 0.0262 -0.1952 50 VAL C CG2 3496 N N . ASP C 51 ? 0.5218 1.0449 0.8036 -0.0315 -0.0220 -0.2525 51 ASP C N 3497 C CA . ASP C 51 ? 0.5307 1.1108 0.8357 0.0030 -0.0463 -0.2803 51 ASP C CA 3498 C C . ASP C 51 ? 0.5460 1.0857 0.8180 0.0531 -0.0679 -0.2719 51 ASP C C 3499 O O . ASP C 51 ? 0.5464 1.0278 0.7868 0.0581 -0.0601 -0.2488 51 ASP C O 3500 C CB . ASP C 51 ? 0.5264 1.2070 0.8854 -0.0058 -0.0377 -0.3138 51 ASP C CB 3501 C CG . ASP C 51 ? 0.5325 1.2565 0.9232 -0.0601 -0.0189 -0.3261 51 ASP C CG 3502 O OD1 . ASP C 51 ? 0.5445 1.2504 0.9316 -0.0740 -0.0280 -0.3268 51 ASP C OD1 3503 O OD2 . ASP C 51 ? 0.5396 1.3139 0.9555 -0.0910 0.0054 -0.3359 51 ASP C OD2 3504 N N . GLN C 52 ? 0.5670 1.1357 0.8440 0.0890 -0.0967 -0.2918 52 GLN C N 3505 C CA . GLN C 52 ? 0.6022 1.1248 0.8397 0.1389 -0.1229 -0.2851 52 GLN C CA 3506 C C . GLN C 52 ? 0.6052 1.1240 0.8439 0.1590 -0.1187 -0.2876 52 GLN C C 3507 O O . GLN C 52 ? 0.6292 1.0701 0.8218 0.1750 -0.1230 -0.2648 52 GLN C O 3508 C CB . GLN C 52 ? 0.6320 1.2026 0.8809 0.1768 -0.1573 -0.3133 52 GLN C CB 3509 C CG . GLN C 52 ? 0.6956 1.1918 0.8812 0.2235 -0.1891 -0.2977 52 GLN C CG 3510 C CD . GLN C 52 ? 0.7218 1.1476 0.8543 0.2076 -0.1889 -0.2681 52 GLN C CD 3511 O OE1 . GLN C 52 ? 0.6936 1.1388 0.8434 0.1714 -0.1737 -0.2682 52 GLN C OE1 3512 N NE2 . GLN C 52 ? 0.7791 1.1208 0.8434 0.2339 -0.2056 -0.2439 52 GLN C NE2 3513 N N . LYS C 53 ? 0.5866 1.1934 0.8784 0.1560 -0.1097 -0.3182 53 LYS C N 3514 C CA . LYS C 53 ? 0.5845 1.2023 0.8841 0.1678 -0.0995 -0.3255 53 LYS C CA 3515 C C . LYS C 53 ? 0.5476 1.2172 0.8811 0.1161 -0.0624 -0.3279 53 LYS C C 3516 O O . LYS C 53 ? 0.5373 1.3013 0.9209 0.0985 -0.0538 -0.3573 53 LYS C O 3517 C CB . LYS C 53 ? 0.6083 1.2941 0.9379 0.2190 -0.1248 -0.3664 53 LYS C CB 3518 C CG . LYS C 53 ? 0.6639 1.2994 0.9554 0.2750 -0.1678 -0.3670 53 LYS C CG 3519 C CD . LYS C 53 ? 0.7097 1.2361 0.9401 0.3031 -0.1791 -0.3425 53 LYS C CD 3520 C CE . LYS C 53 ? 0.7824 1.2561 0.9687 0.3618 -0.2244 -0.3455 53 LYS C CE 3521 N N . ASP C 54 ? 0.5358 1.1431 0.8388 0.0900 -0.0410 -0.2972 54 ASP C N 3522 C CA . ASP C 54 ? 0.5158 1.1495 0.8333 0.0400 -0.0080 -0.2914 54 ASP C CA 3523 C C . ASP C 54 ? 0.5149 1.1410 0.8206 0.0402 0.0087 -0.2866 54 ASP C C 3524 O O . ASP C 54 ? 0.5244 1.0915 0.7990 0.0680 -0.0020 -0.2750 54 ASP C O 3525 C CB . ASP C 54 ? 0.5110 1.0779 0.8001 0.0054 0.0007 -0.2599 54 ASP C CB 3526 C CG . ASP C 54 ? 0.5112 1.1132 0.8206 -0.0464 0.0242 -0.2622 54 ASP C CG 3527 O OD1 . ASP C 54 ? 0.5109 1.1868 0.8515 -0.0643 0.0410 -0.2828 54 ASP C OD1 3528 O OD2 . ASP C 54 ? 0.5136 1.0669 0.8048 -0.0706 0.0260 -0.2442 54 ASP C OD2 3529 N N . LYS C 55 ? 0.5106 1.1970 0.8385 0.0065 0.0355 -0.2968 55 LYS C N 3530 C CA . LYS C 55 ? 0.5159 1.1973 0.8267 -0.0008 0.0551 -0.2906 55 LYS C CA 3531 C C . LYS C 55 ? 0.5222 1.1980 0.8191 -0.0570 0.0850 -0.2705 55 LYS C C 3532 O O . LYS C 55 ? 0.5273 1.2483 0.8471 -0.0930 0.0976 -0.2788 55 LYS C O 3533 C CB . LYS C 55 ? 0.5203 1.2888 0.8646 0.0259 0.0561 -0.3299 55 LYS C CB 3534 C CG . LYS C 55 ? 0.5209 1.4070 0.9163 -0.0005 0.0742 -0.3630 55 LYS C CG 3535 N N . THR C 56 ? 0.5310 1.1463 0.7866 -0.0645 0.0944 -0.2445 56 THR C N 3536 C CA . THR C 56 ? 0.5529 1.1398 0.7795 -0.1114 0.1171 -0.2199 56 THR C CA 3537 C C . THR C 56 ? 0.5690 1.1570 0.7678 -0.1152 0.1338 -0.2143 56 THR C C 3538 O O . THR C 56 ? 0.5605 1.1437 0.7554 -0.0795 0.1238 -0.2227 56 THR C O 3539 C CB . THR C 56 ? 0.5541 1.0480 0.7479 -0.1174 0.1059 -0.1882 56 THR C CB 3540 O OG1 . THR C 56 ? 0.5905 1.0535 0.7562 -0.1612 0.1233 -0.1674 56 THR C OG1 3541 C CG2 . THR C 56 ? 0.5468 0.9798 0.7110 -0.0874 0.0933 -0.1730 56 THR C CG2 3542 N N . SER C 57 ? 0.6021 1.1915 0.7767 -0.1597 0.1585 -0.2002 57 SER C N 3543 C CA . SER C 57 ? 0.6293 1.2264 0.7711 -0.1677 0.1765 -0.1952 57 SER C CA 3544 C C . SER C 57 ? 0.6793 1.2163 0.7659 -0.2113 0.1920 -0.1604 57 SER C C 3545 O O . SER C 57 ? 0.7071 1.2413 0.7921 -0.2526 0.2038 -0.1528 57 SER C O 3546 C CB . SER C 57 ? 0.6337 1.3420 0.8101 -0.1738 0.1967 -0.2310 57 SER C CB 3547 O OG . SER C 57 ? 0.6560 1.3779 0.8040 -0.1672 0.2091 -0.2335 57 SER C OG 3548 N N . ASN C 58 ? 0.6996 1.1843 0.7378 -0.2009 0.1895 -0.1405 58 ASN C N 3549 C CA . ASN C 58 ? 0.7607 1.1769 0.7348 -0.2326 0.1982 -0.1061 58 ASN C CA 3550 C C . ASN C 58 ? 0.7876 1.1924 0.7151 -0.2208 0.2021 -0.0980 58 ASN C C 3551 O O . ASN C 58 ? 0.7783 1.1313 0.6864 -0.1898 0.1812 -0.0881 58 ASN C O 3552 C CB . ASN C 58 ? 0.7618 1.0871 0.7188 -0.2250 0.1753 -0.0823 58 ASN C CB 3553 C CG . ASN C 58 ? 0.8404 1.0895 0.7331 -0.2598 0.1812 -0.0493 58 ASN C CG 3554 O OD1 . ASN C 58 ? 0.8981 1.1595 0.7587 -0.3003 0.2057 -0.0412 58 ASN C OD1 3555 N ND2 . ASN C 58 ? 0.8490 1.0169 0.7193 -0.2440 0.1585 -0.0311 58 ASN C ND2 3556 N N . GLY C 59 ? 0.8255 1.2855 0.7359 -0.2475 0.2296 -0.1051 59 GLY C N 3557 C CA . GLY C 59 ? 0.8542 1.3178 0.7199 -0.2372 0.2355 -0.1028 59 GLY C CA 3558 C C . GLY C 59 ? 0.7995 1.3057 0.7046 -0.1876 0.2209 -0.1345 59 GLY C C 3559 O O . GLY C 59 ? 0.7671 1.3520 0.7257 -0.1759 0.2268 -0.1689 59 GLY C O 3560 N N . ARG C 60 ? 0.7957 1.2478 0.6738 -0.1578 0.1998 -0.1249 60 ARG C N 3561 C CA . ARG C 60 ? 0.7553 1.2284 0.6630 -0.1142 0.1833 -0.1526 60 ARG C CA 3562 C C . ARG C 60 ? 0.6997 1.1540 0.6578 -0.0891 0.1611 -0.1613 60 ARG C C 3563 O O . ARG C 60 ? 0.6736 1.1530 0.6647 -0.0579 0.1503 -0.1885 60 ARG C O 3564 C CB . ARG C 60 ? 0.7773 1.2037 0.6389 -0.0967 0.1692 -0.1420 60 ARG C CB 3565 C CG . ARG C 60 ? 0.8449 1.2838 0.6449 -0.1161 0.1875 -0.1326 60 ARG C CG 3566 C CD . ARG C 60 ? 0.8689 1.2719 0.6300 -0.0910 0.1683 -0.1300 60 ARG C CD 3567 N NE . ARG C 60 ? 0.8584 1.1881 0.6119 -0.0792 0.1421 -0.1085 60 ARG C NE 3568 C CZ . ARG C 60 ? 0.9101 1.1807 0.6122 -0.0930 0.1368 -0.0754 60 ARG C CZ 3569 N NH1 . ARG C 60 ? 0.9834 1.2470 0.6287 -0.1240 0.1565 -0.0545 60 ARG C NH1 3570 N NH2 . ARG C 60 ? 0.8952 1.1121 0.5998 -0.0759 0.1113 -0.0642 60 ARG C NH2 3571 N N . TYR C 61 ? 0.6905 1.0956 0.6483 -0.1022 0.1533 -0.1381 62 TYR C N 3572 C CA . TYR C 61 ? 0.6453 1.0291 0.6415 -0.0827 0.1338 -0.1425 62 TYR C CA 3573 C C . TYR C 61 ? 0.6236 1.0651 0.6674 -0.0849 0.1395 -0.1636 62 TYR C C 3574 O O . TYR C 61 ? 0.6434 1.1209 0.6916 -0.1165 0.1582 -0.1631 62 TYR C O 3575 C CB . TYR C 61 ? 0.6490 0.9651 0.6268 -0.0935 0.1232 -0.1143 62 TYR C CB 3576 C CG . TYR C 61 ? 0.6784 0.9417 0.6102 -0.0891 0.1143 -0.0951 62 TYR C CG 3577 C CD1 . TYR C 61 ? 0.7371 0.9659 0.6202 -0.1127 0.1214 -0.0709 62 TYR C CD1 3578 C CD2 . TYR C 61 ? 0.6619 0.9080 0.5962 -0.0617 0.0972 -0.1023 62 TYR C CD2 3579 C CE1 . TYR C 61 ? 0.7703 0.9513 0.6083 -0.1019 0.1082 -0.0553 62 TYR C CE1 3580 C CE2 . TYR C 61 ? 0.6914 0.9009 0.5889 -0.0552 0.0866 -0.0900 62 TYR C CE2 3581 C CZ . TYR C 61 ? 0.7438 0.9222 0.5933 -0.0718 0.0904 -0.0670 62 TYR C CZ 3582 O OH . TYR C 61 ? 0.7752 0.9176 0.5857 -0.0587 0.0749 -0.0567 62 TYR C OH 3583 N N . SER C 62 ? 0.5915 1.0407 0.6683 -0.0522 0.1223 -0.1831 63 SER C N 3584 C CA . SER C 62 ? 0.5713 1.0658 0.6921 -0.0452 0.1186 -0.2029 63 SER C CA 3585 C C . SER C 62 ? 0.5503 0.9992 0.6814 -0.0146 0.0924 -0.2027 63 SER C C 3586 O O . SER C 62 ? 0.5540 0.9677 0.6724 0.0098 0.0795 -0.2053 63 SER C O 3587 C CB . SER C 62 ? 0.5767 1.1571 0.7260 -0.0317 0.1278 -0.2393 63 SER C CB 3588 O OG . SER C 62 ? 0.5790 1.1483 0.7291 0.0095 0.1111 -0.2580 63 SER C OG 3589 N N . ALA C 63 ? 0.5346 0.9821 0.6846 -0.0191 0.0850 -0.1997 64 ALA C N 3590 C CA . ALA C 63 ? 0.5207 0.9223 0.6714 0.0050 0.0620 -0.1959 64 ALA C CA 3591 C C . ALA C 63 ? 0.5156 0.9585 0.6989 0.0238 0.0494 -0.2175 64 ALA C C 3592 O O . ALA C 63 ? 0.5126 1.0236 0.7253 0.0102 0.0597 -0.2340 64 ALA C O 3593 C CB . ALA C 63 ? 0.5143 0.8582 0.6445 -0.0133 0.0599 -0.1681 64 ALA C CB 3594 N N . THR C 64 ? 0.5203 0.9220 0.6955 0.0540 0.0265 -0.2178 65 THR C N 3595 C CA . THR C 64 ? 0.5255 0.9522 0.7211 0.0788 0.0074 -0.2354 65 THR C CA 3596 C C . THR C 64 ? 0.5287 0.8905 0.6996 0.0827 -0.0085 -0.2146 65 THR C C 3597 O O . THR C 64 ? 0.5351 0.8317 0.6740 0.0772 -0.0084 -0.1931 65 THR C O 3598 C CB . THR C 64 ? 0.5527 0.9921 0.7536 0.1239 -0.0106 -0.2623 65 THR C CB 3599 O OG1 . THR C 64 ? 0.5787 0.9405 0.7419 0.1366 -0.0185 -0.2493 65 THR C OG1 3600 C CG2 . THR C 64 ? 0.5479 1.0754 0.7819 0.1247 0.0046 -0.2928 65 THR C CG2 3601 N N . LEU C 65 ? 0.5273 0.9139 0.7135 0.0911 -0.0217 -0.2237 66 LEU C N 3602 C CA . LEU C 65 ? 0.5383 0.8701 0.6970 0.0976 -0.0378 -0.2070 66 LEU C CA 3603 C C . LEU C 65 ? 0.5688 0.9125 0.7287 0.1368 -0.0662 -0.2248 66 LEU C C 3604 O O . LEU C 65 ? 0.5622 0.9813 0.7613 0.1468 -0.0717 -0.2523 66 LEU C O 3605 C CB . LEU C 65 ? 0.5144 0.8503 0.6786 0.0635 -0.0265 -0.1947 66 LEU C CB 3606 C CG . LEU C 65 ? 0.5261 0.8220 0.6656 0.0677 -0.0407 -0.1825 66 LEU C CG 3607 C CD1 . LEU C 65 ? 0.5421 0.7628 0.6373 0.0695 -0.0415 -0.1588 66 LEU C CD1 3608 C CD2 . LEU C 65 ? 0.5037 0.8167 0.6572 0.0374 -0.0314 -0.1804 66 LEU C CD2 3609 N N . ASP C 66 ? 0.6077 0.8768 0.7219 0.1578 -0.0847 -0.2094 67 ASP C N 3610 C CA . ASP C 66 ? 0.6525 0.9096 0.7492 0.1974 -0.1163 -0.2190 67 ASP C CA 3611 C C . ASP C 66 ? 0.6715 0.8677 0.7230 0.1870 -0.1223 -0.1925 67 ASP C C 3612 O O . ASP C 66 ? 0.7002 0.8194 0.7053 0.1786 -0.1190 -0.1680 67 ASP C O 3613 C CB . ASP C 66 ? 0.7068 0.9166 0.7762 0.2372 -0.1362 -0.2259 67 ASP C CB 3614 C CG . ASP C 66 ? 0.7717 0.9803 0.8278 0.2887 -0.1742 -0.2437 67 ASP C CG 3615 O OD1 . ASP C 66 ? 0.8062 1.0329 0.8746 0.3285 -0.1912 -0.2704 67 ASP C OD1 3616 O OD2 . ASP C 66 ? 0.8013 0.9918 0.8328 0.2930 -0.1891 -0.2333 67 ASP C OD2 3617 N N . LYS C 67 ? 0.6592 0.8951 0.7249 0.1848 -0.1297 -0.2001 68 LYS C N 3618 C CA . LYS C 67 ? 0.6744 0.8658 0.6995 0.1735 -0.1333 -0.1791 68 LYS C CA 3619 C C . LYS C 67 ? 0.7496 0.8770 0.7136 0.2086 -0.1629 -0.1692 68 LYS C C 3620 O O . LYS C 67 ? 0.7799 0.8476 0.6918 0.1962 -0.1612 -0.1445 68 LYS C O 3621 C CB . LYS C 67 ? 0.6401 0.8942 0.7001 0.1565 -0.1307 -0.1929 68 LYS C CB 3622 C CG . LYS C 67 ? 0.5835 0.8602 0.6753 0.1129 -0.1004 -0.1890 68 LYS C CG 3623 C CD . LYS C 67 ? 0.5632 0.8750 0.6740 0.0937 -0.0999 -0.1987 68 LYS C CD 3624 C CE . LYS C 67 ? 0.5203 0.8437 0.6574 0.0536 -0.0737 -0.1956 68 LYS C CE 3625 N NZ . LYS C 67 ? 0.5161 0.8676 0.6717 0.0340 -0.0751 -0.2086 68 LYS C NZ 3626 N N . ASP C 68 ? 0.7866 0.9265 0.7538 0.2528 -0.1904 -0.1893 69 ASP C N 3627 C CA . ASP C 68 ? 0.8774 0.9429 0.7771 0.2929 -0.2242 -0.1794 69 ASP C CA 3628 C C . ASP C 68 ? 0.9289 0.8892 0.7699 0.2873 -0.2193 -0.1521 69 ASP C C 3629 O O . ASP C 68 ? 1.0132 0.8837 0.7781 0.2981 -0.2361 -0.1288 69 ASP C O 3630 C CB . ASP C 68 ? 0.9078 1.0195 0.8308 0.3487 -0.2591 -0.2141 69 ASP C CB 3631 C CG . ASP C 68 ? 0.8625 1.0862 0.8467 0.3515 -0.2653 -0.2457 69 ASP C CG 3632 O OD1 . ASP C 68 ? 0.8429 1.0763 0.8208 0.3261 -0.2586 -0.2361 69 ASP C OD1 3633 O OD2 . ASP C 68 ? 0.8484 1.1547 0.8885 0.3784 -0.2766 -0.2837 69 ASP C OD2 3634 N N . ALA C 69 ? 0.8855 0.8561 0.7588 0.2679 -0.1962 -0.1555 70 ALA C N 3635 C CA . ALA C 69 ? 0.9245 0.8062 0.7528 0.2543 -0.1877 -0.1341 70 ALA C CA 3636 C C . ALA C 69 ? 0.8778 0.7532 0.7064 0.1998 -0.1527 -0.1120 70 ALA C C 3637 O O . ALA C 69 ? 0.9110 0.7168 0.6998 0.1786 -0.1427 -0.0924 70 ALA C O 3638 C CB . ALA C 69 ? 0.9154 0.8126 0.7756 0.2722 -0.1881 -0.1562 70 ALA C CB 3639 N N . LYS C 70 ? 0.8064 0.7553 0.6803 0.1780 -0.1360 -0.1180 71 LYS C N 3640 C CA . LYS C 70 ? 0.7569 0.7149 0.6421 0.1336 -0.1057 -0.1044 71 LYS C CA 3641 C C . LYS C 70 ? 0.7345 0.6838 0.6356 0.1171 -0.0878 -0.1041 71 LYS C C 3642 O O . LYS C 70 ? 0.7410 0.6531 0.6203 0.0900 -0.0725 -0.0885 71 LYS C O 3643 C CB . LYS C 70 ? 0.7985 0.7024 0.6271 0.1152 -0.1024 -0.0804 71 LYS C CB 3644 C CG . LYS C 70 ? 0.8120 0.7365 0.6277 0.1266 -0.1164 -0.0824 71 LYS C CG 3645 C CD . LYS C 70 ? 0.8545 0.7377 0.6158 0.1031 -0.1070 -0.0605 71 LYS C CD 3646 C CE . LYS C 70 ? 0.8608 0.7784 0.6173 0.1113 -0.1177 -0.0671 71 LYS C CE 3647 N NZ . LYS C 70 ? 0.9081 0.7891 0.6049 0.0904 -0.1083 -0.0477 71 LYS C NZ 3648 N N . HIS C 71 ? 0.7099 0.7022 0.6508 0.1334 -0.0898 -0.1248 72 HIS C N 3649 C CA . HIS C 71 ? 0.7008 0.6864 0.6527 0.1263 -0.0783 -0.1292 72 HIS C CA 3650 C C . HIS C 71 ? 0.6375 0.7022 0.6445 0.1179 -0.0626 -0.1459 72 HIS C C 3651 O O . HIS C 71 ? 0.6181 0.7422 0.6573 0.1299 -0.0674 -0.1628 72 HIS C O 3652 C CB . HIS C 71 ? 0.7655 0.7031 0.6914 0.1606 -0.1002 -0.1387 72 HIS C CB 3653 C CG . HIS C 71 ? 0.7678 0.7009 0.7049 0.1577 -0.0913 -0.1489 72 HIS C CG 3654 N ND1 . HIS C 71 ? 0.7560 0.7455 0.7308 0.1797 -0.0931 -0.1761 72 HIS C ND1 3655 C CD2 . HIS C 71 ? 0.7864 0.6710 0.7022 0.1345 -0.0806 -0.1386 72 HIS C CD2 3656 C CE1 . HIS C 71 ? 0.7579 0.7295 0.7302 0.1724 -0.0847 -0.1810 72 HIS C CE1 3657 N NE2 . HIS C 71 ? 0.7773 0.6853 0.7157 0.1450 -0.0781 -0.1590 72 HIS C NE2 3658 N N . SER C 72 ? 0.6115 0.6767 0.6259 0.0952 -0.0440 -0.1413 73 SER C N 3659 C CA . SER C 72 ? 0.5671 0.6930 0.6190 0.0839 -0.0279 -0.1522 73 SER C CA 3660 C C . SER C 72 ? 0.5730 0.6890 0.6216 0.0839 -0.0212 -0.1580 73 SER C C 3661 O O . SER C 72 ? 0.5995 0.6610 0.6207 0.0806 -0.0241 -0.1500 73 SER C O 3662 C CB . SER C 72 ? 0.5302 0.6718 0.5914 0.0537 -0.0122 -0.1390 73 SER C CB 3663 O OG . SER C 72 ? 0.5001 0.6863 0.5851 0.0401 0.0025 -0.1450 73 SER C OG 3664 N N . THR C 73 ? 0.5538 0.7252 0.6287 0.0845 -0.0114 -0.1734 74 THR C N 3665 C CA . THR C 73 ? 0.5599 0.7331 0.6318 0.0858 -0.0046 -0.1826 74 THR C CA 3666 C C . THR C 73 ? 0.5285 0.7528 0.6161 0.0633 0.0159 -0.1817 74 THR C C 3667 O O . THR C 73 ? 0.5145 0.7918 0.6247 0.0576 0.0236 -0.1889 74 THR C O 3668 C CB . THR C 73 ? 0.5921 0.7776 0.6696 0.1208 -0.0178 -0.2099 74 THR C CB 3669 O OG1 . THR C 73 ? 0.6409 0.7655 0.6938 0.1443 -0.0409 -0.2083 74 THR C OG1 3670 C CG2 . THR C 73 ? 0.6042 0.7857 0.6742 0.1230 -0.0124 -0.2217 74 THR C CG2 3671 N N . LEU C 74 ? 0.5254 0.7318 0.5977 0.0490 0.0241 -0.1730 75 LEU C N 3672 C CA . LEU C 74 ? 0.5130 0.7540 0.5857 0.0304 0.0409 -0.1696 75 LEU C CA 3673 C C . LEU C 74 ? 0.5284 0.7878 0.5947 0.0408 0.0445 -0.1869 75 LEU C C 3674 O O . LEU C 74 ? 0.5431 0.7681 0.5952 0.0490 0.0362 -0.1909 75 LEU C O 3675 C CB . LEU C 74 ? 0.5044 0.7148 0.5605 0.0105 0.0441 -0.1476 75 LEU C CB 3676 C CG . LEU C 74 ? 0.5068 0.7314 0.5479 -0.0061 0.0564 -0.1387 75 LEU C CG 3677 C CD1 . LEU C 74 ? 0.5034 0.7555 0.5512 -0.0243 0.0683 -0.1330 75 LEU C CD1 3678 C CD2 . LEU C 74 ? 0.5082 0.6969 0.5317 -0.0125 0.0511 -0.1237 75 LEU C CD2 3679 N N . HIS C 75 ? 0.5291 0.8461 0.6058 0.0377 0.0579 -0.1994 76 HIS C N 3680 C CA . HIS C 75 ? 0.5455 0.8922 0.6150 0.0470 0.0642 -0.2190 76 HIS C CA 3681 C C . HIS C 75 ? 0.5514 0.9089 0.5953 0.0217 0.0809 -0.2040 76 HIS C C 3682 O O . HIS C 75 ? 0.5497 0.9235 0.5907 -0.0029 0.0944 -0.1887 76 HIS C O 3683 C CB . HIS C 75 ? 0.5516 0.9664 0.6485 0.0628 0.0692 -0.2488 76 HIS C CB 3684 C CG . HIS C 75 ? 0.5621 0.9637 0.6775 0.0968 0.0475 -0.2670 76 HIS C CG 3685 N ND1 . HIS C 75 ? 0.5925 0.9705 0.7014 0.1295 0.0313 -0.2895 76 HIS C ND1 3686 C CD2 . HIS C 75 ? 0.5571 0.9602 0.6918 0.1052 0.0366 -0.2663 76 HIS C CD2 3687 C CE1 . HIS C 75 ? 0.6068 0.9650 0.7256 0.1577 0.0105 -0.2994 76 HIS C CE1 3688 N NE2 . HIS C 75 ? 0.5866 0.9633 0.7214 0.1444 0.0131 -0.2858 76 HIS C NE2 3689 N N . ILE C 76 ? 0.5672 0.9097 0.5878 0.0278 0.0780 -0.2084 77 ILE C N 3690 C CA . ILE C 76 ? 0.5880 0.9439 0.5758 0.0109 0.0911 -0.1984 77 ILE C CA 3691 C C . ILE C 76 ? 0.6109 1.0156 0.5941 0.0236 0.0992 -0.2269 77 ILE C C 3692 O O . ILE C 76 ? 0.6187 1.0104 0.6008 0.0454 0.0866 -0.2469 77 ILE C O 3693 C CB . ILE C 76 ? 0.5930 0.8998 0.5537 0.0088 0.0791 -0.1821 77 ILE C CB 3694 C CG1 . ILE C 76 ? 0.5697 0.8345 0.5401 0.0017 0.0697 -0.1612 77 ILE C CG1 3695 C CG2 . ILE C 76 ? 0.6277 0.9419 0.5451 -0.0054 0.0891 -0.1683 77 ILE C CG2 3696 C CD1 . ILE C 76 ? 0.5654 0.7946 0.5208 0.0038 0.0559 -0.1534 77 ILE C CD1 3697 N N . THR C 77 ? 0.6274 1.0894 0.6075 0.0077 0.1214 -0.2308 78 THR C N 3698 C CA . THR C 77 ? 0.6534 1.1778 0.6309 0.0181 0.1336 -0.2617 78 THR C CA 3699 C C . THR C 77 ? 0.6924 1.2151 0.6165 0.0037 0.1438 -0.2503 78 THR C C 3700 O O . THR C 77 ? 0.7126 1.2171 0.6024 -0.0256 0.1547 -0.2187 78 THR C O 3701 C CB . THR C 77 ? 0.6516 1.2560 0.6589 0.0070 0.1548 -0.2786 78 THR C CB 3702 O OG1 . THR C 77 ? 0.6229 1.2268 0.6766 0.0252 0.1401 -0.2895 78 THR C OG1 3703 C CG2 . THR C 77 ? 0.6753 1.3560 0.6858 0.0220 0.1677 -0.3177 78 THR C CG2 3704 N N . ALA C 78 ? 0.7122 1.2480 0.6250 0.0262 0.1376 -0.2766 79 ALA C N 3705 C CA . ALA C 78 ? 0.7547 1.2905 0.6135 0.0195 0.1425 -0.2712 79 ALA C CA 3706 C C . ALA C 78 ? 0.7610 1.2279 0.5863 0.0086 0.1282 -0.2350 79 ALA C C 3707 O O . ALA C 78 ? 0.7937 1.2480 0.5762 -0.0156 0.1390 -0.2050 79 ALA C O 3708 C CB . ALA C 78 ? 0.7924 1.3923 0.6219 -0.0059 0.1745 -0.2705 79 ALA C CB 3709 N N . THR C 79 ? 0.7388 1.1609 0.5823 0.0269 0.1033 -0.2398 80 THR C N 3710 C CA . THR C 79 ? 0.7360 1.1028 0.5640 0.0214 0.0870 -0.2129 80 THR C CA 3711 C C . THR C 79 ? 0.7812 1.1408 0.5520 0.0201 0.0824 -0.2027 80 THR C C 3712 O O . THR C 79 ? 0.8079 1.1938 0.5590 0.0317 0.0813 -0.2255 80 THR C O 3713 C CB . THR C 79 ? 0.7061 1.0384 0.5691 0.0368 0.0648 -0.2259 80 THR C CB 3714 O OG1 . THR C 79 ? 0.6875 1.0259 0.5911 0.0460 0.0660 -0.2429 80 THR C OG1 3715 C CG2 . THR C 79 ? 0.6911 0.9814 0.5580 0.0280 0.0540 -0.1994 80 THR C CG2 3716 N N . LEU C 80 ? 0.7977 1.1191 0.5392 0.0090 0.0772 -0.1699 81 LEU C N 3717 C CA . LEU C 80 ? 0.8519 1.1545 0.5317 0.0124 0.0667 -0.1558 81 LEU C CA 3718 C C . LEU C 80 ? 0.8379 1.1108 0.5285 0.0305 0.0369 -0.1585 81 LEU C C 3719 O O . LEU C 80 ? 0.7884 1.0500 0.5299 0.0331 0.0289 -0.1644 81 LEU C O 3720 C CB . LEU C 80 ? 0.9000 1.1726 0.5274 -0.0099 0.0785 -0.1175 81 LEU C CB 3721 C CG . LEU C 80 ? 0.9287 1.2332 0.5392 -0.0388 0.1118 -0.1106 81 LEU C CG 3722 C CD1 . LEU C 80 ? 0.9885 1.2413 0.5412 -0.0653 0.1189 -0.0691 81 LEU C CD1 3723 C CD2 . LEU C 80 ? 0.9674 1.3257 0.5475 -0.0367 0.1262 -0.1322 81 LEU C CD2 3724 N N . LEU C 81 ? 0.8854 1.1505 0.5265 0.0426 0.0206 -0.1556 82 LEU C N 3725 C CA . LEU C 81 ? 0.8790 1.1294 0.5300 0.0613 -0.0091 -0.1625 82 LEU C CA 3726 C C . LEU C 81 ? 0.8653 1.0763 0.5276 0.0602 -0.0181 -0.1386 82 LEU C C 3727 O O . LEU C 81 ? 0.8245 1.0377 0.5342 0.0672 -0.0316 -0.1515 82 LEU C O 3728 C CB . LEU C 81 ? 0.9443 1.1966 0.5327 0.0784 -0.0275 -0.1639 82 LEU C CB 3729 C CG . LEU C 81 ? 0.9570 1.2518 0.5408 0.0888 -0.0318 -0.1991 82 LEU C CG 3730 C CD1 . LEU C 81 ? 1.0410 1.3321 0.5453 0.1036 -0.0471 -0.1908 82 LEU C CD1 3731 C CD2 . LEU C 81 ? 0.9099 1.2236 0.5560 0.0975 -0.0499 -0.2344 82 LEU C CD2 3732 N N . ASP C 82 ? 0.9061 1.0808 0.5228 0.0492 -0.0095 -0.1053 83 ASP C N 3733 C CA . ASP C 82 ? 0.9046 1.0341 0.5241 0.0497 -0.0191 -0.0832 83 ASP C CA 3734 C C . ASP C 82 ? 0.8334 0.9688 0.5182 0.0352 -0.0053 -0.0867 83 ASP C C 3735 O O . ASP C 82 ? 0.8288 0.9326 0.5238 0.0353 -0.0119 -0.0734 83 ASP C O 3736 C CB . ASP C 82 ? 0.9869 1.0625 0.5297 0.0389 -0.0151 -0.0463 83 ASP C CB 3737 C CG . ASP C 82 ? 1.0766 1.1312 0.5426 0.0593 -0.0365 -0.0383 83 ASP C CG 3738 O OD1 . ASP C 82 ? 1.0881 1.1832 0.5405 0.0651 -0.0349 -0.0564 83 ASP C OD1 3739 O OD2 . ASP C 82 ? 1.1448 1.1388 0.5598 0.0721 -0.0570 -0.0147 83 ASP C OD2 3740 N N . ASP C 83 ? 0.7855 0.9592 0.5107 0.0262 0.0113 -0.1062 84 ASP C N 3741 C CA . ASP C 83 ? 0.7233 0.9030 0.5074 0.0180 0.0195 -0.1130 84 ASP C CA 3742 C C . ASP C 83 ? 0.6795 0.8651 0.5070 0.0295 0.0032 -0.1325 84 ASP C C 3743 O O . ASP C 83 ? 0.6395 0.8249 0.5087 0.0232 0.0080 -0.1374 84 ASP C O 3744 C CB . ASP C 83 ? 0.7054 0.9189 0.5108 0.0086 0.0401 -0.1270 84 ASP C CB 3745 C CG . ASP C 83 ? 0.7371 0.9556 0.5190 -0.0120 0.0622 -0.1095 84 ASP C CG 3746 O OD1 . ASP C 83 ? 0.7612 0.9453 0.5246 -0.0246 0.0631 -0.0844 84 ASP C OD1 3747 O OD2 . ASP C 83 ? 0.7449 1.0038 0.5282 -0.0168 0.0789 -0.1237 84 ASP C OD2 3748 N N . THR C 84 ? 0.6920 0.8853 0.5071 0.0446 -0.0157 -0.1445 85 THR C N 3749 C CA . THR C 84 ? 0.6568 0.8643 0.5126 0.0501 -0.0299 -0.1656 85 THR C CA 3750 C C . THR C 84 ? 0.6405 0.8317 0.5112 0.0529 -0.0374 -0.1539 85 THR C C 3751 O O . THR C 84 ? 0.6733 0.8497 0.5148 0.0685 -0.0528 -0.1435 85 THR C O 3752 C CB . THR C 84 ? 0.6816 0.9139 0.5237 0.0653 -0.0495 -0.1872 85 THR C CB 3753 O OG1 . THR C 84 ? 0.6935 0.9414 0.5226 0.0631 -0.0422 -0.2020 85 THR C OG1 3754 C CG2 . THR C 84 ? 0.6499 0.9067 0.5392 0.0640 -0.0613 -0.2126 85 THR C CG2 3755 N N . ALA C 85 ? 0.5943 0.7853 0.5061 0.0403 -0.0279 -0.1567 86 ALA C N 3756 C CA . ALA C 85 ? 0.5761 0.7552 0.5046 0.0408 -0.0307 -0.1478 86 ALA C CA 3757 C C . ALA C 85 ? 0.5350 0.7197 0.5045 0.0245 -0.0193 -0.1553 86 ALA C C 3758 O O . ALA C 85 ? 0.5252 0.7118 0.5048 0.0142 -0.0104 -0.1635 86 ALA C O 3759 C CB . ALA C 85 ? 0.5981 0.7412 0.4963 0.0394 -0.0251 -0.1205 86 ALA C CB 3760 N N . THR C 86 ? 0.5181 0.7015 0.5056 0.0240 -0.0209 -0.1529 87 THR C N 3761 C CA . THR C 86 ? 0.4898 0.6717 0.5043 0.0077 -0.0092 -0.1544 87 THR C CA 3762 C C . THR C 86 ? 0.4839 0.6392 0.4901 0.0036 0.0006 -0.1344 87 THR C C 3763 O O . THR C 86 ? 0.4967 0.6365 0.4876 0.0104 -0.0027 -0.1214 87 THR C O 3764 C CB . THR C 86 ? 0.4784 0.6832 0.5176 0.0072 -0.0136 -0.1664 87 THR C CB 3765 O OG1 . THR C 86 ? 0.4848 0.7265 0.5367 0.0108 -0.0239 -0.1896 87 THR C OG1 3766 C CG2 . THR C 86 ? 0.4611 0.6623 0.5183 -0.0137 0.0002 -0.1667 87 THR C CG2 3767 N N . TYR C 87 ? 0.4711 0.6188 0.4857 -0.0067 0.0108 -0.1336 88 TYR C N 3768 C CA . TYR C 87 ? 0.4649 0.5985 0.4781 -0.0100 0.0185 -0.1202 88 TYR C CA 3769 C C . TYR C 87 ? 0.4538 0.5808 0.4821 -0.0171 0.0211 -0.1195 88 TYR C C 3770 O O . TYR C 87 ? 0.4552 0.5778 0.4892 -0.0243 0.0228 -0.1266 88 TYR C O 3771 C CB . TYR C 87 ? 0.4685 0.6046 0.4772 -0.0095 0.0250 -0.1222 88 TYR C CB 3772 C CG . TYR C 87 ? 0.4829 0.6291 0.4700 -0.0054 0.0261 -0.1208 88 TYR C CG 3773 C CD1 . TYR C 87 ? 0.4904 0.6465 0.4685 0.0004 0.0206 -0.1334 88 TYR C CD1 3774 C CD2 . TYR C 87 ? 0.4841 0.6294 0.4560 -0.0107 0.0332 -0.1072 88 TYR C CD2 3775 C CE1 . TYR C 87 ? 0.5077 0.6728 0.4580 0.0047 0.0214 -0.1313 88 TYR C CE1 3776 C CE2 . TYR C 87 ? 0.5105 0.6613 0.4526 -0.0112 0.0366 -0.1030 88 TYR C CE2 3777 C CZ . TYR C 87 ? 0.5222 0.6832 0.4517 -0.0016 0.0303 -0.1145 88 TYR C CZ 3778 O OH . TYR C 87 ? 0.5542 0.7206 0.4468 -0.0016 0.0335 -0.1097 88 TYR C OH 3779 N N . ILE C 88 ? 0.4512 0.5727 0.4803 -0.0166 0.0209 -0.1109 89 ILE C N 3780 C CA . ILE C 88 ? 0.4441 0.5635 0.4827 -0.0217 0.0226 -0.1113 89 ILE C CA 3781 C C . ILE C 88 ? 0.4453 0.5548 0.4837 -0.0236 0.0256 -0.1032 89 ILE C C 3782 O O . ILE C 88 ? 0.4497 0.5572 0.4851 -0.0231 0.0260 -0.0972 89 ILE C O 3783 C CB . ILE C 88 ? 0.4449 0.5732 0.4877 -0.0158 0.0168 -0.1161 89 ILE C CB 3784 C CG1 . ILE C 88 ? 0.4417 0.5934 0.4916 -0.0121 0.0117 -0.1303 89 ILE C CG1 3785 C CG2 . ILE C 88 ? 0.4387 0.5704 0.4889 -0.0211 0.0204 -0.1184 89 ILE C CG2 3786 C CD1 . ILE C 88 ? 0.4460 0.6094 0.4980 0.0046 -0.0001 -0.1386 89 ILE C CD1 3787 N N . CYS C 89 ? 0.4500 0.5526 0.4886 -0.0273 0.0272 -0.1036 90 CYS C N 3788 C CA . CYS C 89 ? 0.4571 0.5549 0.4955 -0.0252 0.0261 -0.0995 90 CYS C CA 3789 C C . CYS C 89 ? 0.4551 0.5536 0.4934 -0.0281 0.0252 -0.0987 90 CYS C C 3790 O O . CYS C 89 ? 0.4633 0.5620 0.4968 -0.0335 0.0277 -0.1013 90 CYS C O 3791 C CB . CYS C 89 ? 0.4747 0.5554 0.5030 -0.0220 0.0236 -0.1000 90 CYS C CB 3792 S SG . CYS C 89 ? 0.5081 0.5876 0.5350 -0.0108 0.0159 -0.0990 90 CYS C SG 3793 N N . VAL C 90 ? 0.4517 0.5539 0.4955 -0.0270 0.0227 -0.0978 91 VAL C N 3794 C CA . VAL C 90 ? 0.4536 0.5559 0.4970 -0.0278 0.0202 -0.1009 91 VAL C CA 3795 C C . VAL C 90 ? 0.4583 0.5644 0.5034 -0.0271 0.0157 -0.1021 91 VAL C C 3796 O O . VAL C 90 ? 0.4591 0.5738 0.5149 -0.0294 0.0147 -0.1032 91 VAL C O 3797 C CB . VAL C 90 ? 0.4582 0.5547 0.5041 -0.0266 0.0173 -0.1032 91 VAL C CB 3798 C CG1 . VAL C 90 ? 0.4627 0.5581 0.5083 -0.0241 0.0129 -0.1115 91 VAL C CG1 3799 C CG2 . VAL C 90 ? 0.4608 0.5594 0.5051 -0.0215 0.0170 -0.1053 91 VAL C CG2 3800 N N . VAL C 91 ? 0.4652 0.5698 0.4988 -0.0255 0.0133 -0.1037 92 VAL C N 3801 C CA . VAL C 91 ? 0.4706 0.5813 0.5024 -0.0214 0.0054 -0.1073 92 VAL C CA 3802 C C . VAL C 91 ? 0.4751 0.5899 0.5063 -0.0236 0.0030 -0.1159 92 VAL C C 3803 O O . VAL C 91 ? 0.4830 0.5971 0.5038 -0.0243 0.0073 -0.1185 92 VAL C O 3804 C CB . VAL C 91 ? 0.4946 0.5924 0.5013 -0.0143 0.0008 -0.1015 92 VAL C CB 3805 C CG1 . VAL C 91 ? 0.5027 0.6102 0.5058 -0.0042 -0.0122 -0.1071 92 VAL C CG1 3806 C CG2 . VAL C 91 ? 0.4963 0.5805 0.5000 -0.0095 0.0009 -0.0960 92 VAL C CG2 3807 N N . GLY C 92 ? 0.4734 0.5967 0.5177 -0.0258 -0.0034 -0.1239 93 GLY C N 3808 C CA . GLY C 92 ? 0.4810 0.6045 0.5241 -0.0270 -0.0087 -0.1360 93 GLY C CA 3809 C C . GLY C 92 ? 0.4914 0.6300 0.5268 -0.0215 -0.0186 -0.1433 93 GLY C C 3810 O O . GLY C 92 ? 0.4908 0.6447 0.5360 -0.0190 -0.0250 -0.1446 93 GLY C O 3811 N N . ASP C 93 ? 0.5054 0.6450 0.5228 -0.0174 -0.0208 -0.1508 94 ASP C N 3812 C CA . ASP C 93 ? 0.5236 0.6749 0.5217 -0.0095 -0.0314 -0.1559 94 ASP C CA 3813 C C . ASP C 93 ? 0.5320 0.6990 0.5436 -0.0108 -0.0438 -0.1764 94 ASP C C 3814 O O . ASP C 93 ? 0.5512 0.7321 0.5464 -0.0021 -0.0557 -0.1837 94 ASP C O 3815 C CB . ASP C 93 ? 0.5453 0.6914 0.5057 -0.0068 -0.0251 -0.1507 94 ASP C CB 3816 C CG . ASP C 93 ? 0.5474 0.7005 0.5104 -0.0101 -0.0168 -0.1640 94 ASP C CG 3817 O OD1 . ASP C 93 ? 0.5470 0.7015 0.5307 -0.0093 -0.0230 -0.1806 94 ASP C OD1 3818 O OD2 . ASP C 93 ? 0.5560 0.7134 0.4994 -0.0139 -0.0043 -0.1601 94 ASP C OD2 3819 N N . ARG C 94 ? 0.5255 0.6854 0.5620 -0.0226 -0.0425 -0.1856 95 ARG C N 3820 C CA . ARG C 94 ? 0.5411 0.7100 0.5933 -0.0310 -0.0536 -0.2065 95 ARG C CA 3821 C C . ARG C 94 ? 0.5380 0.6998 0.6182 -0.0516 -0.0499 -0.2066 95 ARG C C 3822 O O . ARG C 94 ? 0.5319 0.6726 0.6133 -0.0568 -0.0391 -0.1915 95 ARG C O 3823 C CB . ARG C 94 ? 0.5636 0.7169 0.6038 -0.0281 -0.0570 -0.2233 95 ARG C CB 3824 C CG . ARG C 94 ? 0.5740 0.7412 0.5830 -0.0125 -0.0575 -0.2274 95 ARG C CG 3825 C CD . ARG C 94 ? 0.5884 0.7819 0.5846 -0.0060 -0.0718 -0.2379 95 ARG C CD 3826 N NE . ARG C 94 ? 0.6104 0.8126 0.5681 0.0053 -0.0710 -0.2428 95 ARG C NE 3827 C CZ . ARG C 94 ? 0.6186 0.8203 0.5410 0.0107 -0.0623 -0.2236 95 ARG C CZ 3828 N NH1 . ARG C 94 ? 0.6467 0.8587 0.5305 0.0155 -0.0587 -0.2293 95 ARG C NH1 3829 N NH2 . ARG C 94 ? 0.6073 0.7959 0.5294 0.0091 -0.0565 -0.1996 95 ARG C NH2 3830 N N . GLY C 95 ? 0.5512 0.7328 0.6517 -0.0659 -0.0582 -0.2244 96 GLY C N 3831 C CA . GLY C 95 ? 0.5617 0.7344 0.6840 -0.0950 -0.0521 -0.2266 96 GLY C CA 3832 C C . GLY C 95 ? 0.6025 0.7311 0.7173 -0.1097 -0.0571 -0.2397 96 GLY C C 3833 O O . GLY C 95 ? 0.6306 0.7567 0.7612 -0.1386 -0.0585 -0.2525 96 GLY C O 3834 N N . SER C 96 ? 0.6112 0.7059 0.7018 -0.0904 -0.0601 -0.2389 97 SER C N 3835 C CA . SER C 96 ? 0.6553 0.7029 0.7342 -0.0941 -0.0693 -0.2556 97 SER C CA 3836 C C . SER C 96 ? 0.6629 0.6717 0.7196 -0.0716 -0.0680 -0.2482 97 SER C C 3837 O O . SER C 96 ? 0.6306 0.6547 0.6834 -0.0573 -0.0587 -0.2309 97 SER C O 3838 C CB . SER C 96 ? 0.6669 0.7403 0.7458 -0.0859 -0.0832 -0.2834 97 SER C CB 3839 O OG . SER C 96 ? 0.6414 0.7422 0.7033 -0.0573 -0.0826 -0.2820 97 SER C OG 3840 N N . ALA C 97 ? 0.7110 0.6715 0.7545 -0.0672 -0.0793 -0.2650 98 ALA C N 3841 C CA . ALA C 97 ? 0.7275 0.6550 0.7531 -0.0403 -0.0830 -0.2662 98 ALA C CA 3842 C C . ALA C 97 ? 0.6951 0.6742 0.7192 -0.0123 -0.0791 -0.2756 98 ALA C C 3843 O O . ALA C 97 ? 0.6941 0.6713 0.7123 0.0091 -0.0774 -0.2755 98 ALA C O 3844 C CB . ALA C 97 ? 0.7974 0.6568 0.8070 -0.0380 -0.1003 -0.2870 98 ALA C CB 3845 N N . LEU C 98 ? 0.6763 0.7033 0.7037 -0.0141 -0.0778 -0.2842 99 LEU C N 3846 C CA . LEU C 98 ? 0.6604 0.7332 0.6765 0.0054 -0.0720 -0.2922 99 LEU C CA 3847 C C . LEU C 98 ? 0.6201 0.7244 0.6344 0.0040 -0.0562 -0.2655 99 LEU C C 3848 O O . LEU C 98 ? 0.6124 0.7523 0.6111 0.0105 -0.0487 -0.2656 99 LEU C O 3849 C CB . LEU C 98 ? 0.6745 0.7754 0.6824 0.0056 -0.0803 -0.3135 99 LEU C CB 3850 C CG . LEU C 98 ? 0.7187 0.7906 0.7281 0.0041 -0.0977 -0.3449 99 LEU C CG 3851 C CD1 . LEU C 98 ? 0.7268 0.8359 0.7302 0.0011 -0.1065 -0.3627 99 LEU C CD1 3852 C CD2 . LEU C 98 ? 0.7462 0.7976 0.7459 0.0282 -0.1033 -0.3696 99 LEU C CD2 3853 N N . GLY C 99 ? 0.6034 0.6898 0.6287 -0.0063 -0.0510 -0.2430 100 GLY C N 3854 C CA . GLY C 99 ? 0.5715 0.6790 0.5958 -0.0087 -0.0385 -0.2194 100 GLY C CA 3855 C C . GLY C 99 ? 0.5610 0.6751 0.5820 0.0012 -0.0284 -0.2145 100 GLY C C 3856 O O . GLY C 99 ? 0.5761 0.6759 0.6005 0.0130 -0.0326 -0.2270 100 GLY C O 3857 N N . ARG C 100 ? 0.5410 0.6759 0.5546 -0.0026 -0.0170 -0.1985 103 ARG C N 3858 C CA . ARG C 100 ? 0.5308 0.6788 0.5451 0.0000 -0.0056 -0.1938 103 ARG C CA 3859 C C . ARG C 100 ? 0.5093 0.6470 0.5282 -0.0090 -0.0004 -0.1707 103 ARG C C 3860 O O . ARG C 100 ? 0.5089 0.6451 0.5192 -0.0154 -0.0001 -0.1582 103 ARG C O 3861 C CB . ARG C 100 ? 0.5407 0.7225 0.5355 -0.0023 0.0059 -0.1991 103 ARG C CB 3862 C CG . ARG C 100 ? 0.5439 0.7538 0.5452 -0.0033 0.0193 -0.2042 103 ARG C CG 3863 C CD . ARG C 100 ? 0.5663 0.8016 0.5814 0.0143 0.0160 -0.2350 103 ARG C CD 3864 N NE . ARG C 100 ? 0.5931 0.8597 0.5912 0.0156 0.0212 -0.2540 103 ARG C NE 3865 C CZ . ARG C 100 ? 0.6161 0.8726 0.6095 0.0277 0.0084 -0.2713 103 ARG C CZ 3866 N NH1 . ARG C 100 ? 0.6391 0.9299 0.6135 0.0289 0.0146 -0.2897 103 ARG C NH1 3867 N NH2 . ARG C 100 ? 0.6154 0.8272 0.6198 0.0359 -0.0096 -0.2714 103 ARG C NH2 3868 N N . LEU C 101 ? 0.4979 0.6281 0.5283 -0.0059 0.0010 -0.1677 104 LEU C N 3869 C CA . LEU C 101 ? 0.4766 0.5999 0.5105 -0.0130 0.0060 -0.1497 104 LEU C CA 3870 C C . LEU C 101 ? 0.4685 0.6118 0.4956 -0.0190 0.0178 -0.1458 104 LEU C C 3871 O O . LEU C 101 ? 0.4712 0.6395 0.5007 -0.0172 0.0235 -0.1588 104 LEU C O 3872 C CB . LEU C 101 ? 0.4787 0.5822 0.5211 -0.0076 0.0009 -0.1475 104 LEU C CB 3873 C CG . LEU C 101 ? 0.4992 0.5692 0.5406 -0.0103 -0.0083 -0.1460 104 LEU C CG 3874 C CD1 . LEU C 101 ? 0.5089 0.5517 0.5446 -0.0058 -0.0126 -0.1386 104 LEU C CD1 3875 C CD2 . LEU C 101 ? 0.4879 0.5603 0.5333 -0.0252 -0.0058 -0.1372 104 LEU C CD2 3876 N N . HIS C 102 ? 0.4640 0.5970 0.4829 -0.0271 0.0212 -0.1303 105 HIS C N 3877 C CA . HIS C 102 ? 0.4686 0.6062 0.4752 -0.0382 0.0318 -0.1243 105 HIS C CA 3878 C C . HIS C 102 ? 0.4534 0.5832 0.4713 -0.0396 0.0326 -0.1181 105 HIS C C 3879 O O . HIS C 102 ? 0.4481 0.5616 0.4688 -0.0353 0.0271 -0.1099 105 HIS C O 3880 C CB . HIS C 102 ? 0.4934 0.6124 0.4701 -0.0436 0.0317 -0.1122 105 HIS C CB 3881 C CG . HIS C 102 ? 0.5120 0.6397 0.4718 -0.0411 0.0294 -0.1184 105 HIS C CG 3882 N ND1 . HIS C 102 ? 0.5443 0.6831 0.4776 -0.0528 0.0405 -0.1201 105 HIS C ND1 3883 C CD2 . HIS C 102 ? 0.5118 0.6418 0.4763 -0.0305 0.0179 -0.1254 105 HIS C CD2 3884 C CE1 . HIS C 102 ? 0.5573 0.7044 0.4771 -0.0461 0.0350 -0.1275 105 HIS C CE1 3885 N NE2 . HIS C 102 ? 0.5406 0.6821 0.4807 -0.0321 0.0202 -0.1318 105 HIS C NE2 3886 N N . PHE C 103 ? 0.4487 0.5976 0.4746 -0.0455 0.0395 -0.1258 106 PHE C N 3887 C CA . PHE C 103 ? 0.4357 0.5834 0.4733 -0.0447 0.0382 -0.1249 106 PHE C CA 3888 C C . PHE C 103 ? 0.4502 0.5890 0.4768 -0.0618 0.0462 -0.1199 106 PHE C C 3889 O O . PHE C 103 ? 0.4690 0.6147 0.4833 -0.0795 0.0566 -0.1219 106 PHE C O 3890 C CB . PHE C 103 ? 0.4251 0.6024 0.4822 -0.0351 0.0350 -0.1415 106 PHE C CB 3891 C CG . PHE C 103 ? 0.4205 0.5892 0.4815 -0.0162 0.0233 -0.1459 106 PHE C CG 3892 C CD1 . PHE C 103 ? 0.4186 0.5953 0.4786 -0.0110 0.0222 -0.1560 106 PHE C CD1 3893 C CD2 . PHE C 103 ? 0.4207 0.5684 0.4809 -0.0049 0.0131 -0.1403 106 PHE C CD2 3894 C CE1 . PHE C 103 ? 0.4285 0.5863 0.4886 0.0054 0.0093 -0.1617 106 PHE C CE1 3895 C CE2 . PHE C 103 ? 0.4385 0.5631 0.4933 0.0086 0.0016 -0.1420 106 PHE C CE2 3896 C CZ . PHE C 103 ? 0.4418 0.5687 0.4977 0.0141 -0.0011 -0.1534 106 PHE C CZ 3897 N N . GLY C 104 ? 0.4469 0.5678 0.4745 -0.0586 0.0420 -0.1143 107 GLY C N 3898 C CA . GLY C 104 ? 0.4673 0.5744 0.4862 -0.0730 0.0465 -0.1138 107 GLY C CA 3899 C C . GLY C 104 ? 0.4575 0.5958 0.4973 -0.0761 0.0474 -0.1287 107 GLY C C 3900 O O . GLY C 104 ? 0.4388 0.5979 0.4945 -0.0597 0.0402 -0.1350 107 GLY C O 3901 N N . ALA C 105 ? 0.4791 0.6170 0.5156 -0.0974 0.0544 -0.1348 108 ALA C N 3902 C CA . ALA C 105 ? 0.4719 0.6490 0.5316 -0.1029 0.0544 -0.1541 108 ALA C CA 3903 C C . ALA C 105 ? 0.4598 0.6355 0.5267 -0.0825 0.0419 -0.1563 108 ALA C C 3904 O O . ALA C 105 ? 0.4520 0.6644 0.5370 -0.0737 0.0354 -0.1716 108 ALA C O 3905 C CB . ALA C 105 ? 0.5046 0.6758 0.5571 -0.1366 0.0653 -0.1605 108 ALA C CB 3906 N N . GLY C 106 ? 0.4643 0.6017 0.5151 -0.0734 0.0380 -0.1429 109 GLY C N 3907 C CA . GLY C 106 ? 0.4569 0.5945 0.5083 -0.0565 0.0295 -0.1440 109 GLY C CA 3908 C C . GLY C 106 ? 0.4763 0.6003 0.5223 -0.0635 0.0282 -0.1527 109 GLY C C 3909 O O . GLY C 106 ? 0.4927 0.6137 0.5397 -0.0846 0.0324 -0.1622 109 GLY C O 3910 N N . THR C 107 ? 0.4771 0.5931 0.5158 -0.0481 0.0232 -0.1510 110 THR C N 3911 C CA . THR C 107 ? 0.4993 0.6078 0.5328 -0.0486 0.0194 -0.1640 110 THR C CA 3912 C C . THR C 107 ? 0.4924 0.6348 0.5296 -0.0377 0.0127 -0.1736 110 THR C C 3913 O O . THR C 107 ? 0.4842 0.6362 0.5147 -0.0231 0.0109 -0.1636 110 THR C O 3914 C CB . THR C 107 ? 0.5122 0.5945 0.5328 -0.0353 0.0182 -0.1607 110 THR C CB 3915 O OG1 . THR C 107 ? 0.5310 0.5796 0.5431 -0.0382 0.0196 -0.1506 110 THR C OG1 3916 C CG2 . THR C 107 ? 0.5388 0.6087 0.5525 -0.0343 0.0131 -0.1786 110 THR C CG2 3917 N N . GLN C 108 ? 0.5057 0.6632 0.5497 -0.0462 0.0081 -0.1929 111 GLN C N 3918 C CA . GLN C 108 ? 0.5083 0.6971 0.5504 -0.0328 -0.0020 -0.2047 111 GLN C CA 3919 C C . GLN C 108 ? 0.5260 0.7026 0.5499 -0.0231 -0.0040 -0.2099 111 GLN C C 3920 O O . GLN C 108 ? 0.5474 0.7050 0.5710 -0.0323 -0.0039 -0.2238 111 GLN C O 3921 C CB . GLN C 108 ? 0.5153 0.7383 0.5780 -0.0461 -0.0077 -0.2290 111 GLN C CB 3922 C CG . GLN C 108 ? 0.5272 0.7893 0.5883 -0.0272 -0.0235 -0.2436 111 GLN C CG 3923 C CD . GLN C 108 ? 0.5387 0.8487 0.6290 -0.0403 -0.0303 -0.2735 111 GLN C CD 3924 O OE1 . GLN C 108 ? 0.5525 0.8788 0.6451 -0.0446 -0.0383 -0.2961 111 GLN C OE1 3925 N NE2 . GLN C 108 ? 0.5265 0.8657 0.6415 -0.0477 -0.0268 -0.2775 111 GLN C NE2 3926 N N . LEU C 109 ? 0.5241 0.7085 0.5291 -0.0057 -0.0053 -0.1996 112 LEU C N 3927 C CA . LEU C 109 ? 0.5414 0.7266 0.5276 0.0038 -0.0046 -0.2068 112 LEU C CA 3928 C C . LEU C 109 ? 0.5613 0.7726 0.5325 0.0131 -0.0163 -0.2212 112 LEU C C 3929 O O . LEU C 109 ? 0.5661 0.7900 0.5233 0.0228 -0.0236 -0.2116 112 LEU C O 3930 C CB . LEU C 109 ? 0.5378 0.7201 0.5086 0.0111 0.0054 -0.1879 112 LEU C CB 3931 C CG . LEU C 109 ? 0.5563 0.7505 0.5105 0.0198 0.0107 -0.1981 112 LEU C CG 3932 C CD1 . LEU C 109 ? 0.5573 0.7359 0.5262 0.0222 0.0123 -0.2135 112 LEU C CD1 3933 C CD2 . LEU C 109 ? 0.5595 0.7654 0.4953 0.0203 0.0224 -0.1798 112 LEU C CD2 3934 N N . ILE C 110 ? 0.5791 0.7940 0.5497 0.0122 -0.0206 -0.2453 113 ILE C N 3935 C CA . ILE C 110 ? 0.6033 0.8460 0.5581 0.0219 -0.0334 -0.2640 113 ILE C CA 3936 C C . ILE C 110 ? 0.6271 0.8730 0.5544 0.0335 -0.0292 -0.2717 113 ILE C C 3937 O O . ILE C 110 ? 0.6367 0.8682 0.5711 0.0316 -0.0259 -0.2889 113 ILE C O 3938 C CB . ILE C 110 ? 0.6137 0.8678 0.5930 0.0081 -0.0440 -0.2942 113 ILE C CB 3939 C CG1 . ILE C 110 ? 0.5939 0.8585 0.6035 -0.0065 -0.0447 -0.2909 113 ILE C CG1 3940 C CG2 . ILE C 110 ? 0.6385 0.9279 0.6020 0.0208 -0.0605 -0.3172 113 ILE C CG2 3941 C CD1 . ILE C 110 ? 0.6094 0.8765 0.6473 -0.0342 -0.0455 -0.3169 113 ILE C CD1 3942 N N . VAL C 111 ? 0.6438 0.9060 0.5354 0.0461 -0.0297 -0.2598 114 VAL C N 3943 C CA . VAL C 111 ? 0.6705 0.9462 0.5311 0.0550 -0.0220 -0.2665 114 VAL C CA 3944 C C . VAL C 111 ? 0.7053 1.0053 0.5428 0.0656 -0.0375 -0.2910 114 VAL C C 3945 O O . VAL C 111 ? 0.7258 1.0364 0.5363 0.0743 -0.0503 -0.2827 114 VAL C O 3946 C CB . VAL C 111 ? 0.6807 0.9569 0.5074 0.0550 -0.0081 -0.2358 114 VAL C CB 3947 C CG1 . VAL C 111 ? 0.7151 1.0167 0.5098 0.0598 0.0043 -0.2454 114 VAL C CG1 3948 C CG2 . VAL C 111 ? 0.6458 0.9032 0.4990 0.0439 0.0052 -0.2159 114 VAL C CG2 3949 N N . ILE C 112 ? 0.7189 1.0243 0.5645 0.0675 -0.0393 -0.3230 115 ILE C N 3950 C CA . ILE C 112 ? 0.7534 1.0835 0.5804 0.0767 -0.0552 -0.3531 115 ILE C CA 3951 C C . ILE C 112 ? 0.7913 1.1458 0.5704 0.0907 -0.0473 -0.3570 115 ILE C C 3952 O O . ILE C 112 ? 0.7929 1.1493 0.5725 0.0925 -0.0304 -0.3615 115 ILE C O 3953 C CB . ILE C 112 ? 0.7597 1.0776 0.6198 0.0680 -0.0647 -0.3909 115 ILE C CB 3954 C CG1 . ILE C 112 ? 0.7574 1.0434 0.6318 0.0672 -0.0519 -0.3971 115 ILE C CG1 3955 C CG2 . ILE C 112 ? 0.7402 1.0510 0.6376 0.0496 -0.0747 -0.3919 115 ILE C CG2 3956 C CD1 . ILE C 112 ? 0.7927 1.0559 0.6786 0.0646 -0.0629 -0.4376 115 ILE C CD1 3957 N N . PRO C 113 ? 0.6435 1.0534 0.5517 0.1231 -0.1594 -0.1059 116 PRO C N 3958 C CA . PRO C 113 ? 0.6157 1.0474 0.5734 0.1095 -0.1479 -0.1245 116 PRO C CA 3959 C C . PRO C 113 ? 0.6145 1.0413 0.5912 0.1388 -0.1476 -0.1097 116 PRO C C 3960 O O . PRO C 113 ? 0.6276 0.9991 0.5773 0.1583 -0.1444 -0.0825 116 PRO C O 3961 C CB . PRO C 113 ? 0.5936 0.9666 0.5433 0.0774 -0.1219 -0.1261 116 PRO C CB 3962 C CG . PRO C 113 ? 0.6022 0.9144 0.5070 0.0875 -0.1187 -0.1006 116 PRO C CG 3963 C CD . PRO C 113 ? 0.6351 0.9740 0.5116 0.1063 -0.1397 -0.0941 116 PRO C CD 3964 N N . ASP C 114 ? 0.6040 1.0900 0.6301 0.1403 -0.1492 -0.1306 117 ASP C N 3965 C CA . ASP C 114 ? 0.6020 1.0882 0.6544 0.1662 -0.1451 -0.1248 117 ASP C CA 3966 C C . ASP C 114 ? 0.5758 1.0150 0.6303 0.1425 -0.1154 -0.1261 117 ASP C C 3967 O O . ASP C 114 ? 0.5604 1.0274 0.6419 0.1136 -0.0998 -0.1474 117 ASP C O 3968 C CB . ASP C 114 ? 0.6042 1.1833 0.7134 0.1791 -0.1579 -0.1505 117 ASP C CB 3969 C CG . ASP C 114 ? 0.6129 1.1966 0.7540 0.2109 -0.1537 -0.1486 117 ASP C CG 3970 O OD1 . ASP C 114 ? 0.6136 1.2711 0.8100 0.2127 -0.1530 -0.1757 117 ASP C OD1 3971 O OD2 . ASP C 114 ? 0.6289 1.1446 0.7435 0.2328 -0.1495 -0.1233 117 ASP C OD2 3972 N N . ILE C 115 ? 0.5769 0.9464 0.6010 0.1533 -0.1072 -0.1031 118 ILE C N 3973 C CA . ILE C 115 ? 0.5583 0.8862 0.5790 0.1352 -0.0829 -0.1035 118 ILE C CA 3974 C C . ILE C 115 ? 0.5586 0.9077 0.6134 0.1541 -0.0758 -0.1140 118 ILE C C 3975 O O . ILE C 115 ? 0.5767 0.9013 0.6305 0.1857 -0.0814 -0.1029 118 ILE C O 3976 C CB . ILE C 115 ? 0.5632 0.8147 0.5407 0.1349 -0.0773 -0.0804 118 ILE C CB 3977 C CG1 . ILE C 115 ? 0.5648 0.8008 0.5114 0.1206 -0.0838 -0.0728 118 ILE C CG1 3978 C CG2 . ILE C 115 ? 0.5503 0.7684 0.5229 0.1164 -0.0561 -0.0832 118 ILE C CG2 3979 C CD1 . ILE C 115 ? 0.5475 0.7988 0.4996 0.0865 -0.0758 -0.0895 118 ILE C CD1 3980 N N . GLN C 116 ? 0.5441 0.9369 0.6293 0.1333 -0.0610 -0.1365 119 GLN C N 3981 C CA . GLN C 116 ? 0.5469 0.9756 0.6706 0.1484 -0.0512 -0.1541 119 GLN C CA 3982 C C . GLN C 116 ? 0.5501 0.9244 0.6547 0.1518 -0.0343 -0.1489 119 GLN C C 3983 O O . GLN C 116 ? 0.5637 0.9425 0.6905 0.1794 -0.0325 -0.1572 119 GLN C O 3984 C CB . GLN C 116 ? 0.5367 1.0305 0.6955 0.1186 -0.0352 -0.1803 119 GLN C CB 3985 C CG . GLN C 116 ? 0.5427 1.1067 0.7574 0.1389 -0.0310 -0.2060 119 GLN C CG 3986 C CD . GLN C 116 ? 0.5435 1.1879 0.8041 0.1564 -0.0538 -0.2214 119 GLN C CD 3987 O OE1 . GLN C 116 ? 0.5386 1.2607 0.8540 0.1598 -0.0478 -0.2494 119 GLN C OE1 3988 N NE2 . GLN C 116 ? 0.5497 1.1824 0.7885 0.1674 -0.0800 -0.2054 119 GLN C NE2 3989 N N . ASN C 117 ? 0.5400 0.8652 0.6057 0.1249 -0.0230 -0.1376 120 ASN C N 3990 C CA . ASN C 117 ? 0.5446 0.8242 0.5892 0.1243 -0.0094 -0.1353 120 ASN C CA 3991 C C . ASN C 117 ? 0.5401 0.7543 0.5432 0.1195 -0.0147 -0.1132 120 ASN C C 3992 O O . ASN C 117 ? 0.5313 0.7264 0.5086 0.0942 -0.0087 -0.1063 120 ASN C O 3993 C CB . ASN C 117 ? 0.5430 0.8433 0.5857 0.0965 0.0134 -0.1491 120 ASN C CB 3994 C CG . ASN C 117 ? 0.5580 0.9217 0.6442 0.1041 0.0246 -0.1754 120 ASN C CG 3995 O OD1 . ASN C 117 ? 0.5779 0.9432 0.6808 0.1279 0.0286 -0.1888 120 ASN C OD1 3996 N ND2 . ASN C 117 ? 0.5633 0.9808 0.6722 0.0831 0.0315 -0.1862 120 ASN C ND2 3997 N N . PRO C 118 ? 0.5507 0.7302 0.5489 0.1446 -0.0252 -0.1016 121 PRO C N 3998 C CA . PRO C 118 ? 0.5502 0.6730 0.5147 0.1388 -0.0270 -0.0836 121 PRO C CA 3999 C C . PRO C 118 ? 0.5459 0.6428 0.4966 0.1239 -0.0127 -0.0911 121 PRO C C 4000 O O . PRO C 118 ? 0.5586 0.6583 0.5233 0.1320 -0.0035 -0.1071 121 PRO C O 4001 C CB . PRO C 118 ? 0.5795 0.6729 0.5468 0.1689 -0.0360 -0.0714 121 PRO C CB 4002 C CG . PRO C 118 ? 0.5895 0.7303 0.5879 0.1932 -0.0468 -0.0777 121 PRO C CG 4003 C CD . PRO C 118 ? 0.5721 0.7629 0.5972 0.1802 -0.0349 -0.1033 121 PRO C CD 4004 N N . ASP C 119 ? 0.5305 0.6070 0.4551 0.1037 -0.0119 -0.0819 122 ASP C N 4005 C CA . ASP C 119 ? 0.5276 0.5833 0.4357 0.0914 -0.0037 -0.0869 122 ASP C CA 4006 C C . ASP C 119 ? 0.5234 0.5419 0.4137 0.0871 -0.0089 -0.0735 122 ASP C C 4007 O O . ASP C 119 ? 0.5126 0.5271 0.3865 0.0725 -0.0096 -0.0691 122 ASP C O 4008 C CB . ASP C 119 ? 0.5202 0.5988 0.4160 0.0711 0.0031 -0.0900 122 ASP C CB 4009 C CG . ASP C 119 ? 0.5304 0.6012 0.4074 0.0623 0.0096 -0.0976 122 ASP C CG 4010 O OD1 . ASP C 119 ? 0.5430 0.5990 0.4246 0.0702 0.0113 -0.1092 122 ASP C OD1 4011 O OD2 . ASP C 119 ? 0.5331 0.6117 0.3892 0.0470 0.0129 -0.0919 122 ASP C OD2 4012 N N . PRO C 120 ? 0.5356 0.5265 0.4298 0.1005 -0.0115 -0.0662 123 PRO C N 4013 C CA . PRO C 120 ? 0.5376 0.4992 0.4169 0.0942 -0.0133 -0.0532 123 PRO C CA 4014 C C . PRO C 120 ? 0.5354 0.4857 0.4089 0.0791 -0.0080 -0.0622 123 PRO C C 4015 O O . PRO C 120 ? 0.5484 0.4948 0.4295 0.0782 -0.0019 -0.0783 123 PRO C O 4016 C CB . PRO C 120 ? 0.5688 0.4992 0.4520 0.1110 -0.0124 -0.0434 123 PRO C CB 4017 C CG . PRO C 120 ? 0.5816 0.5147 0.4857 0.1251 -0.0083 -0.0582 123 PRO C CG 4018 C CD . PRO C 120 ? 0.5584 0.5400 0.4711 0.1224 -0.0104 -0.0698 123 PRO C CD 4019 N N . ALA C 121 ? 0.5214 0.4713 0.3840 0.0684 -0.0111 -0.0552 124 ALA C N 4020 C CA . ALA C 121 ? 0.5206 0.4693 0.3818 0.0567 -0.0098 -0.0638 124 ALA C CA 4021 C C . ALA C 121 ? 0.5160 0.4595 0.3737 0.0506 -0.0112 -0.0554 124 ALA C C 4022 O O . ALA C 121 ? 0.5097 0.4543 0.3604 0.0535 -0.0138 -0.0441 124 ALA C O 4023 C CB . ALA C 121 ? 0.5117 0.4847 0.3648 0.0519 -0.0135 -0.0706 124 ALA C CB 4024 N N . VAL C 122 ? 0.5212 0.4645 0.3864 0.0416 -0.0088 -0.0650 125 VAL C N 4025 C CA . VAL C 122 ? 0.5180 0.4668 0.3865 0.0357 -0.0087 -0.0626 125 VAL C CA 4026 C C . VAL C 122 ? 0.5119 0.4864 0.3855 0.0336 -0.0178 -0.0730 125 VAL C C 4027 O O . VAL C 122 ? 0.5188 0.5047 0.4016 0.0277 -0.0188 -0.0886 125 VAL C O 4028 C CB . VAL C 122 ? 0.5361 0.4666 0.4141 0.0259 0.0040 -0.0641 125 VAL C CB 4029 C CG1 . VAL C 122 ? 0.5302 0.4769 0.4164 0.0183 0.0067 -0.0666 125 VAL C CG1 4030 C CG2 . VAL C 122 ? 0.5534 0.4549 0.4184 0.0322 0.0107 -0.0467 125 VAL C CG2 4031 N N . TYR C 123 ? 0.5077 0.4907 0.3751 0.0396 -0.0253 -0.0650 126 TYR C N 4032 C CA . TYR C 123 ? 0.5110 0.5141 0.3791 0.0442 -0.0369 -0.0683 126 TYR C CA 4033 C C . TYR C 123 ? 0.5089 0.5253 0.3951 0.0465 -0.0388 -0.0729 126 TYR C C 4034 O O . TYR C 123 ? 0.5053 0.5128 0.3958 0.0452 -0.0306 -0.0699 126 TYR C O 4035 C CB . TYR C 123 ? 0.5162 0.5122 0.3651 0.0511 -0.0428 -0.0544 126 TYR C CB 4036 C CG . TYR C 123 ? 0.5265 0.5189 0.3606 0.0480 -0.0390 -0.0520 126 TYR C CG 4037 C CD1 . TYR C 123 ? 0.5381 0.5454 0.3627 0.0464 -0.0416 -0.0597 126 TYR C CD1 4038 C CD2 . TYR C 123 ? 0.5291 0.5103 0.3603 0.0467 -0.0328 -0.0453 126 TYR C CD2 4039 C CE1 . TYR C 123 ? 0.5512 0.5604 0.3647 0.0435 -0.0351 -0.0611 126 TYR C CE1 4040 C CE2 . TYR C 123 ? 0.5311 0.5176 0.3560 0.0446 -0.0282 -0.0465 126 TYR C CE2 4041 C CZ . TYR C 123 ? 0.5439 0.5434 0.3602 0.0430 -0.0279 -0.0544 126 TYR C CZ 4042 O OH . TYR C 123 ? 0.5620 0.5716 0.3743 0.0409 -0.0204 -0.0590 126 TYR C OH 4043 N N . GLN C 124 ? 0.5163 0.5595 0.4132 0.0512 -0.0500 -0.0818 127 GLN C N 4044 C CA . GLN C 124 ? 0.5187 0.5841 0.4397 0.0580 -0.0542 -0.0890 127 GLN C CA 4045 C C . GLN C 124 ? 0.5288 0.5903 0.4413 0.0776 -0.0680 -0.0762 127 GLN C C 4046 O O . GLN C 124 ? 0.5454 0.6099 0.4398 0.0860 -0.0812 -0.0677 127 GLN C O 4047 C CB . GLN C 124 ? 0.5219 0.6276 0.4691 0.0522 -0.0592 -0.1106 127 GLN C CB 4048 C CG . GLN C 124 ? 0.5342 0.6736 0.5161 0.0590 -0.0617 -0.1228 127 GLN C CG 4049 C CD . GLN C 124 ? 0.5511 0.7380 0.5678 0.0471 -0.0630 -0.1496 127 GLN C CD 4050 O OE1 . GLN C 124 ? 0.5743 0.7762 0.5871 0.0402 -0.0710 -0.1602 127 GLN C OE1 4051 N NE2 . GLN C 124 ? 0.5487 0.7641 0.6018 0.0427 -0.0538 -0.1645 127 GLN C NE2 4052 N N . LEU C 125 ? 0.5268 0.5789 0.4502 0.0847 -0.0635 -0.0749 128 LEU C N 4053 C CA . LEU C 125 ? 0.5465 0.5824 0.4652 0.1038 -0.0734 -0.0633 128 LEU C CA 4054 C C . LEU C 125 ? 0.5532 0.6169 0.5061 0.1209 -0.0802 -0.0758 128 LEU C C 4055 O O . LEU C 125 ? 0.5406 0.6230 0.5187 0.1144 -0.0681 -0.0929 128 LEU C O 4056 C CB . LEU C 125 ? 0.5474 0.5455 0.4525 0.0991 -0.0622 -0.0556 128 LEU C CB 4057 C CG . LEU C 125 ? 0.5495 0.5218 0.4250 0.0880 -0.0585 -0.0416 128 LEU C CG 4058 C CD1 . LEU C 125 ? 0.5243 0.5049 0.3950 0.0722 -0.0493 -0.0468 128 LEU C CD1 4059 C CD2 . LEU C 125 ? 0.5584 0.4997 0.4284 0.0866 -0.0522 -0.0377 128 LEU C CD2 4060 N N . ARG C 126 ? 0.5798 0.6476 0.5328 0.1439 -0.0992 -0.0665 129 ARG C N 4061 C CA . ARG C 126 ? 0.5917 0.6924 0.5826 0.1670 -0.1098 -0.0791 129 ARG C CA 4062 C C . ARG C 126 ? 0.6191 0.6837 0.6166 0.1888 -0.1096 -0.0721 129 ARG C C 4063 O O . ARG C 126 ? 0.6448 0.6573 0.6120 0.1916 -0.1098 -0.0504 129 ARG C O 4064 C CB . ARG C 126 ? 0.6079 0.7488 0.6017 0.1838 -0.1351 -0.0771 129 ARG C CB 4065 C CG . ARG C 126 ? 0.5837 0.7700 0.5852 0.1615 -0.1341 -0.0962 129 ARG C CG 4066 C CD . ARG C 126 ? 0.6068 0.8561 0.6310 0.1782 -0.1591 -0.1089 129 ARG C CD 4067 N NE . ARG C 126 ? 0.5886 0.8841 0.6328 0.1519 -0.1538 -0.1369 129 ARG C NE 4068 C CZ . ARG C 126 ? 0.5681 0.9038 0.6609 0.1376 -0.1412 -0.1657 129 ARG C CZ 4069 N NH1 . ARG C 126 ? 0.5631 0.9057 0.6891 0.1486 -0.1328 -0.1722 129 ARG C NH1 4070 N NH2 . ARG C 126 ? 0.5582 0.9265 0.6670 0.1101 -0.1345 -0.1902 129 ARG C NH2 4071 N N . ASP C 127 ? 0.6177 0.7109 0.6580 0.2021 -0.1068 -0.0936 130 ASP C N 4072 C CA . ASP C 127 ? 0.6484 0.7117 0.7050 0.2244 -0.1041 -0.0962 130 ASP C CA 4073 C C . ASP C 127 ? 0.7018 0.7311 0.7466 0.2571 -0.1260 -0.0706 130 ASP C C 4074 O O . ASP C 127 ? 0.7157 0.7751 0.7599 0.2743 -0.1486 -0.0604 130 ASP C O 4075 C CB . ASP C 127 ? 0.6375 0.7540 0.7484 0.2346 -0.0974 -0.1288 130 ASP C CB 4076 C CG . ASP C 127 ? 0.6685 0.7577 0.8022 0.2579 -0.0911 -0.1398 130 ASP C CG 4077 O OD1 . ASP C 127 ? 0.6946 0.7186 0.8016 0.2582 -0.0867 -0.1259 130 ASP C OD1 4078 O OD2 . ASP C 127 ? 0.6665 0.8023 0.8491 0.2746 -0.0887 -0.1664 130 ASP C OD2 4079 N N . SER C 128 ? 0.7411 0.7062 0.7741 0.2643 -0.1189 -0.0600 131 SER C N 4080 C CA . SER C 128 ? 0.8086 0.7241 0.8280 0.2949 -0.1351 -0.0317 131 SER C CA 4081 C C . SER C 128 ? 0.8409 0.7862 0.9042 0.3395 -0.1542 -0.0396 131 SER C C 4082 O O . SER C 128 ? 0.8858 0.8259 0.9369 0.3693 -0.1789 -0.0134 131 SER C O 4083 C CB . SER C 128 ? 0.8437 0.6802 0.8487 0.2874 -0.1181 -0.0253 131 SER C CB 4084 O OG . SER C 128 ? 0.9177 0.6941 0.9082 0.3154 -0.1302 0.0051 131 SER C OG 4085 N N . LYS C 129 ? 0.8241 0.8042 0.9375 0.3451 -0.1429 -0.0757 132 LYS C N 4086 C CA . LYS C 129 ? 0.8546 0.8717 1.0211 0.3889 -0.1585 -0.0905 132 LYS C CA 4087 C C . LYS C 129 ? 0.8269 0.9382 1.0204 0.3942 -0.1768 -0.1029 132 LYS C C 4088 O O . LYS C 129 ? 0.8634 0.9975 1.0640 0.4298 -0.2068 -0.0878 132 LYS C O 4089 C CB . LYS C 129 ? 0.8489 0.8710 1.0613 0.3922 -0.1357 -0.1293 132 LYS C CB 4090 C CG . LYS C 129 ? 0.9006 0.8327 1.1028 0.4012 -0.1235 -0.1243 132 LYS C CG 4091 C CD . LYS C 129 ? 0.9775 0.8684 1.1978 0.4549 -0.1453 -0.1055 132 LYS C CD 4092 N N . SER C 130 ? 0.7727 0.9380 0.9802 0.3583 -0.1590 -0.1303 133 SER C N 4093 C CA . SER C 130 ? 0.7471 1.0033 0.9873 0.3551 -0.1708 -0.1496 133 SER C CA 4094 C C . SER C 130 ? 0.7212 0.9842 0.9187 0.3196 -0.1723 -0.1371 133 SER C C 4095 O O . SER C 130 ? 0.7063 0.9183 0.8603 0.2892 -0.1545 -0.1242 133 SER C O 4096 C CB . SER C 130 ? 0.7129 1.0299 1.0087 0.3404 -0.1470 -0.1930 133 SER C CB 4097 O OG . SER C 130 ? 0.6789 0.9731 0.9478 0.2952 -0.1157 -0.1986 133 SER C OG 4098 N N . SER C 131 ? 0.7206 1.0506 0.9338 0.3250 -0.1942 -0.1445 134 SER C N 4099 C CA . SER C 131 ? 0.6997 1.0437 0.8796 0.2925 -0.1956 -0.1407 134 SER C CA 4100 C C . SER C 131 ? 0.6536 1.0256 0.8541 0.2484 -0.1663 -0.1698 134 SER C C 4101 O O . SER C 131 ? 0.6352 0.9793 0.7988 0.2159 -0.1533 -0.1624 134 SER C O 4102 C CB . SER C 131 ? 0.7199 1.1299 0.9089 0.3131 -0.2306 -0.1428 134 SER C CB 4103 O OG . SER C 131 ? 0.7152 1.2052 0.9739 0.3350 -0.2419 -0.1737 134 SER C OG 4104 N N . ASP C 132 ? 0.6401 1.0649 0.8991 0.2487 -0.1544 -0.2017 135 ASP C N 4105 C CA . ASP C 132 ? 0.6068 1.0681 0.8910 0.2075 -0.1266 -0.2298 135 ASP C CA 4106 C C . ASP C 132 ? 0.5901 0.9897 0.8368 0.1746 -0.0936 -0.2200 135 ASP C C 4107 O O . ASP C 132 ? 0.5753 0.9722 0.8084 0.1390 -0.0779 -0.2232 135 ASP C O 4108 C CB . ASP C 132 ? 0.6030 1.1422 0.9610 0.2157 -0.1197 -0.2668 135 ASP C CB 4109 C CG . ASP C 132 ? 0.6168 1.1339 0.9911 0.2406 -0.1081 -0.2698 135 ASP C CG 4110 O OD1 . ASP C 132 ? 0.6368 1.0857 0.9742 0.2637 -0.1172 -0.2430 135 ASP C OD1 4111 O OD2 . ASP C 132 ? 0.6092 1.1780 1.0348 0.2350 -0.0878 -0.3017 135 ASP C OD2 4112 N N . LYS C 133 ? 0.5990 0.9494 0.8295 0.1876 -0.0842 -0.2091 136 LYS C N 4113 C CA . LYS C 133 ? 0.5867 0.8861 0.7805 0.1604 -0.0569 -0.2008 136 LYS C CA 4114 C C . LYS C 133 ? 0.5818 0.8232 0.7183 0.1490 -0.0628 -0.1713 136 LYS C C 4115 O O . LYS C 133 ? 0.5973 0.8113 0.7123 0.1693 -0.0837 -0.1512 136 LYS C O 4116 C CB . LYS C 133 ? 0.6027 0.8763 0.8005 0.1762 -0.0454 -0.2059 136 LYS C CB 4117 C CG . LYS C 133 ? 0.6055 0.9359 0.8559 0.1783 -0.0273 -0.2402 136 LYS C CG 4118 C CD . LYS C 133 ? 0.6232 0.9242 0.8616 0.1765 -0.0044 -0.2492 136 LYS C CD 4119 C CE . LYS C 133 ? 0.6501 0.9152 0.8963 0.2143 -0.0183 -0.2479 136 LYS C CE 4120 N N . SER C 134 ? 0.5663 0.7896 0.6786 0.1173 -0.0432 -0.1680 137 SER C N 4121 C CA . SER C 134 ? 0.5640 0.7390 0.6284 0.1063 -0.0460 -0.1442 137 SER C CA 4122 C C . SER C 134 ? 0.5597 0.7033 0.5971 0.0832 -0.0230 -0.1384 137 SER C C 4123 O O . SER C 134 ? 0.5561 0.7177 0.6067 0.0689 -0.0029 -0.1512 137 SER C O 4124 C CB . SER C 134 ? 0.5577 0.7519 0.6199 0.0967 -0.0572 -0.1447 137 SER C CB 4125 O OG . SER C 134 ? 0.5458 0.7627 0.6256 0.0695 -0.0395 -0.1610 137 SER C OG 4126 N N . VAL C 135 ? 0.5632 0.6637 0.5621 0.0806 -0.0263 -0.1185 138 VAL C N 4127 C CA . VAL C 135 ? 0.5671 0.6413 0.5377 0.0628 -0.0106 -0.1099 138 VAL C CA 4128 C C . VAL C 135 ? 0.5656 0.6212 0.5144 0.0529 -0.0143 -0.0969 138 VAL C C 4129 O O . VAL C 135 ? 0.5660 0.6252 0.5146 0.0594 -0.0287 -0.0942 138 VAL C O 4130 C CB . VAL C 135 ? 0.5741 0.6203 0.5240 0.0690 -0.0088 -0.1042 138 VAL C CB 4131 C CG1 . VAL C 135 ? 0.5847 0.6477 0.5555 0.0767 -0.0002 -0.1225 138 VAL C CG1 4132 C CG2 . VAL C 135 ? 0.5826 0.6021 0.5196 0.0810 -0.0246 -0.0913 138 VAL C CG2 4133 N N . CYS C 136 ? 0.5741 0.6111 0.5034 0.0393 -0.0013 -0.0893 139 CYS C N 4134 C CA . CYS C 136 ? 0.5781 0.5934 0.4888 0.0338 -0.0033 -0.0782 139 CYS C CA 4135 C C . CYS C 136 ? 0.5774 0.5693 0.4611 0.0377 -0.0044 -0.0644 139 CYS C C 4136 O O . CYS C 136 ? 0.5857 0.5745 0.4581 0.0356 0.0035 -0.0620 139 CYS C O 4137 C CB . CYS C 136 ? 0.5924 0.6024 0.5071 0.0172 0.0116 -0.0799 139 CYS C CB 4138 S SG . CYS C 136 ? 0.6136 0.6598 0.5680 0.0050 0.0167 -0.1029 139 CYS C SG 4139 N N . LEU C 137 ? 0.5692 0.5512 0.4430 0.0424 -0.0141 -0.0577 140 LEU C N 4140 C CA . LEU C 137 ? 0.5654 0.5349 0.4212 0.0449 -0.0163 -0.0487 140 LEU C CA 4141 C C . LEU C 137 ? 0.5674 0.5278 0.4154 0.0440 -0.0153 -0.0422 140 LEU C C 4142 O O . LEU C 137 ? 0.5621 0.5238 0.4128 0.0448 -0.0192 -0.0443 140 LEU C O 4143 C CB . LEU C 137 ? 0.5635 0.5302 0.4178 0.0501 -0.0252 -0.0474 140 LEU C CB 4144 C CG . LEU C 137 ? 0.5610 0.5211 0.4039 0.0481 -0.0267 -0.0425 140 LEU C CG 4145 C CD1 . LEU C 137 ? 0.5658 0.5258 0.4060 0.0464 -0.0242 -0.0482 140 LEU C CD1 4146 C CD2 . LEU C 137 ? 0.5637 0.5167 0.4038 0.0484 -0.0314 -0.0378 140 LEU C CD2 4147 N N . PHE C 138 ? 0.5778 0.5302 0.4150 0.0442 -0.0100 -0.0346 141 PHE C N 4148 C CA . PHE C 138 ? 0.5852 0.5270 0.4168 0.0496 -0.0105 -0.0271 141 PHE C CA 4149 C C . PHE C 138 ? 0.5783 0.5332 0.4053 0.0555 -0.0192 -0.0258 141 PHE C C 4150 O O . PHE C 138 ? 0.5805 0.5442 0.3985 0.0555 -0.0218 -0.0249 141 PHE C O 4151 C CB . PHE C 138 ? 0.6118 0.5365 0.4308 0.0502 -0.0023 -0.0149 141 PHE C CB 4152 C CG . PHE C 138 ? 0.6250 0.5326 0.4401 0.0616 -0.0037 -0.0046 141 PHE C CG 4153 C CD1 . PHE C 138 ? 0.6070 0.5121 0.4376 0.0659 -0.0059 -0.0131 141 PHE C CD1 4154 C CD2 . PHE C 138 ? 0.6516 0.5459 0.4460 0.0700 -0.0027 0.0137 141 PHE C CD2 4155 C CE1 . PHE C 138 ? 0.6267 0.5158 0.4593 0.0801 -0.0065 -0.0065 141 PHE C CE1 4156 C CE2 . PHE C 138 ? 0.6723 0.5480 0.4654 0.0862 -0.0059 0.0252 141 PHE C CE2 4157 C CZ . PHE C 138 ? 0.6587 0.5314 0.4745 0.0920 -0.0074 0.0135 141 PHE C CZ 4158 N N . THR C 139 ? 0.5719 0.5322 0.4065 0.0581 -0.0223 -0.0292 142 THR C N 4159 C CA . THR C 139 ? 0.5657 0.5440 0.4024 0.0583 -0.0275 -0.0318 142 THR C CA 4160 C C . THR C 139 ? 0.5684 0.5580 0.4149 0.0655 -0.0279 -0.0344 142 THR C C 4161 O O . THR C 139 ? 0.5743 0.5538 0.4255 0.0695 -0.0237 -0.0370 142 THR C O 4162 C CB . THR C 139 ? 0.5586 0.5380 0.3960 0.0490 -0.0275 -0.0359 142 THR C CB 4163 O OG1 . THR C 139 ? 0.5664 0.5596 0.4073 0.0435 -0.0286 -0.0390 142 THR C OG1 4164 C CG2 . THR C 139 ? 0.5524 0.5288 0.3900 0.0477 -0.0257 -0.0374 142 THR C CG2 4165 N N . ASP C 140 ? 0.5669 0.5809 0.4202 0.0662 -0.0320 -0.0377 143 ASP C N 4166 C CA . ASP C 140 ? 0.5685 0.6059 0.4384 0.0723 -0.0314 -0.0448 143 ASP C CA 4167 C C . ASP C 140 ? 0.5842 0.6184 0.4616 0.0932 -0.0346 -0.0412 143 ASP C C 4168 O O . ASP C 140 ? 0.5880 0.6322 0.4817 0.1016 -0.0309 -0.0497 143 ASP C O 4169 C CB . ASP C 140 ? 0.5648 0.6036 0.4364 0.0629 -0.0223 -0.0518 143 ASP C CB 4170 C CG . ASP C 140 ? 0.5683 0.6035 0.4294 0.0455 -0.0194 -0.0497 143 ASP C CG 4171 O OD1 . ASP C 140 ? 0.5705 0.6097 0.4330 0.0386 -0.0224 -0.0493 143 ASP C OD1 4172 O OD2 . ASP C 140 ? 0.5815 0.6086 0.4319 0.0394 -0.0145 -0.0486 143 ASP C OD2 4173 N N . PHE C 141 ? 0.6016 0.6199 0.4657 0.1023 -0.0402 -0.0283 144 PHE C N 4174 C CA . PHE C 141 ? 0.6325 0.6391 0.4987 0.1251 -0.0443 -0.0181 144 PHE C CA 4175 C C . PHE C 141 ? 0.6456 0.6916 0.5191 0.1408 -0.0589 -0.0169 144 PHE C C 4176 O O . PHE C 141 ? 0.6321 0.7078 0.5018 0.1301 -0.0654 -0.0223 144 PHE C O 4177 C CB . PHE C 141 ? 0.6557 0.6205 0.4984 0.1257 -0.0402 -0.0005 144 PHE C CB 4178 C CG . PHE C 141 ? 0.6472 0.6182 0.4673 0.1138 -0.0424 0.0053 144 PHE C CG 4179 C CD1 . PHE C 141 ? 0.6601 0.6452 0.4612 0.1247 -0.0528 0.0173 144 PHE C CD1 4180 C CD2 . PHE C 141 ? 0.6172 0.5829 0.4348 0.0939 -0.0346 -0.0028 144 PHE C CD2 4181 C CE1 . PHE C 141 ? 0.6540 0.6479 0.4330 0.1130 -0.0528 0.0177 144 PHE C CE1 4182 C CE2 . PHE C 141 ? 0.6053 0.5773 0.4064 0.0849 -0.0346 -0.0019 144 PHE C CE2 4183 C CZ . PHE C 141 ? 0.6294 0.6154 0.4107 0.0929 -0.0423 0.0066 144 PHE C CZ 4184 N N . ASP C 142 ? 0.6772 0.7254 0.5644 0.1670 -0.0649 -0.0124 145 ASP C N 4185 C CA . ASP C 142 ? 0.6989 0.7925 0.5961 0.1873 -0.0829 -0.0112 145 ASP C CA 4186 C C . ASP C 142 ? 0.7339 0.8203 0.5957 0.1957 -0.0952 0.0106 145 ASP C C 4187 O O . ASP C 142 ? 0.7561 0.7930 0.5882 0.1924 -0.0872 0.0294 145 ASP C O 4188 C CB . ASP C 142 ? 0.7208 0.8239 0.6483 0.2186 -0.0873 -0.0140 145 ASP C CB 4189 C CG . ASP C 142 ? 0.7711 0.8099 0.6853 0.2399 -0.0832 0.0072 145 ASP C CG 4190 O OD1 . ASP C 142 ? 0.7905 0.7791 0.6737 0.2258 -0.0739 0.0226 145 ASP C OD1 4191 O OD2 . ASP C 142 ? 0.7989 0.8366 0.7370 0.2708 -0.0878 0.0070 145 ASP C OD2 4192 N N . SER C 143 ? 0.7448 0.8857 0.6100 0.2047 -0.1137 0.0061 146 SER C N 4193 C CA . SER C 143 ? 0.7828 0.9310 0.6098 0.2119 -0.1276 0.0229 146 SER C CA 4194 C C . SER C 143 ? 0.8464 0.9540 0.6465 0.2437 -0.1337 0.0573 146 SER C C 4195 O O . SER C 143 ? 0.8867 0.9970 0.6467 0.2538 -0.1452 0.0779 146 SER C O 4196 C CB . SER C 143 ? 0.7774 1.0033 0.6197 0.2141 -0.1482 0.0039 146 SER C CB 4197 O OG . SER C 143 ? 0.7314 0.9832 0.5991 0.1816 -0.1383 -0.0259 146 SER C OG 4198 N N . GLN C 144 ? 0.8634 0.9300 0.6835 0.2584 -0.1244 0.0632 147 GLN C N 4199 C CA . GLN C 144 ? 0.9319 0.9397 0.7307 0.2857 -0.1239 0.0962 147 GLN C CA 4200 C C . GLN C 144 ? 0.9535 0.8976 0.7115 0.2630 -0.1039 0.1158 147 GLN C C 4201 O O . GLN C 144 ? 1.0188 0.9179 0.7406 0.2777 -0.1032 0.1496 147 GLN C O 4202 C CB . GLN C 144 ? 0.9376 0.9197 0.7776 0.3034 -0.1159 0.0871 147 GLN C CB 4203 C CG . GLN C 144 ? 1.0173 0.9532 0.8514 0.3455 -0.1233 0.1168 147 GLN C CG 4204 C CD . GLN C 144 ? 1.0229 0.9571 0.9096 0.3698 -0.1206 0.0974 147 GLN C CD 4205 O OE1 . GLN C 144 ? 1.0713 1.0145 0.9743 0.4132 -0.1377 0.1082 147 GLN C OE1 4206 N NE2 . GLN C 144 ? 0.9779 0.9040 0.8909 0.3438 -0.0997 0.0675 147 GLN C NE2 4207 N N . THR C 145 ? 0.9049 0.8475 0.6695 0.2275 -0.0873 0.0950 148 THR C N 4208 C CA . THR C 145 ? 0.9158 0.8102 0.6543 0.2030 -0.0666 0.1052 148 THR C CA 4209 C C . THR C 145 ? 0.9259 0.8405 0.6239 0.1896 -0.0686 0.1134 148 THR C C 4210 O O . THR C 145 ? 0.8879 0.8530 0.5910 0.1783 -0.0770 0.0924 148 THR C O 4211 C CB . THR C 145 ? 0.8617 0.7506 0.6285 0.1751 -0.0503 0.0779 148 THR C CB 4212 O OG1 . THR C 145 ? 0.8539 0.7339 0.6558 0.1861 -0.0483 0.0648 148 THR C OG1 4213 C CG2 . THR C 145 ? 0.8730 0.7167 0.6234 0.1526 -0.0294 0.0854 148 THR C CG2 4214 N N . ASN C 146 ? 0.9833 0.8560 0.6408 0.1895 -0.0584 0.1428 149 ASN C N 4215 C CA . ASN C 146 ? 0.9979 0.8847 0.6139 0.1726 -0.0529 0.1489 149 ASN C CA 4216 C C . ASN C 146 ? 0.9827 0.8395 0.6018 0.1407 -0.0254 0.1410 149 ASN C C 4217 O O . ASN C 146 ? 1.0117 0.8149 0.6341 0.1354 -0.0078 0.1542 149 ASN C O 4218 C CB . ASN C 146 ? 1.0813 0.9506 0.6423 0.1926 -0.0589 0.1888 149 ASN C CB 4219 C CG . ASN C 146 ? 1.0989 1.0205 0.6518 0.2236 -0.0912 0.1924 149 ASN C CG 4220 O OD1 . ASN C 146 ? 1.0672 1.0525 0.6240 0.2166 -0.1050 0.1669 149 ASN C OD1 4221 N ND2 . ASN C 146 ? 1.1597 1.0552 0.7039 0.2585 -0.1037 0.2227 149 ASN C ND2 4222 N N . VAL C 147 ? 0.9412 0.8341 0.5637 0.1200 -0.0217 0.1168 150 VAL C N 4223 C CA . VAL C 147 ? 0.9207 0.7996 0.5543 0.0928 0.0012 0.1040 150 VAL C CA 4224 C C . VAL C 147 ? 0.9735 0.8405 0.5632 0.0807 0.0192 0.1228 150 VAL C C 4225 O O . VAL C 147 ? 0.9820 0.8839 0.5428 0.0784 0.0158 0.1185 150 VAL C O 4226 C CB . VAL C 147 ? 0.8575 0.7761 0.5201 0.0798 -0.0024 0.0692 150 VAL C CB 4227 C CG1 . VAL C 147 ? 0.8395 0.7498 0.5185 0.0575 0.0179 0.0558 150 VAL C CG1 4228 C CG2 . VAL C 147 ? 0.8121 0.7409 0.5117 0.0882 -0.0163 0.0542 150 VAL C CG2 4229 N N . SER C 148 ? 1.0144 0.8321 0.5992 0.0708 0.0404 0.1415 151 SER C N 4230 C CA . SER C 148 ? 1.0761 0.8763 0.6188 0.0549 0.0638 0.1627 151 SER C CA 4231 C C . SER C 148 ? 1.0441 0.8767 0.6027 0.0275 0.0824 0.1342 151 SER C C 4232 O O . SER C 148 ? 0.9813 0.8342 0.5876 0.0207 0.0793 0.1029 151 SER C O 4233 C CB . SER C 148 ? 1.1353 0.8663 0.6732 0.0492 0.0840 0.1906 151 SER C CB 4234 O OG . SER C 148 ? 1.1733 0.8699 0.6992 0.0795 0.0670 0.2172 151 SER C OG 4235 N N . GLN C 149 ? 1.0952 0.9344 0.6125 0.0137 0.1018 0.1459 152 GLN C N 4236 C CA . GLN C 149 ? 1.0751 0.9509 0.6077 -0.0098 0.1216 0.1175 152 GLN C CA 4237 C C . GLN C 149 ? 1.0794 0.9318 0.6456 -0.0360 0.1501 0.1126 152 GLN C C 4238 O O . GLN C 149 ? 1.1013 0.9046 0.6781 -0.0377 0.1547 0.1294 152 GLN C O 4239 C CB . GLN C 149 ? 1.1281 1.0310 0.6022 -0.0147 0.1323 0.1262 152 GLN C CB 4240 C CG . GLN C 149 ? 1.1025 1.0607 0.5952 -0.0280 0.1424 0.0857 152 GLN C CG 4241 C CD . GLN C 149 ? 1.0324 1.0158 0.5812 -0.0175 0.1203 0.0488 152 GLN C CD 4242 O OE1 . GLN C 149 ? 1.0157 1.0053 0.5630 0.0012 0.0929 0.0468 152 GLN C OE1 4243 N NE2 . GLN C 149 ? 0.9917 0.9911 0.5908 -0.0298 0.1327 0.0203 152 GLN C NE2 4244 N N . SER C 150 ? 1.0610 0.9517 0.6481 -0.0563 0.1693 0.0857 153 SER C N 4245 C CA . SER C 150 ? 1.0560 0.9436 0.6865 -0.0827 0.1944 0.0712 153 SER C CA 4246 C C . SER C 150 ? 1.1341 0.9982 0.7304 -0.1102 0.2323 0.0951 153 SER C C 4247 O O . SER C 150 ? 1.1729 1.0593 0.7252 -0.1164 0.2472 0.1023 153 SER C O 4248 C CB . SER C 150 ? 0.9961 0.9435 0.6761 -0.0870 0.1940 0.0273 153 SER C CB 4249 O OG . SER C 150 ? 0.9898 0.9466 0.7201 -0.1099 0.2129 0.0085 153 SER C OG 4250 N N . LYS C 151 ? 1.1616 0.9797 0.7773 -0.1285 0.2494 0.1060 154 LYS C N 4251 C CA . LYS C 151 ? 1.2404 1.0278 0.8319 -0.1614 0.2906 0.1281 154 LYS C CA 4252 C C . LYS C 151 ? 1.2170 1.0613 0.8562 -0.1937 0.3189 0.0902 154 LYS C C 4253 O O . LYS C 151 ? 1.2781 1.1249 0.8943 -0.2232 0.3567 0.1004 154 LYS C O 4254 C CB . LYS C 151 ? 1.2869 0.9963 0.8861 -0.1699 0.2991 0.1511 154 LYS C CB 4255 C CG . LYS C 151 ? 1.3975 1.0479 0.9505 -0.1974 0.3390 0.1914 154 LYS C CG 4256 N N . ASP C 152 ? 1.1317 1.0241 0.8373 -0.1870 0.3004 0.0474 155 ASP C N 4257 C CA . ASP C 152 ? 1.0985 1.0576 0.8599 -0.2084 0.3189 0.0060 155 ASP C CA 4258 C C . ASP C 152 ? 1.0599 1.0804 0.8159 -0.1898 0.3090 -0.0156 155 ASP C C 4259 O O . ASP C 152 ? 1.0199 1.0428 0.7655 -0.1578 0.2755 -0.0173 155 ASP C O 4260 C CB . ASP C 152 ? 1.0388 1.0171 0.8742 -0.2078 0.3013 -0.0273 155 ASP C CB 4261 C CG . ASP C 152 ? 1.0300 1.0714 0.9297 -0.2362 0.3248 -0.0667 155 ASP C CG 4262 O OD1 . ASP C 152 ? 1.0385 1.1305 0.9394 -0.2443 0.3449 -0.0807 155 ASP C OD1 4263 O OD2 . ASP C 152 ? 1.0181 1.0644 0.9705 -0.2501 0.3226 -0.0873 155 ASP C OD2 4264 N N . SER C 153 ? 1.0753 1.1455 0.8416 -0.2115 0.3406 -0.0350 156 SER C N 4265 C CA . SER C 153 ? 1.0453 1.1753 0.8124 -0.1957 0.3367 -0.0624 156 SER C CA 4266 C C . SER C 153 ? 0.9628 1.1405 0.8036 -0.1744 0.3108 -0.1050 156 SER C C 4267 O O . SER C 153 ? 0.9364 1.1465 0.7805 -0.1515 0.2969 -0.1261 156 SER C O 4268 C CB . SER C 153 ? 1.0980 1.2697 0.8541 -0.2257 0.3824 -0.0723 156 SER C CB 4269 O OG . SER C 153 ? 1.0962 1.2989 0.9172 -0.2557 0.4084 -0.0958 156 SER C OG 4270 N N . ASP C 154 ? 0.9279 1.1075 0.8254 -0.1815 0.3040 -0.1172 157 ASP C N 4271 C CA . ASP C 154 ? 0.8581 1.0820 0.8224 -0.1601 0.2775 -0.1526 157 ASP C CA 4272 C C . ASP C 154 ? 0.8125 0.9997 0.7672 -0.1286 0.2352 -0.1407 157 ASP C C 4273 O O . ASP C 154 ? 0.7658 0.9808 0.7601 -0.1050 0.2099 -0.1625 157 ASP C O 4274 C CB . ASP C 154 ? 0.8519 1.1102 0.8831 -0.1838 0.2895 -0.1765 157 ASP C CB 4275 C CG . ASP C 154 ? 0.8836 1.2021 0.9456 -0.2125 0.3300 -0.2014 157 ASP C CG 4276 O OD1 . ASP C 154 ? 0.8951 1.2398 1.0064 -0.2420 0.3481 -0.2186 157 ASP C OD1 4277 O OD2 . ASP C 154 ? 0.9015 1.2452 0.9410 -0.2075 0.3453 -0.2072 157 ASP C OD2 4278 N N . VAL C 155 ? 0.8287 0.9544 0.7308 -0.1276 0.2287 -0.1051 158 VAL C N 4279 C CA . VAL C 155 ? 0.7898 0.8826 0.6795 -0.1008 0.1931 -0.0930 158 VAL C CA 4280 C C . VAL C 155 ? 0.7944 0.8741 0.6326 -0.0822 0.1824 -0.0786 158 VAL C C 4281 O O . VAL C 155 ? 0.8404 0.9046 0.6287 -0.0915 0.1992 -0.0579 158 VAL C O 4282 C CB . VAL C 155 ? 0.8069 0.8453 0.6844 -0.1090 0.1902 -0.0691 158 VAL C CB 4283 C CG1 . VAL C 155 ? 0.7708 0.7863 0.6426 -0.0821 0.1557 -0.0622 158 VAL C CG1 4284 C CG2 . VAL C 155 ? 0.8066 0.8590 0.7346 -0.1333 0.2038 -0.0880 158 VAL C CG2 4285 N N . TYR C 156 ? 0.7500 0.8368 0.5992 -0.0572 0.1547 -0.0898 159 TYR C N 4286 C CA . TYR C 156 ? 0.7518 0.8309 0.5610 -0.0415 0.1422 -0.0834 159 TYR C CA 4287 C C . TYR C 156 ? 0.7310 0.7758 0.5274 -0.0258 0.1148 -0.0659 159 TYR C C 4288 O O . TYR C 156 ? 0.6956 0.7387 0.5245 -0.0158 0.0974 -0.0743 159 TYR C O 4289 C CB . TYR C 156 ? 0.7304 0.8454 0.5645 -0.0286 0.1378 -0.1153 159 TYR C CB 4290 C CG . TYR C 156 ? 0.7433 0.9026 0.6055 -0.0402 0.1640 -0.1404 159 TYR C CG 4291 C CD1 . TYR C 156 ? 0.7840 0.9605 0.6109 -0.0551 0.1906 -0.1413 159 TYR C CD1 4292 C CD2 . TYR C 156 ? 0.7181 0.9083 0.6421 -0.0358 0.1621 -0.1641 159 TYR C CD2 4293 C CE1 . TYR C 156 ? 0.7993 1.0228 0.6549 -0.0676 0.2184 -0.1673 159 TYR C CE1 4294 C CE2 . TYR C 156 ? 0.7273 0.9678 0.6855 -0.0455 0.1866 -0.1911 159 TYR C CE2 4295 C CZ . TYR C 156 ? 0.7681 1.0250 0.6933 -0.0626 0.2165 -0.1935 159 TYR C CZ 4296 O OH . TYR C 156 ? 0.7829 1.0954 0.7441 -0.0738 0.2443 -0.2230 159 TYR C OH 4297 N N . ILE C 157 ? 0.7589 0.7806 0.5073 -0.0229 0.1112 -0.0417 160 ILE C N 4298 C CA . ILE C 157 ? 0.7431 0.7407 0.4813 -0.0073 0.0868 -0.0273 160 ILE C CA 4299 C C . ILE C 157 ? 0.7545 0.7645 0.4598 0.0033 0.0743 -0.0280 160 ILE C C 4300 O O . ILE C 157 ? 0.7940 0.8122 0.4580 -0.0007 0.0839 -0.0192 160 ILE C O 4301 C CB . ILE C 157 ? 0.7706 0.7287 0.4903 -0.0097 0.0897 0.0023 160 ILE C CB 4302 C CG1 . ILE C 157 ? 0.7628 0.7094 0.5188 -0.0242 0.1024 -0.0033 160 ILE C CG1 4303 C CG2 . ILE C 157 ? 0.7558 0.6978 0.4704 0.0088 0.0654 0.0129 160 ILE C CG2 4304 C CD1 . ILE C 157 ? 0.8094 0.7124 0.5464 -0.0348 0.1179 0.0226 160 ILE C CD1 4305 N N . THR C 158 ? 0.7235 0.7369 0.4458 0.0149 0.0538 -0.0396 161 THR C N 4306 C CA . THR C 158 ? 0.7353 0.7639 0.4352 0.0218 0.0408 -0.0464 161 THR C CA 4307 C C . THR C 158 ? 0.7532 0.7716 0.4278 0.0315 0.0256 -0.0224 161 THR C C 4308 O O . THR C 158 ? 0.7505 0.7439 0.4327 0.0355 0.0236 -0.0038 161 THR C O 4309 C CB . THR C 158 ? 0.7015 0.7358 0.4337 0.0264 0.0289 -0.0710 161 THR C CB 4310 O OG1 . THR C 158 ? 0.6774 0.6936 0.4302 0.0323 0.0156 -0.0615 161 THR C OG1 4311 C CG2 . THR C 158 ? 0.6906 0.7325 0.4536 0.0240 0.0408 -0.0931 161 THR C CG2 4312 N N . ASP C 159 ? 0.7780 0.8192 0.4250 0.0364 0.0144 -0.0261 162 ASP C N 4313 C CA . ASP C 159 ? 0.7959 0.8395 0.4259 0.0499 -0.0045 -0.0081 162 ASP C CA 4314 C C . ASP C 159 ? 0.7549 0.8009 0.4236 0.0540 -0.0197 -0.0212 162 ASP C C 4315 O O . ASP C 159 ? 0.7286 0.7761 0.4254 0.0460 -0.0172 -0.0440 162 ASP C O 4316 C CB . ASP C 159 ? 0.8371 0.9161 0.4251 0.0532 -0.0136 -0.0115 162 ASP C CB 4317 C CG . ASP C 159 ? 0.8728 0.9581 0.4363 0.0720 -0.0333 0.0140 162 ASP C CG 4318 O OD1 . ASP C 159 ? 0.8714 0.9284 0.4516 0.0829 -0.0371 0.0343 162 ASP C OD1 4319 O OD2 . ASP C 159 ? 0.9139 1.0354 0.4420 0.0777 -0.0460 0.0120 162 ASP C OD2 4320 N N . LYS C 160 ? 0.7571 0.8025 0.4272 0.0673 -0.0339 -0.0059 163 LYS C N 4321 C CA . LYS C 160 ? 0.7219 0.7727 0.4280 0.0693 -0.0445 -0.0169 163 LYS C CA 4322 C C . LYS C 160 ? 0.7142 0.7988 0.4308 0.0616 -0.0541 -0.0437 163 LYS C C 4323 O O . LYS C 160 ? 0.7396 0.8535 0.4330 0.0610 -0.0606 -0.0525 163 LYS C O 4324 C CB . LYS C 160 ? 0.7279 0.7747 0.4381 0.0869 -0.0551 0.0020 163 LYS C CB 4325 C CG . LYS C 160 ? 0.7647 0.8399 0.4489 0.1038 -0.0720 0.0135 163 LYS C CG 4326 C CD . LYS C 160 ? 0.7672 0.8412 0.4686 0.1250 -0.0835 0.0269 163 LYS C CD 4327 C CE . LYS C 160 ? 0.8105 0.9138 0.4864 0.1486 -0.1037 0.0422 163 LYS C CE 4328 N NZ . LYS C 160 ? 0.8220 0.9262 0.5227 0.1738 -0.1152 0.0524 163 LYS C NZ 4329 N N . CYS C 161 ? 0.6880 0.7671 0.4380 0.0539 -0.0536 -0.0569 164 CYS C N 4330 C CA . CYS C 161 ? 0.6866 0.7841 0.4530 0.0406 -0.0568 -0.0836 164 CYS C CA 4331 C C . CYS C 161 ? 0.6639 0.7704 0.4594 0.0379 -0.0622 -0.0864 164 CYS C C 4332 O O . CYS C 161 ? 0.6486 0.7339 0.4563 0.0417 -0.0574 -0.0734 164 CYS C O 4333 C CB . CYS C 161 ? 0.6828 0.7523 0.4597 0.0299 -0.0434 -0.0963 164 CYS C CB 4334 S SG . CYS C 161 ? 0.7328 0.8151 0.5134 0.0149 -0.0415 -0.1321 164 CYS C SG 4335 N N . VAL C 162 ? 0.6660 0.8084 0.4735 0.0292 -0.0707 -0.1066 165 VAL C N 4336 C CA . VAL C 162 ? 0.6494 0.8112 0.4877 0.0228 -0.0733 -0.1132 165 VAL C CA 4337 C C . VAL C 162 ? 0.6475 0.7923 0.5067 -0.0019 -0.0619 -0.1325 165 VAL C C 4338 O O . VAL C 162 ? 0.6662 0.8191 0.5263 -0.0158 -0.0618 -0.1559 165 VAL C O 4339 C CB . VAL C 162 ? 0.6615 0.8847 0.5061 0.0291 -0.0914 -0.1243 165 VAL C CB 4340 C CG1 . VAL C 162 ? 0.6493 0.9017 0.5330 0.0205 -0.0912 -0.1353 165 VAL C CG1 4341 C CG2 . VAL C 162 ? 0.6748 0.9072 0.4942 0.0576 -0.1038 -0.1001 165 VAL C CG2 4342 N N . LEU C 163 ? 0.6334 0.7525 0.5071 -0.0079 -0.0514 -0.1229 166 LEU C N 4343 C CA . LEU C 163 ? 0.6448 0.7404 0.5348 -0.0314 -0.0390 -0.1347 166 LEU C CA 4344 C C . LEU C 163 ? 0.6426 0.7634 0.5582 -0.0465 -0.0339 -0.1399 166 LEU C C 4345 O O . LEU C 163 ? 0.6257 0.7602 0.5450 -0.0361 -0.0341 -0.1266 166 LEU C O 4346 C CB . LEU C 163 ? 0.6463 0.6840 0.5257 -0.0289 -0.0284 -0.1188 166 LEU C CB 4347 C CG . LEU C 163 ? 0.6351 0.6537 0.5077 -0.0182 -0.0248 -0.0943 166 LEU C CG 4348 C CD1 . LEU C 163 ? 0.6467 0.6555 0.5288 -0.0346 -0.0138 -0.0897 166 LEU C CD1 4349 C CD2 . LEU C 163 ? 0.6371 0.6178 0.4962 -0.0067 -0.0231 -0.0832 166 LEU C CD2 4350 N N . ASP C 164 ? 0.6640 0.7915 0.5992 -0.0728 -0.0271 -0.1626 167 ASP C N 4351 C CA . ASP C 164 ? 0.6704 0.8245 0.6342 -0.0947 -0.0174 -0.1719 167 ASP C CA 4352 C C . ASP C 164 ? 0.6963 0.7907 0.6574 -0.1156 0.0041 -0.1605 167 ASP C C 4353 O O . ASP C 164 ? 0.7272 0.7791 0.6872 -0.1305 0.0119 -0.1691 167 ASP C O 4354 C CB . ASP C 164 ? 0.6842 0.8926 0.6757 -0.1144 -0.0237 -0.2079 167 ASP C CB 4355 C CG . ASP C 164 ? 0.6940 0.9485 0.7238 -0.1382 -0.0139 -0.2225 167 ASP C CG 4356 O OD1 . ASP C 164 ? 0.6904 0.9335 0.7223 -0.1401 -0.0001 -0.2042 167 ASP C OD1 4357 O OD2 . ASP C 164 ? 0.7137 1.0227 0.7730 -0.1565 -0.0195 -0.2556 167 ASP C OD2 4358 N N . MET C 165 ? 0.6909 0.7799 0.6481 -0.1148 0.0140 -0.1404 168 MET C N 4359 C CA . MET C 165 ? 0.7272 0.7688 0.6782 -0.1370 0.0356 -0.1266 168 MET C CA 4360 C C . MET C 165 ? 0.7454 0.8260 0.7296 -0.1709 0.0505 -0.1472 168 MET C C 4361 O O . MET C 165 ? 0.7312 0.8585 0.7288 -0.1730 0.0558 -0.1477 168 MET C O 4362 C CB . MET C 165 ? 0.7203 0.7426 0.6450 -0.1209 0.0393 -0.0967 168 MET C CB 4363 C CG . MET C 165 ? 0.7136 0.6961 0.6104 -0.0931 0.0272 -0.0786 168 MET C CG 4364 S SD . MET C 165 ? 0.7226 0.6895 0.5893 -0.0761 0.0288 -0.0498 168 MET C SD 4365 C CE . MET C 165 ? 0.7843 0.6938 0.6301 -0.0976 0.0480 -0.0280 168 MET C CE 4366 N N . ARG C 166 ? 0.7787 0.8420 0.7799 -0.1985 0.0585 -0.1680 169 ARG C N 4367 C CA . ARG C 166 ? 0.7940 0.9075 0.8369 -0.2341 0.0691 -0.1997 169 ARG C CA 4368 C C . ARG C 166 ? 0.8152 0.9370 0.8692 -0.2619 0.0955 -0.1909 169 ARG C C 4369 O O . ARG C 166 ? 0.7954 0.9953 0.8833 -0.2702 0.0966 -0.2103 169 ARG C O 4370 C CB . ARG C 166 ? 0.8377 0.9178 0.8950 -0.2615 0.0754 -0.2259 169 ARG C CB 4371 C CG . ARG C 166 ? 0.8220 0.9208 0.8766 -0.2418 0.0511 -0.2485 169 ARG C CG 4372 C CD . ARG C 166 ? 0.8777 0.9429 0.9489 -0.2719 0.0608 -0.2806 169 ARG C CD 4373 N NE . ARG C 166 ? 0.8727 0.9434 0.9312 -0.2518 0.0414 -0.2997 169 ARG C NE 4374 C CZ . ARG C 166 ? 0.9140 0.9642 0.9848 -0.2716 0.0457 -0.3350 169 ARG C CZ 4375 N NH1 . ARG C 166 ? 0.9688 0.9849 1.0676 -0.3133 0.0687 -0.3548 169 ARG C NH1 4376 N NH2 . ARG C 166 ? 0.9065 0.9690 0.9608 -0.2514 0.0292 -0.3521 169 ARG C NH2 4377 N N . SER C 167 ? 0.8599 0.9045 0.8850 -0.2748 0.1168 -0.1614 170 SER C N 4378 C CA . SER C 167 ? 0.8952 0.9382 0.9213 -0.3062 0.1472 -0.1491 170 SER C CA 4379 C C . SER C 167 ? 0.8583 0.9503 0.8734 -0.2854 0.1457 -0.1353 170 SER C C 4380 O O . SER C 167 ? 0.8781 0.9983 0.9017 -0.3097 0.1698 -0.1345 170 SER C O 4381 C CB . SER C 167 ? 0.9655 0.9051 0.9535 -0.3211 0.1684 -0.1148 170 SER C CB 4382 O OG . SER C 167 ? 0.9552 0.8527 0.8946 -0.2840 0.1564 -0.0776 170 SER C OG 4383 N N . MET C 168 ? 0.8090 0.9105 0.8066 -0.2421 0.1195 -0.1271 171 MET C N 4384 C CA . MET C 168 ? 0.7764 0.9171 0.7643 -0.2179 0.1155 -0.1179 171 MET C CA 4385 C C . MET C 168 ? 0.7252 0.9510 0.7538 -0.1996 0.0974 -0.1468 171 MET C C 4386 O O . MET C 168 ? 0.7014 0.9679 0.7343 -0.1810 0.0962 -0.1469 171 MET C O 4387 C CB . MET C 168 ? 0.7664 0.8570 0.7095 -0.1831 0.0998 -0.0898 171 MET C CB 4388 C CG . MET C 168 ? 0.8228 0.8385 0.7214 -0.1917 0.1139 -0.0563 171 MET C CG 4389 S SD . MET C 168 ? 0.8570 0.8887 0.7267 -0.2001 0.1361 -0.0374 171 MET C SD 4390 C CE . MET C 168 ? 0.7943 0.8524 0.6508 -0.1549 0.1109 -0.0373 171 MET C CE 4391 N N . ASP C 169 ? 0.7143 0.9662 0.7717 -0.2036 0.0830 -0.1718 172 ASP C N 4392 C CA . ASP C 169 ? 0.6730 1.0004 0.7621 -0.1793 0.0584 -0.1950 172 ASP C CA 4393 C C . ASP C 169 ? 0.6380 0.9576 0.7019 -0.1341 0.0396 -0.1758 172 ASP C C 4394 O O . ASP C 169 ? 0.6159 0.9882 0.6999 -0.1127 0.0326 -0.1826 172 ASP C O 4395 C CB . ASP C 169 ? 0.6716 1.0865 0.8130 -0.1962 0.0685 -0.2228 172 ASP C CB 4396 C CG . ASP C 169 ? 0.6527 1.1476 0.8353 -0.1834 0.0424 -0.2543 172 ASP C CG 4397 O OD1 . ASP C 169 ? 0.6678 1.2154 0.8938 -0.2155 0.0493 -0.2859 172 ASP C OD1 4398 O OD2 . ASP C 169 ? 0.6299 1.1360 0.8009 -0.1421 0.0151 -0.2473 172 ASP C OD2 4399 N N . PHE C 170 ? 0.6373 0.8896 0.6606 -0.1205 0.0329 -0.1534 173 PHE C N 4400 C CA . PHE C 170 ? 0.6127 0.8473 0.6109 -0.0844 0.0192 -0.1350 173 PHE C CA 4401 C C . PHE C 170 ? 0.6027 0.8183 0.5853 -0.0654 -0.0015 -0.1326 173 PHE C C 4402 O O . PHE C 170 ? 0.6172 0.7918 0.5852 -0.0766 -0.0001 -0.1310 173 PHE C O 4403 C CB . PHE C 170 ? 0.6245 0.8042 0.5875 -0.0852 0.0325 -0.1100 173 PHE C CB 4404 C CG . PHE C 170 ? 0.6024 0.7637 0.5433 -0.0536 0.0201 -0.0958 173 PHE C CG 4405 C CD1 . PHE C 170 ? 0.5840 0.7771 0.5347 -0.0358 0.0196 -0.0998 173 PHE C CD1 4406 C CD2 . PHE C 170 ? 0.5993 0.7124 0.5139 -0.0427 0.0108 -0.0819 173 PHE C CD2 4407 C CE1 . PHE C 170 ? 0.5700 0.7412 0.5034 -0.0106 0.0105 -0.0898 173 PHE C CE1 4408 C CE2 . PHE C 170 ? 0.5777 0.6765 0.4766 -0.0187 0.0019 -0.0718 173 PHE C CE2 4409 C CZ . PHE C 170 ? 0.5660 0.6908 0.4735 -0.0042 0.0020 -0.0756 173 PHE C CZ 4410 N N . LYS C 171 ? 0.5845 0.8288 0.5700 -0.0360 -0.0189 -0.1322 174 LYS C N 4411 C CA . LYS C 171 ? 0.5818 0.8134 0.5476 -0.0170 -0.0368 -0.1271 174 LYS C CA 4412 C C . LYS C 171 ? 0.5712 0.7666 0.5119 0.0080 -0.0397 -0.1047 174 LYS C C 4413 O O . LYS C 171 ? 0.5669 0.7715 0.5153 0.0212 -0.0371 -0.1001 174 LYS C O 4414 C CB . LYS C 171 ? 0.5815 0.8759 0.5669 -0.0040 -0.0560 -0.1426 174 LYS C CB 4415 C CG . LYS C 171 ? 0.6023 0.9222 0.5969 -0.0249 -0.0616 -0.1663 174 LYS C CG 4416 C CD . LYS C 171 ? 0.6268 0.9674 0.6549 -0.0608 -0.0452 -0.1883 174 LYS C CD 4417 C CE . LYS C 171 ? 0.6361 1.0635 0.7084 -0.0608 -0.0540 -0.2122 174 LYS C CE 4418 N NZ . LYS C 171 ? 0.6558 1.1050 0.7637 -0.1025 -0.0338 -0.2361 174 LYS C NZ 4419 N N . SER C 172 ? 0.5722 0.7285 0.4865 0.0126 -0.0432 -0.0945 175 SER C N 4420 C CA . SER C 172 ? 0.5663 0.6907 0.4604 0.0317 -0.0446 -0.0764 175 SER C CA 4421 C C . SER C 172 ? 0.5724 0.6813 0.4444 0.0401 -0.0523 -0.0706 175 SER C C 4422 O O . SER C 172 ? 0.5806 0.6883 0.4474 0.0285 -0.0529 -0.0804 175 SER C O 4423 C CB . SER C 172 ? 0.5645 0.6511 0.4487 0.0238 -0.0322 -0.0675 175 SER C CB 4424 O OG . SER C 172 ? 0.5734 0.6314 0.4476 0.0105 -0.0282 -0.0673 175 SER C OG 4425 N N . ASN C 173 ? 0.5751 0.6712 0.4344 0.0589 -0.0558 -0.0562 176 ASN C N 4426 C CA . ASN C 173 ? 0.5878 0.6665 0.4222 0.0651 -0.0582 -0.0470 176 ASN C CA 4427 C C . ASN C 173 ? 0.5815 0.6213 0.4077 0.0598 -0.0472 -0.0406 176 ASN C C 4428 O O . ASN C 173 ? 0.5735 0.5991 0.4085 0.0592 -0.0415 -0.0380 176 ASN C O 4429 C CB . ASN C 173 ? 0.6077 0.6895 0.4312 0.0873 -0.0662 -0.0315 176 ASN C CB 4430 C CG . ASN C 173 ? 0.6170 0.7458 0.4483 0.0987 -0.0821 -0.0369 176 ASN C CG 4431 O OD1 . ASN C 173 ? 0.6303 0.7891 0.4581 0.0898 -0.0894 -0.0504 176 ASN C OD1 4432 N ND2 . ASN C 173 ? 0.6227 0.7609 0.4672 0.1198 -0.0885 -0.0293 176 ASN C ND2 4433 N N . SER C 174 ? 0.5886 0.6180 0.3993 0.0560 -0.0443 -0.0409 177 SER C N 4434 C CA . SER C 174 ? 0.5820 0.5848 0.3907 0.0526 -0.0349 -0.0376 177 SER C CA 4435 C C . SER C 174 ? 0.5972 0.5970 0.3876 0.0524 -0.0299 -0.0356 177 SER C C 4436 O O . SER C 174 ? 0.6094 0.6263 0.3869 0.0506 -0.0329 -0.0428 177 SER C O 4437 C CB . SER C 174 ? 0.5713 0.5646 0.3927 0.0433 -0.0319 -0.0469 177 SER C CB 4438 O OG . SER C 174 ? 0.5794 0.5785 0.4008 0.0359 -0.0324 -0.0602 177 SER C OG 4439 N N . ALA C 175 ? 0.5988 0.5809 0.3888 0.0519 -0.0208 -0.0285 178 ALA C N 4440 C CA . ALA C 175 ? 0.6159 0.5966 0.3925 0.0475 -0.0103 -0.0279 178 ALA C CA 4441 C C . ALA C 175 ? 0.6031 0.5775 0.4004 0.0417 -0.0020 -0.0363 178 ALA C C 4442 O O . ALA C 175 ? 0.5913 0.5570 0.4044 0.0421 -0.0036 -0.0349 178 ALA C O 4443 C CB . ALA C 175 ? 0.6436 0.6121 0.3985 0.0513 -0.0053 -0.0082 178 ALA C CB 4444 N N . VAL C 176 ? 0.6069 0.5916 0.4056 0.0374 0.0059 -0.0479 179 VAL C N 4445 C CA . VAL C 176 ? 0.5952 0.5841 0.4198 0.0358 0.0112 -0.0593 179 VAL C CA 4446 C C . VAL C 176 ? 0.6111 0.6078 0.4357 0.0267 0.0282 -0.0597 179 VAL C C 4447 O O . VAL C 176 ? 0.6360 0.6392 0.4378 0.0217 0.0388 -0.0579 179 VAL C O 4448 C CB . VAL C 176 ? 0.5922 0.5876 0.4301 0.0408 0.0081 -0.0769 179 VAL C CB 4449 C CG1 . VAL C 176 ? 0.5847 0.5884 0.4529 0.0458 0.0097 -0.0872 179 VAL C CG1 4450 C CG2 . VAL C 176 ? 0.5878 0.5701 0.4254 0.0444 -0.0043 -0.0751 179 VAL C CG2 4451 N N . ALA C 177 ? 0.6026 0.6018 0.4514 0.0225 0.0318 -0.0631 180 ALA C N 4452 C CA . ALA C 177 ? 0.6182 0.6285 0.4760 0.0088 0.0507 -0.0673 180 ALA C CA 4453 C C . ALA C 177 ? 0.6026 0.6420 0.5020 0.0095 0.0506 -0.0883 180 ALA C C 4454 O O . ALA C 177 ? 0.5835 0.6256 0.5012 0.0184 0.0348 -0.0922 180 ALA C O 4455 C CB . ALA C 177 ? 0.6351 0.6208 0.4841 -0.0014 0.0583 -0.0518 180 ALA C CB 4456 N N . TRP C 178 ? 0.6155 0.6815 0.5288 0.0010 0.0680 -0.1019 181 TRP C N 4457 C CA . TRP C 178 ? 0.6056 0.7100 0.5656 0.0024 0.0688 -0.1247 181 TRP C CA 4458 C C . TRP C 178 ? 0.6294 0.7614 0.6045 -0.0188 0.0965 -0.1360 181 TRP C C 4459 O O . TRP C 178 ? 0.6572 0.7781 0.6003 -0.0317 0.1161 -0.1258 181 TRP C O 4460 C CB . TRP C 178 ? 0.5915 0.7111 0.5694 0.0250 0.0559 -0.1392 181 TRP C CB 4461 C CG . TRP C 178 ? 0.6032 0.7349 0.5740 0.0257 0.0711 -0.1517 181 TRP C CG 4462 C CD1 . TRP C 178 ? 0.6111 0.7836 0.6145 0.0267 0.0855 -0.1766 181 TRP C CD1 4463 C CD2 . TRP C 178 ? 0.6160 0.7254 0.5460 0.0254 0.0736 -0.1444 181 TRP C CD2 4464 N NE1 . TRP C 178 ? 0.6286 0.8027 0.6111 0.0266 0.0985 -0.1859 181 TRP C NE1 4465 C CE2 . TRP C 178 ? 0.6332 0.7696 0.5693 0.0252 0.0904 -0.1668 181 TRP C CE2 4466 C CE3 . TRP C 178 ? 0.6162 0.6925 0.5081 0.0256 0.0628 -0.1247 181 TRP C CE3 4467 C CZ2 . TRP C 178 ? 0.6528 0.7827 0.5535 0.0238 0.0959 -0.1706 181 TRP C CZ2 4468 C CZ3 . TRP C 178 ? 0.6323 0.7058 0.4930 0.0248 0.0665 -0.1278 181 TRP C CZ3 4469 C CH2 . TRP C 178 ? 0.6518 0.7513 0.5149 0.0232 0.0826 -0.1509 181 TRP C CH2 4470 N N . SER C 179 ? 0.6251 0.7968 0.6481 -0.0235 0.0982 -0.1569 182 SER C N 4471 C CA . SER C 179 ? 0.6513 0.8579 0.6987 -0.0475 0.1269 -0.1724 182 SER C CA 4472 C C . SER C 179 ? 0.6407 0.9117 0.7491 -0.0373 0.1228 -0.2053 182 SER C C 4473 O O . SER C 179 ? 0.6209 0.9075 0.7565 -0.0176 0.0962 -0.2131 182 SER C O 4474 C CB . SER C 179 ? 0.6676 0.8556 0.7156 -0.0758 0.1403 -0.1644 182 SER C CB 4475 O OG . SER C 179 ? 0.6920 0.9140 0.7671 -0.1042 0.1714 -0.1802 182 SER C OG 4476 N N . ASN C 180 ? 0.6641 0.9752 0.7926 -0.0496 0.1496 -0.2240 183 ASN C N 4477 C CA . ASN C 180 ? 0.6588 1.0408 0.8525 -0.0384 0.1492 -0.2593 183 ASN C CA 4478 C C . ASN C 180 ? 0.6548 1.0822 0.9015 -0.0553 0.1483 -0.2781 183 ASN C C 4479 O O . ASN C 180 ? 0.6440 1.1371 0.9510 -0.0407 0.1386 -0.3076 183 ASN C O 4480 C CB . ASN C 180 ? 0.6835 1.1004 0.8834 -0.0490 0.1826 -0.2775 183 ASN C CB 4481 C CG . ASN C 180 ? 0.6987 1.0777 0.8452 -0.0358 0.1847 -0.2652 183 ASN C CG 4482 O OD1 . ASN C 180 ? 0.6875 1.0220 0.8057 -0.0138 0.1584 -0.2486 183 ASN C OD1 4483 N ND2 . ASN C 180 ? 0.7277 1.1285 0.8603 -0.0517 0.2174 -0.2758 183 ASN C ND2 4484 N N . LYS C 181 ? 0.6706 1.0640 0.8969 -0.0847 0.1576 -0.2630 184 LYS C N 4485 C CA . LYS C 181 ? 0.6747 1.1059 0.9488 -0.1088 0.1607 -0.2841 184 LYS C CA 4486 C C . LYS C 181 ? 0.6480 1.1029 0.9486 -0.0827 0.1196 -0.2945 184 LYS C C 4487 O O . LYS C 181 ? 0.6404 1.0457 0.9008 -0.0646 0.0956 -0.2716 184 LYS C O 4488 C CB . LYS C 181 ? 0.7063 1.0797 0.9472 -0.1461 0.1829 -0.2641 184 LYS C CB 4489 C CG . LYS C 181 ? 0.7527 1.1043 0.9653 -0.1765 0.2261 -0.2507 184 LYS C CG 4490 C CD . LYS C 181 ? 0.7976 1.0782 0.9738 -0.2072 0.2448 -0.2247 184 LYS C CD 4491 N N . ASP C 183 ? 0.7099 1.0978 1.0269 -0.1936 0.1496 -0.3131 186 ASP C N 4492 C CA . ASP C 183 ? 0.7361 1.0551 1.0247 -0.2120 0.1547 -0.3015 186 ASP C CA 4493 C C . ASP C 183 ? 0.7312 0.9729 0.9514 -0.1843 0.1420 -0.2600 186 ASP C C 4494 O O . ASP C 183 ? 0.7505 0.9353 0.9459 -0.1897 0.1413 -0.2495 186 ASP C O 4495 C CB . ASP C 183 ? 0.7897 1.0756 1.0872 -0.2611 0.1998 -0.3027 186 ASP C CB 4496 C CG . ASP C 183 ? 0.8165 1.0586 1.0708 -0.2654 0.2295 -0.2676 186 ASP C CG 4497 O OD1 . ASP C 183 ? 0.8262 1.1161 1.1077 -0.2827 0.2539 -0.2804 186 ASP C OD1 4498 O OD2 . ASP C 183 ? 0.8297 0.9957 1.0232 -0.2510 0.2282 -0.2289 186 ASP C OD2 4499 N N . PHE C 184 ? 0.7071 0.9508 0.9018 -0.1550 0.1328 -0.2406 187 PHE C N 4500 C CA . PHE C 184 ? 0.6982 0.8817 0.8343 -0.1295 0.1204 -0.2054 187 PHE C CA 4501 C C . PHE C 184 ? 0.6744 0.8539 0.8011 -0.1056 0.0867 -0.2059 187 PHE C C 4502 O O . PHE C 184 ? 0.6521 0.8845 0.8055 -0.0895 0.0629 -0.2248 187 PHE C O 4503 C CB . PHE C 184 ? 0.6817 0.8778 0.8014 -0.1079 0.1194 -0.1938 187 PHE C CB 4504 C CG . PHE C 184 ? 0.6698 0.8129 0.7342 -0.0852 0.1077 -0.1622 187 PHE C CG 4505 C CD1 . PHE C 184 ? 0.6307 0.7819 0.6881 -0.0538 0.0792 -0.1597 187 PHE C CD1 4506 C CD2 . PHE C 184 ? 0.6947 0.7813 0.7153 -0.0953 0.1252 -0.1346 187 PHE C CD2 4507 C CE1 . PHE C 184 ? 0.6209 0.7296 0.6337 -0.0372 0.0702 -0.1349 187 PHE C CE1 4508 C CE2 . PHE C 184 ? 0.6827 0.7322 0.6582 -0.0740 0.1122 -0.1096 187 PHE C CE2 4509 C CZ . PHE C 184 ? 0.6435 0.7068 0.6180 -0.0472 0.0856 -0.1122 187 PHE C CZ 4510 N N . ALA C 185 ? 0.6855 0.8038 0.7729 -0.1023 0.0853 -0.1842 188 ALA C N 4511 C CA . ALA C 185 ? 0.6686 0.7790 0.7405 -0.0825 0.0589 -0.1830 188 ALA C CA 4512 C C . ALA C 185 ? 0.6726 0.7249 0.6967 -0.0670 0.0574 -0.1511 188 ALA C C 4513 O O . ALA C 185 ? 0.7006 0.7071 0.7052 -0.0772 0.0769 -0.1334 188 ALA C O 4514 C CB . ALA C 185 ? 0.6843 0.7978 0.7777 -0.1019 0.0596 -0.2078 188 ALA C CB 4515 N N . CYS C 186 ? 0.6495 0.7057 0.6552 -0.0425 0.0342 -0.1435 189 CYS C N 4516 C CA . CYS C 186 ? 0.6494 0.6643 0.6170 -0.0274 0.0303 -0.1181 189 CYS C CA 4517 C C . CYS C 186 ? 0.6732 0.6419 0.6280 -0.0346 0.0407 -0.1113 189 CYS C C 4518 O O . CYS C 186 ? 0.6879 0.6209 0.6171 -0.0274 0.0462 -0.0888 189 CYS C O 4519 C CB . CYS C 186 ? 0.6268 0.6564 0.5823 -0.0061 0.0069 -0.1152 189 CYS C CB 4520 S SG . CYS C 186 ? 0.6261 0.6867 0.5876 0.0114 -0.0056 -0.1131 189 CYS C SG 4521 N N . ALA C 187 ? 0.6846 0.6558 0.6589 -0.0473 0.0424 -0.1329 190 ALA C N 4522 C CA . ALA C 187 ? 0.7149 0.6391 0.6831 -0.0522 0.0526 -0.1319 190 ALA C CA 4523 C C . ALA C 187 ? 0.7558 0.6292 0.7171 -0.0645 0.0768 -0.1136 190 ALA C C 4524 O O . ALA C 187 ? 0.7878 0.6113 0.7360 -0.0585 0.0834 -0.1013 190 ALA C O 4525 C CB . ALA C 187 ? 0.7272 0.6680 0.7207 -0.0665 0.0509 -0.1661 190 ALA C CB 4526 N N . ASN C 188 ? 0.7598 0.6460 0.7292 -0.0803 0.0908 -0.1110 191 ASN C N 4527 C CA . ASN C 188 ? 0.8053 0.6444 0.7584 -0.0930 0.1158 -0.0877 191 ASN C CA 4528 C C . ASN C 188 ? 0.7953 0.6505 0.7247 -0.0871 0.1193 -0.0669 191 ASN C C 4529 O O . ASN C 188 ? 0.8352 0.6695 0.7523 -0.1034 0.1427 -0.0518 191 ASN C O 4530 C CB . ASN C 188 ? 0.8453 0.6738 0.8299 -0.1286 0.1411 -0.1069 191 ASN C CB 4531 C CG . ASN C 188 ? 0.8769 0.6675 0.8775 -0.1363 0.1442 -0.1243 191 ASN C CG 4532 O OD1 . ASN C 188 ? 0.8963 0.6389 0.8754 -0.1171 0.1398 -0.1082 191 ASN C OD1 4533 N ND2 . ASN C 188 ? 0.8883 0.7044 0.9303 -0.1643 0.1520 -0.1613 191 ASN C ND2 4534 N N . ALA C 189 ? 0.7468 0.6372 0.6682 -0.0653 0.0976 -0.0670 192 ALA C N 4535 C CA . ALA C 189 ? 0.7359 0.6452 0.6372 -0.0582 0.0989 -0.0547 192 ALA C CA 4536 C C . ALA C 189 ? 0.7666 0.6363 0.6227 -0.0477 0.1026 -0.0222 192 ALA C C 4537 O O . ALA C 189 ? 0.7893 0.6616 0.6223 -0.0531 0.1157 -0.0096 192 ALA C O 4538 C CB . ALA C 189 ? 0.6876 0.6366 0.5958 -0.0386 0.0754 -0.0658 192 ALA C CB 4539 N N . PHE C 190 ? 0.7687 0.6074 0.6122 -0.0315 0.0905 -0.0105 193 PHE C N 4540 C CA . PHE C 190 ? 0.7990 0.6062 0.6034 -0.0155 0.0879 0.0195 193 PHE C CA 4541 C C . PHE C 190 ? 0.8634 0.6105 0.6580 -0.0213 0.1046 0.0389 193 PHE C C 4542 O O . PHE C 190 ? 0.8901 0.6041 0.6648 -0.0008 0.0967 0.0599 193 PHE C O 4543 C CB . PHE C 190 ? 0.7643 0.5837 0.5657 0.0094 0.0629 0.0188 193 PHE C CB 4544 C CG . PHE C 190 ? 0.7143 0.5798 0.5201 0.0145 0.0491 0.0050 193 PHE C CG 4545 C CD1 . PHE C 190 ? 0.6737 0.5656 0.5084 0.0110 0.0417 -0.0179 193 PHE C CD1 4546 C CD2 . PHE C 190 ? 0.7152 0.5958 0.4949 0.0229 0.0434 0.0147 193 PHE C CD2 4547 C CE1 . PHE C 190 ? 0.6382 0.5613 0.4761 0.0173 0.0302 -0.0273 193 PHE C CE1 4548 C CE2 . PHE C 190 ? 0.6792 0.5937 0.4657 0.0260 0.0331 -0.0005 193 PHE C CE2 4549 C CZ . PHE C 190 ? 0.6416 0.5726 0.4577 0.0238 0.0273 -0.0197 193 PHE C CZ 4550 N N . ASN C 191 ? 0.8928 0.6260 0.7044 -0.0494 0.1285 0.0310 194 ASN C N 4551 C CA . ASN C 191 ? 0.9652 0.6321 0.7722 -0.0614 0.1498 0.0469 194 ASN C CA 4552 C C . ASN C 191 ? 1.0358 0.6562 0.7908 -0.0534 0.1605 0.0915 194 ASN C C 4553 O O . ASN C 191 ? 1.1054 0.6578 0.8495 -0.0535 0.1737 0.1132 194 ASN C O 4554 C CB . ASN C 191 ? 0.9811 0.6505 0.8239 -0.0996 0.1751 0.0231 194 ASN C CB 4555 C CG . ASN C 191 ? 0.9935 0.6926 0.8278 -0.1223 0.1958 0.0265 194 ASN C CG 4556 O OD1 . ASN C 191 ? 1.0562 0.7182 0.8800 -0.1478 0.2264 0.0418 194 ASN C OD1 4557 N ND2 . ASN C 191 ? 0.9398 0.7042 0.7796 -0.1139 0.1818 0.0114 194 ASN C ND2 4558 N N . ASN C 192 ? 1.0251 0.6810 0.7470 -0.0456 0.1546 0.1044 195 ASN C N 4559 C CA A ASN C 192 ? 1.0922 0.7174 0.7560 -0.0351 0.1601 0.1468 195 ASN C CA 4560 C CA B ASN C 192 ? 1.0929 0.7165 0.7569 -0.0351 0.1603 0.1471 195 ASN C CA 4561 C C . ASN C 192 ? 1.0921 0.7116 0.7337 0.0048 0.1302 0.1652 195 ASN C C 4562 O O . ASN C 192 ? 1.1592 0.7450 0.7542 0.0215 0.1289 0.2036 195 ASN C O 4563 C CB A ASN C 192 ? 1.0871 0.7603 0.7244 -0.0474 0.1692 0.1464 195 ASN C CB 4564 C CB B ASN C 192 ? 1.0934 0.7610 0.7291 -0.0488 0.1715 0.1488 195 ASN C CB 4565 C CG A ASN C 192 ? 1.0830 0.7759 0.7503 -0.0854 0.1987 0.1234 195 ASN C CG 4566 C CG B ASN C 192 ? 1.1848 0.8121 0.7573 -0.0517 0.1901 0.1935 195 ASN C CG 4567 O OD1 A ASN C 192 ? 1.0334 0.7871 0.7170 -0.0925 0.1982 0.0973 195 ASN C OD1 4568 O OD1 B ASN C 192 ? 1.2535 0.8104 0.8090 -0.0506 0.2017 0.2243 195 ASN C OD1 4569 N ND2 A ASN C 192 ? 1.1358 0.7782 0.8148 -0.1099 0.2251 0.1308 195 ASN C ND2 4570 N ND2 B ASN C 192 ? 1.1893 0.8590 0.7244 -0.0548 0.1938 0.1975 195 ASN C ND2 4571 N N . SER C 193 ? 1.0212 0.6774 0.6960 0.0199 0.1062 0.1381 196 SER C N 4572 C CA . SER C 193 ? 1.0137 0.6763 0.6810 0.0550 0.0787 0.1470 196 SER C CA 4573 C C . SER C 193 ? 1.0314 0.6494 0.7266 0.0682 0.0767 0.1446 196 SER C C 4574 O O . SER C 193 ? 1.0350 0.6270 0.7602 0.0479 0.0934 0.1270 196 SER C O 4575 C CB . SER C 193 ? 0.9343 0.6636 0.6205 0.0609 0.0573 0.1186 196 SER C CB 4576 O OG . SER C 193 ? 0.9205 0.6887 0.5894 0.0474 0.0613 0.1126 196 SER C OG 4577 N N . ILE C 194 ? 1.0450 0.6590 0.7335 0.1024 0.0564 0.1583 197 ILE C N 4578 C CA . ILE C 194 ? 1.0561 0.6373 0.7763 0.1198 0.0530 0.1497 197 ILE C CA 4579 C C . ILE C 194 ? 0.9779 0.6163 0.7347 0.1257 0.0359 0.1138 197 ILE C C 4580 O O . ILE C 194 ? 0.9431 0.6322 0.6946 0.1409 0.0158 0.1122 197 ILE C O 4581 C CB . ILE C 194 ? 1.1321 0.6687 0.8297 0.1570 0.0438 0.1864 197 ILE C CB 4582 C CG1 . ILE C 194 ? 1.2272 0.6755 0.9046 0.1475 0.0696 0.2162 197 ILE C CG1 4583 C CG2 . ILE C 194 ? 1.1191 0.6575 0.8554 0.1861 0.0297 0.1689 197 ILE C CG2 4584 C CD1 . ILE C 194 ? 1.2823 0.7191 0.9050 0.1323 0.0823 0.2512 197 ILE C CD1 4585 N N . ILE C 195 ? 0.9559 0.5866 0.7477 0.1108 0.0455 0.0842 198 ILE C N 4586 C CA . ILE C 195 ? 0.8891 0.5701 0.7098 0.1111 0.0340 0.0512 198 ILE C CA 4587 C C . ILE C 195 ? 0.9039 0.5732 0.7485 0.1360 0.0284 0.0408 198 ILE C C 4588 O O . ILE C 195 ? 0.9624 0.5734 0.8133 0.1450 0.0390 0.0478 198 ILE C O 4589 C CB . ILE C 195 ? 0.8583 0.5502 0.7001 0.0802 0.0456 0.0215 198 ILE C CB 4590 C CG1 . ILE C 195 ? 0.8355 0.5509 0.6635 0.0580 0.0504 0.0251 198 ILE C CG1 4591 C CD1 . ILE C 195 ? 0.7856 0.5585 0.6100 0.0608 0.0343 0.0174 198 ILE C CD1 4592 N N . PRO C 196 ? 0.8564 0.5795 0.7161 0.1467 0.0140 0.0230 199 PRO C N 4593 C CA . PRO C 196 ? 0.8637 0.5888 0.7522 0.1663 0.0123 0.0039 199 PRO C CA 4594 C C . PRO C 196 ? 0.8745 0.5742 0.7841 0.1491 0.0285 -0.0254 199 PRO C C 4595 O O . PRO C 196 ? 0.8501 0.5586 0.7569 0.1202 0.0353 -0.0384 199 PRO C O 4596 C CB . PRO C 196 ? 0.8041 0.5997 0.7007 0.1674 -0.0007 -0.0113 199 PRO C CB 4597 C CG . PRO C 196 ? 0.7846 0.6042 0.6556 0.1627 -0.0111 0.0089 199 PRO C CG 4598 C CD . PRO C 196 ? 0.8033 0.5859 0.6536 0.1420 0.0005 0.0213 199 PRO C CD 4599 N N . GLU C 197 ? 0.9137 0.5861 0.8466 0.1684 0.0336 -0.0385 200 GLU C N 4600 C CA . GLU C 197 ? 0.9342 0.5819 0.8888 0.1533 0.0495 -0.0723 200 GLU C CA 4601 C C . GLU C 197 ? 0.8790 0.5875 0.8389 0.1330 0.0476 -0.1058 200 GLU C C 4602 O O . GLU C 197 ? 0.8803 0.5844 0.8447 0.1077 0.0568 -0.1296 200 GLU C O 4603 C CB . GLU C 197 ? 0.9878 0.5982 0.9690 0.1830 0.0549 -0.0835 200 GLU C CB 4604 N N . ASP C 198 ? 0.8364 0.6024 0.7944 0.1432 0.0356 -0.1068 201 ASP C N 4605 C CA . ASP C 198 ? 0.7941 0.6145 0.7506 0.1271 0.0346 -0.1324 201 ASP C CA 4606 C C . ASP C 198 ? 0.7463 0.5998 0.6794 0.1079 0.0255 -0.1182 201 ASP C C 4607 O O . ASP C 198 ? 0.7155 0.6149 0.6415 0.1029 0.0205 -0.1242 201 ASP C O 4608 C CB . ASP C 198 ? 0.7868 0.6483 0.7589 0.1461 0.0330 -0.1468 201 ASP C CB 4609 C CG . ASP C 198 ? 0.7828 0.6631 0.7574 0.1680 0.0207 -0.1217 201 ASP C CG 4610 O OD1 . ASP C 198 ? 0.8200 0.7021 0.8189 0.1958 0.0202 -0.1267 201 ASP C OD1 4611 O OD2 . ASP C 198 ? 0.7523 0.6488 0.7072 0.1587 0.0110 -0.1000 201 ASP C OD2 4612 N N . THR C 199 ? 0.7462 0.5738 0.6678 0.0972 0.0254 -0.0996 202 THR C N 4613 C CA . THR C 199 ? 0.7053 0.5598 0.6098 0.0813 0.0181 -0.0894 202 THR C CA 4614 C C . THR C 199 ? 0.6895 0.5664 0.5944 0.0618 0.0191 -0.1127 202 THR C C 4615 O O . THR C 199 ? 0.7130 0.5717 0.6294 0.0506 0.0273 -0.1312 202 THR C O 4616 C CB . THR C 199 ? 0.7174 0.5434 0.6113 0.0756 0.0206 -0.0664 202 THR C CB 4617 O OG1 . THR C 199 ? 0.7445 0.5468 0.6324 0.0960 0.0187 -0.0434 202 THR C OG1 4618 C CG2 . THR C 199 ? 0.6782 0.5357 0.5582 0.0653 0.0128 -0.0579 202 THR C CG2 4619 N N . PHE C 200 ? 0.6549 0.5711 0.5471 0.0578 0.0101 -0.1116 203 PHE C N 4620 C CA . PHE C 200 ? 0.6441 0.5875 0.5302 0.0444 0.0065 -0.1289 203 PHE C CA 4621 C C . PHE C 200 ? 0.6344 0.5805 0.5206 0.0329 0.0019 -0.1236 203 PHE C C 4622 O O . PHE C 200 ? 0.6134 0.5646 0.4915 0.0351 -0.0038 -0.1045 203 PHE C O 4623 C CB . PHE C 200 ? 0.6263 0.6045 0.4949 0.0470 0.0006 -0.1261 203 PHE C CB 4624 C CG . PHE C 200 ? 0.6228 0.6297 0.4755 0.0374 -0.0061 -0.1366 203 PHE C CG 4625 C CD1 . PHE C 200 ? 0.6353 0.6517 0.4926 0.0294 -0.0045 -0.1643 203 PHE C CD1 4626 C CD2 . PHE C 200 ? 0.6102 0.6344 0.4422 0.0372 -0.0149 -0.1190 203 PHE C CD2 4627 C CE1 . PHE C 200 ? 0.6364 0.6875 0.4753 0.0232 -0.0147 -0.1735 203 PHE C CE1 4628 C CE2 . PHE C 200 ? 0.6133 0.6631 0.4256 0.0331 -0.0240 -0.1234 203 PHE C CE2 4629 C CZ . PHE C 200 ? 0.6265 0.6940 0.4409 0.0270 -0.0254 -0.1503 203 PHE C CZ 4630 N N . PHE C 201 ? 0.6514 0.5968 0.5511 0.0198 0.0057 -0.1446 204 PHE C N 4631 C CA . PHE C 201 ? 0.6463 0.6057 0.5548 0.0077 0.0022 -0.1467 204 PHE C CA 4632 C C . PHE C 201 ? 0.6471 0.6508 0.5539 0.0019 -0.0097 -0.1682 204 PHE C C 4633 O O . PHE C 201 ? 0.6680 0.6800 0.5893 -0.0105 -0.0065 -0.1970 204 PHE C O 4634 C CB . PHE C 201 ? 0.6721 0.6002 0.6022 -0.0067 0.0175 -0.1545 204 PHE C CB 4635 C CG . PHE C 201 ? 0.6817 0.5672 0.6061 -0.0004 0.0278 -0.1275 204 PHE C CG 4636 C CD1 . PHE C 201 ? 0.7097 0.5524 0.6343 0.0084 0.0372 -0.1229 204 PHE C CD1 4637 C CD2 . PHE C 201 ? 0.6677 0.5574 0.5855 -0.0013 0.0278 -0.1077 204 PHE C CD2 4638 C CE1 . PHE C 201 ? 0.7302 0.5357 0.6443 0.0176 0.0436 -0.0945 204 PHE C CE1 4639 C CE2 . PHE C 201 ? 0.6844 0.5398 0.5896 0.0043 0.0363 -0.0827 204 PHE C CE2 4640 C CZ . PHE C 201 ? 0.7203 0.5339 0.6214 0.0145 0.0428 -0.0738 204 PHE C CZ 4641 N N . PRO C 202 ? 0.6323 0.6635 0.5205 0.0112 -0.0241 -0.1545 205 PRO C N 4642 C CA . PRO C 202 ? 0.6410 0.7154 0.5197 0.0109 -0.0393 -0.1681 205 PRO C CA 4643 C C . PRO C 202 ? 0.6461 0.7474 0.5520 0.0007 -0.0449 -0.1869 205 PRO C C 4644 O O . PRO C 202 ? 0.6359 0.7277 0.5616 -0.0021 -0.0397 -0.1789 205 PRO C O 4645 C CB . PRO C 202 ? 0.6291 0.7103 0.4835 0.0252 -0.0508 -0.1400 205 PRO C CB 4646 C CG . PRO C 202 ? 0.6142 0.6602 0.4659 0.0297 -0.0403 -0.1189 205 PRO C CG 4647 C CD . PRO C 202 ? 0.6124 0.6331 0.4874 0.0225 -0.0272 -0.1254 205 PRO C CD 4648 N N . SER C 203 ? 0.6675 0.8082 0.5752 -0.0057 -0.0548 -0.2145 206 SER C N 4649 C CA . SER C 203 ? 0.6741 0.8547 0.6132 -0.0164 -0.0627 -0.2380 206 SER C CA 4650 C C . SER C 203 ? 0.6648 0.8824 0.6003 0.0013 -0.0841 -0.2215 206 SER C C 4651 O O . SER C 203 ? 0.6754 0.9087 0.5770 0.0180 -0.1006 -0.2068 206 SER C O 4652 C CB . SER C 203 ? 0.7008 0.9174 0.6455 -0.0305 -0.0676 -0.2789 206 SER C CB 4653 O OG . SER C 203 ? 0.7164 0.8940 0.6804 -0.0496 -0.0448 -0.3003 206 SER C OG 4654 N N . PRO C 204 ? 0.6531 0.8822 0.6233 -0.0014 -0.0821 -0.2230 207 PRO C N 4655 C CA . PRO C 204 ? 0.6469 0.9101 0.6242 0.0186 -0.1010 -0.2108 207 PRO C CA 4656 C C . PRO C 204 ? 0.6666 0.9969 0.6464 0.0277 -0.1286 -0.2296 207 PRO C C 4657 O O . PRO C 204 ? 0.6841 1.0463 0.6747 0.0105 -0.1306 -0.2627 207 PRO C O 4658 C CB . PRO C 204 ? 0.6322 0.8987 0.6537 0.0067 -0.0859 -0.2197 207 PRO C CB 4659 C CG . PRO C 204 ? 0.6398 0.8904 0.6805 -0.0237 -0.0644 -0.2437 207 PRO C CG 4660 C CD . PRO C 204 ? 0.6501 0.8556 0.6542 -0.0236 -0.0583 -0.2345 207 PRO C CD 4661 N N . ALA D 3 ? 1.0370 1.2908 1.0406 -0.3907 -0.0653 0.2808 3 ALA D N 4662 C CA . ALA D 3 ? 1.0417 1.2510 0.9997 -0.3567 -0.0788 0.2763 3 ALA D CA 4663 C C . ALA D 3 ? 1.0107 1.1250 0.9880 -0.3041 -0.1108 0.2433 3 ALA D C 4664 O O . ALA D 3 ? 1.0389 1.0789 1.0410 -0.3071 -0.1464 0.2510 3 ALA D O 4665 C CB . ALA D 3 ? 1.1408 1.3175 1.0457 -0.3992 -0.1064 0.3407 3 ALA D CB 4666 N N . VAL D 4 ? 0.9566 1.0795 0.9237 -0.2574 -0.0976 0.2040 4 VAL D N 4667 C CA . VAL D 4 ? 0.9271 0.9799 0.9087 -0.2085 -0.1217 0.1708 4 VAL D CA 4668 C C . VAL D 4 ? 0.9374 0.9758 0.8840 -0.1851 -0.1320 0.1691 4 VAL D C 4669 O O . VAL D 4 ? 0.9128 1.0143 0.8377 -0.1817 -0.1025 0.1579 4 VAL D O 4670 C CB . VAL D 4 ? 0.8444 0.9280 0.8606 -0.1737 -0.0941 0.1181 4 VAL D CB 4671 C CG1 . VAL D 4 ? 0.8260 0.8505 0.8521 -0.1289 -0.1153 0.0861 4 VAL D CG1 4672 C CG2 . VAL D 4 ? 0.8353 0.9386 0.8885 -0.1943 -0.0875 0.1178 4 VAL D CG2 4673 N N . THR D 5 ? 0.9772 0.9345 0.9222 -0.1671 -0.1771 0.1762 5 THR D N 4674 C CA . THR D 5 ? 0.9964 0.9369 0.9143 -0.1443 -0.1959 0.1765 5 THR D CA 4675 C C . THR D 5 ? 0.9414 0.8681 0.8864 -0.0909 -0.1982 0.1239 5 THR D C 4676 O O . THR D 5 ? 0.9260 0.8179 0.9037 -0.0713 -0.2089 0.0994 5 THR D O 4677 C CB . THR D 5 ? 1.0976 0.9595 0.9944 -0.1612 -0.2519 0.2254 5 THR D CB 4678 O OG1 . THR D 5 ? 1.1554 1.0237 1.0329 -0.2192 -0.2517 0.2791 5 THR D OG1 4679 C CG2 . THR D 5 ? 1.1314 0.9950 0.9911 -0.1475 -0.2692 0.2361 5 THR D CG2 4680 N N . GLN D 6 ? 0.9164 0.8774 0.8468 -0.0703 -0.1875 0.1060 6 GLN D N 4681 C CA . GLN D 6 ? 0.8720 0.8309 0.8272 -0.0256 -0.1897 0.0605 6 GLN D CA 4682 C C . GLN D 6 ? 0.9110 0.8544 0.8518 -0.0077 -0.2224 0.0659 6 GLN D C 4683 O O . GLN D 6 ? 0.9454 0.9080 0.8486 -0.0277 -0.2253 0.0949 6 GLN D O 4684 C CB . GLN D 6 ? 0.7954 0.8201 0.7586 -0.0173 -0.1426 0.0252 6 GLN D CB 4685 C CG . GLN D 6 ? 0.7514 0.7927 0.7340 -0.0261 -0.1140 0.0135 6 GLN D CG 4686 C CD . GLN D 6 ? 0.6906 0.7847 0.6804 -0.0172 -0.0755 -0.0176 6 GLN D CD 4687 O OE1 . GLN D 6 ? 0.6743 0.8043 0.6641 -0.0330 -0.0497 -0.0172 6 GLN D OE1 4688 N NE2 . GLN D 6 ? 0.6649 0.7650 0.6647 0.0077 -0.0738 -0.0457 6 GLN D NE2 4689 N N . SER D 7 ? 0.9090 0.8244 0.8802 0.0310 -0.2479 0.0359 7 SER D N 4690 C CA . SER D 7 ? 0.9356 0.8494 0.9062 0.0567 -0.2780 0.0293 7 SER D CA 4691 C C . SER D 7 ? 0.8849 0.8273 0.8988 0.0986 -0.2708 -0.0264 7 SER D C 4692 O O . SER D 7 ? 0.8681 0.7954 0.9114 0.1153 -0.2695 -0.0526 7 SER D O 4693 C CB . SER D 7 ? 1.0312 0.8673 0.9922 0.0581 -0.3399 0.0653 7 SER D CB 4694 O OG . SER D 7 ? 1.0504 0.8378 1.0543 0.0958 -0.3745 0.0353 7 SER D OG 4695 N N . PRO D 8 ? 0.8631 0.8547 0.8807 0.1127 -0.2649 -0.0456 8 PRO D N 4696 C CA . PRO D 8 ? 0.8827 0.9000 0.8628 0.0945 -0.2659 -0.0214 8 PRO D CA 4697 C C . PRO D 8 ? 0.8359 0.9028 0.7925 0.0639 -0.2153 -0.0198 8 PRO D C 4698 O O . PRO D 8 ? 0.7886 0.8650 0.7604 0.0581 -0.1825 -0.0347 8 PRO D O 4699 C CB . PRO D 8 ? 0.8694 0.9257 0.8779 0.1264 -0.2785 -0.0563 8 PRO D CB 4700 C CG . PRO D 8 ? 0.8112 0.8956 0.8667 0.1472 -0.2535 -0.1022 8 PRO D CG 4701 C CD . PRO D 8 ? 0.8200 0.8540 0.8810 0.1464 -0.2558 -0.0964 8 PRO D CD 4702 N N . ARG D 9 ? 0.8558 0.9539 0.7751 0.0470 -0.2125 -0.0041 9 ARG D N 4703 C CA . ARG D 9 ? 0.8200 0.9698 0.7200 0.0242 -0.1687 -0.0120 9 ARG D CA 4704 C C . ARG D 9 ? 0.7730 0.9706 0.6958 0.0396 -0.1513 -0.0550 9 ARG D C 4705 O O . ARG D 9 ? 0.7309 0.9598 0.6602 0.0310 -0.1154 -0.0767 9 ARG D O 4706 C CB . ARG D 9 ? 0.8762 1.0422 0.7190 -0.0053 -0.1731 0.0252 9 ARG D CB 4707 C CG . ARG D 9 ? 0.9465 1.0627 0.7638 -0.0280 -0.1983 0.0777 9 ARG D CG 4708 C CD . ARG D 9 ? 0.9303 1.0501 0.7550 -0.0523 -0.1667 0.0861 9 ARG D CD 4709 N NE . ARG D 9 ? 0.9518 1.1288 0.7352 -0.0869 -0.1386 0.1039 9 ARG D NE 4710 C CZ . ARG D 9 ? 0.9024 1.1414 0.6926 -0.0889 -0.0952 0.0710 9 ARG D CZ 4711 N NH1 . ARG D 9 ? 0.8310 1.0738 0.6643 -0.0626 -0.0766 0.0257 9 ARG D NH1 4712 N NH2 . ARG D 9 ? 0.9263 1.2252 0.6800 -0.1176 -0.0719 0.0832 9 ARG D NH2 4713 N N . ASN D 10 ? 0.7859 0.9874 0.7245 0.0618 -0.1806 -0.0672 10 ASN D N 4714 C CA . ASN D 10 ? 0.7466 0.9952 0.7154 0.0738 -0.1696 -0.1071 10 ASN D CA 4715 C C . ASN D 10 ? 0.7423 0.9901 0.7584 0.1051 -0.1945 -0.1284 10 ASN D C 4716 O O . ASN D 10 ? 0.7915 1.0094 0.8063 0.1227 -0.2365 -0.1130 10 ASN D O 4717 C CB . ASN D 10 ? 0.7750 1.0601 0.7117 0.0650 -0.1790 -0.1075 10 ASN D CB 4718 C CG . ASN D 10 ? 0.7769 1.0813 0.6706 0.0377 -0.1505 -0.0993 10 ASN D CG 4719 O OD1 . ASN D 10 ? 0.7432 1.0792 0.6481 0.0316 -0.1221 -0.1298 10 ASN D OD1 4720 N ND2 . ASN D 10 ? 0.8209 1.1087 0.6675 0.0205 -0.1596 -0.0592 10 ASN D ND2 4721 N N . LYS D 11 ? 0.6899 0.9729 0.7488 0.1117 -0.1703 -0.1638 11 LYS D N 4722 C CA . LYS D 11 ? 0.6817 0.9864 0.7911 0.1407 -0.1866 -0.1918 11 LYS D CA 4723 C C . LYS D 11 ? 0.6398 1.0109 0.7879 0.1361 -0.1634 -0.2271 11 LYS D C 4724 O O . LYS D 11 ? 0.6037 0.9864 0.7532 0.1146 -0.1265 -0.2338 11 LYS D O 4725 C CB . LYS D 11 ? 0.6746 0.9480 0.8019 0.1552 -0.1842 -0.1954 11 LYS D CB 4726 C CG . LYS D 11 ? 0.6864 0.9800 0.8633 0.1929 -0.2092 -0.2267 11 LYS D CG 4727 C CD . LYS D 11 ? 0.7535 1.0118 0.9287 0.2185 -0.2662 -0.2138 11 LYS D CD 4728 C CE . LYS D 11 ? 0.7719 1.0351 0.9992 0.2632 -0.2963 -0.2483 11 LYS D CE 4729 N NZ . LYS D 11 ? 0.7391 1.0940 1.0224 0.2813 -0.2858 -0.2952 11 LYS D NZ 4730 N N . VAL D 12 ? 0.6499 1.0631 0.8315 0.1552 -0.1888 -0.2480 12 VAL D N 4731 C CA . VAL D 12 ? 0.6163 1.1013 0.8451 0.1493 -0.1711 -0.2823 12 VAL D CA 4732 C C . VAL D 12 ? 0.6068 1.1307 0.8905 0.1772 -0.1749 -0.3111 12 VAL D C 4733 O O . VAL D 12 ? 0.6389 1.1580 0.9410 0.2124 -0.2137 -0.3184 12 VAL D O 4734 C CB . VAL D 12 ? 0.6371 1.1608 0.8716 0.1481 -0.1957 -0.2919 12 VAL D CB 4735 C CG1 . VAL D 12 ? 0.6047 1.2042 0.8928 0.1339 -0.1762 -0.3260 12 VAL D CG1 4736 C CG2 . VAL D 12 ? 0.6560 1.1473 0.8300 0.1248 -0.1944 -0.2681 12 VAL D CG2 4737 N N . ALA D 13 ? 0.5694 1.1328 0.8778 0.1617 -0.1364 -0.3282 13 ALA D N 4738 C CA . ALA D 13 ? 0.5608 1.1728 0.9149 0.1846 -0.1307 -0.3585 13 ALA D CA 4739 C C . ALA D 13 ? 0.5351 1.2428 0.9377 0.1649 -0.1021 -0.3862 13 ALA D C 4740 O O . ALA D 13 ? 0.5206 1.2392 0.9170 0.1272 -0.0824 -0.3772 13 ALA D O 4741 C CB . ALA D 13 ? 0.5548 1.1217 0.8826 0.1844 -0.1115 -0.3478 13 ALA D CB 4742 N N . VAL D 14 ? 0.5343 1.3129 0.9871 0.1896 -0.1010 -0.4218 14 VAL D N 4743 C CA . VAL D 14 ? 0.5154 1.4017 1.0191 0.1684 -0.0710 -0.4487 14 VAL D CA 4744 C C . VAL D 14 ? 0.5030 1.4086 0.9938 0.1490 -0.0284 -0.4478 14 VAL D C 4745 O O . VAL D 14 ? 0.5110 1.3692 0.9736 0.1706 -0.0304 -0.4448 14 VAL D O 4746 C CB . VAL D 14 ? 0.5276 1.5084 1.1036 0.2085 -0.0941 -0.4961 14 VAL D CB 4747 C CG1 . VAL D 14 ? 0.5118 1.5952 1.1413 0.1784 -0.0799 -0.5141 14 VAL D CG1 4748 C CG2 . VAL D 14 ? 0.5616 1.4882 1.1366 0.2553 -0.1518 -0.4967 14 VAL D CG2 4749 N N . THR D 15 ? 0.4906 1.4651 1.0006 0.1056 0.0071 -0.4484 15 THR D N 4750 C CA . THR D 15 ? 0.4898 1.5027 0.9887 0.0827 0.0474 -0.4469 15 THR D CA 4751 C C . THR D 15 ? 0.4987 1.5919 1.0341 0.1254 0.0472 -0.4924 15 THR D C 4752 O O . THR D 15 ? 0.5006 1.6863 1.0994 0.1473 0.0364 -0.5317 15 THR D O 4753 C CB . THR D 15 ? 0.4890 1.5695 1.0079 0.0230 0.0810 -0.4365 15 THR D CB 4754 O OG1 . THR D 15 ? 0.4909 1.4912 0.9810 -0.0110 0.0750 -0.4019 15 THR D OG1 4755 C CG2 . THR D 15 ? 0.4999 1.6146 0.9945 -0.0062 0.1212 -0.4251 15 THR D CG2 4756 N N . GLY D 16 ? 0.5074 1.5665 1.0053 0.1402 0.0560 -0.4915 16 GLY D N 4757 C CA . GLY D 16 ? 0.5251 1.6531 1.0516 0.1843 0.0545 -0.5406 16 GLY D CA 4758 C C . GLY D 16 ? 0.5430 1.6081 1.0805 0.2472 0.0039 -0.5629 16 GLY D C 4759 O O . GLY D 16 ? 0.5655 1.6818 1.1371 0.2935 -0.0078 -0.6125 16 GLY D O 4760 N N . GLY D 17 ? 0.5418 1.4972 1.0503 0.2481 -0.0275 -0.5271 17 GLY D N 4761 C CA . GLY D 17 ? 0.5711 1.4470 1.0793 0.2977 -0.0795 -0.5334 17 GLY D CA 4762 C C . GLY D 17 ? 0.5849 1.3584 1.0373 0.3002 -0.0846 -0.5099 17 GLY D C 4763 O O . GLY D 17 ? 0.5675 1.3252 0.9776 0.2639 -0.0493 -0.4849 17 GLY D O 4764 N N . LYS D 18 ? 0.6225 1.3244 1.0771 0.3422 -0.1324 -0.5168 18 LYS D N 4765 C CA . LYS D 18 ? 0.6417 1.2436 1.0506 0.3441 -0.1443 -0.4953 18 LYS D CA 4766 C C . LYS D 18 ? 0.6468 1.1443 1.0140 0.3236 -0.1670 -0.4396 18 LYS D C 4767 O O . LYS D 18 ? 0.6668 1.1431 1.0461 0.3361 -0.2020 -0.4297 18 LYS D O 4768 C CB . LYS D 18 ? 0.6918 1.2771 1.1297 0.3998 -0.1836 -0.5405 18 LYS D CB 4769 C CG . LYS D 18 ? 0.7171 1.2148 1.1140 0.3987 -0.1920 -0.5273 18 LYS D CG 4770 C CD . LYS D 18 ? 0.7830 1.2636 1.2132 0.4553 -0.2343 -0.5801 18 LYS D CD 4771 C CE . LYS D 18 ? 0.8046 1.2067 1.1961 0.4496 -0.2405 -0.5711 18 LYS D CE 4772 N NZ . LYS D 18 ? 0.8679 1.2585 1.2932 0.5051 -0.2804 -0.6321 18 LYS D NZ 4773 N N . VAL D 19 ? 0.6319 1.0723 0.9498 0.2919 -0.1468 -0.4041 19 VAL D N 4774 C CA . VAL D 19 ? 0.6361 0.9919 0.9128 0.2681 -0.1602 -0.3532 19 VAL D CA 4775 C C . VAL D 19 ? 0.6568 0.9359 0.9039 0.2661 -0.1699 -0.3367 19 VAL D C 4776 O O . VAL D 19 ? 0.6394 0.9317 0.8747 0.2570 -0.1428 -0.3456 19 VAL D O 4777 C CB . VAL D 19 ? 0.5932 0.9689 0.8448 0.2233 -0.1217 -0.3247 19 VAL D CB 4778 C CG1 . VAL D 19 ? 0.5967 0.8983 0.8044 0.1995 -0.1288 -0.2789 19 VAL D CG1 4779 C CG2 . VAL D 19 ? 0.5784 1.0198 0.8603 0.2219 -0.1203 -0.3384 19 VAL D CG2 4780 N N . THR D 20 ? 0.7002 0.9005 0.9348 0.2720 -0.2109 -0.3109 20 THR D N 4781 C CA . THR D 20 ? 0.7272 0.8515 0.9374 0.2633 -0.2245 -0.2900 20 THR D CA 4782 C C . THR D 20 ? 0.7341 0.8059 0.9059 0.2273 -0.2278 -0.2342 20 THR D C 4783 O O . THR D 20 ? 0.7719 0.8116 0.9378 0.2290 -0.2608 -0.2110 20 THR D O 4784 C CB . THR D 20 ? 0.7918 0.8647 1.0279 0.3033 -0.2773 -0.3144 20 THR D CB 4785 O OG1 . THR D 20 ? 0.7905 0.9284 1.0643 0.3403 -0.2712 -0.3748 20 THR D OG1 4786 C CG2 . THR D 20 ? 0.8207 0.8171 1.0358 0.2896 -0.2914 -0.2953 20 THR D CG2 4787 N N . LEU D 21 ? 0.7023 0.7718 0.8477 0.1953 -0.1940 -0.2139 21 LEU D N 4788 C CA . LEU D 21 ? 0.7096 0.7449 0.8219 0.1609 -0.1912 -0.1673 21 LEU D CA 4789 C C . LEU D 21 ? 0.7506 0.7196 0.8548 0.1520 -0.2146 -0.1473 21 LEU D C 4790 O O . LEU D 21 ? 0.7439 0.7061 0.8567 0.1577 -0.2087 -0.1662 21 LEU D O 4791 C CB . LEU D 21 ? 0.6546 0.7312 0.7506 0.1335 -0.1438 -0.1604 21 LEU D CB 4792 C CG . LEU D 21 ? 0.6214 0.7597 0.7270 0.1342 -0.1190 -0.1791 21 LEU D CG 4793 C CD1 . LEU D 21 ? 0.5822 0.7407 0.6724 0.1072 -0.0810 -0.1702 21 LEU D CD1 4794 C CD2 . LEU D 21 ? 0.6404 0.7877 0.7451 0.1388 -0.1403 -0.1719 21 LEU D CD2 4795 N N . SER D 22 ? 0.8005 0.7225 0.8868 0.1351 -0.2430 -0.1077 22 SER D N 4796 C CA . SER D 22 ? 0.8519 0.7066 0.9337 0.1197 -0.2710 -0.0826 22 SER D CA 4797 C C . SER D 22 ? 0.8343 0.6989 0.8913 0.0751 -0.2423 -0.0462 22 SER D C 4798 O O . SER D 22 ? 0.8019 0.7140 0.8394 0.0573 -0.2108 -0.0338 22 SER D O 4799 C CB . SER D 22 ? 0.9350 0.7240 1.0146 0.1257 -0.3280 -0.0571 22 SER D CB 4800 N N . CYS D 23 ? 0.8598 0.6837 0.9223 0.0589 -0.2549 -0.0342 23 CYS D N 4801 C CA . CYS D 23 ? 0.8515 0.6891 0.8999 0.0165 -0.2326 -0.0012 23 CYS D CA 4802 C C . CYS D 23 ? 0.9162 0.6879 0.9711 -0.0070 -0.2700 0.0271 23 CYS D C 4803 O O . CYS D 23 ? 0.9329 0.6654 1.0114 0.0090 -0.2924 0.0029 23 CYS D O 4804 C CB . CYS D 23 ? 0.7832 0.6705 0.8411 0.0181 -0.1905 -0.0272 23 CYS D CB 4805 S SG . CYS D 23 ? 0.7798 0.6980 0.8335 -0.0261 -0.1638 0.0026 23 CYS D SG 4806 N N . ASN D 24 ? 0.9582 0.7211 0.9908 -0.0480 -0.2770 0.0782 24 ASN D N 4807 C CA . ASN D 24 ? 1.0317 0.7317 1.0690 -0.0819 -0.3139 0.1157 24 ASN D CA 4808 C C . ASN D 24 ? 1.0214 0.7696 1.0529 -0.1338 -0.2822 0.1485 24 ASN D C 4809 O O . ASN D 24 ? 0.9991 0.8140 1.0057 -0.1535 -0.2466 0.1658 24 ASN D O 4810 C CB . ASN D 24 ? 1.1218 0.7577 1.1379 -0.0899 -0.3629 0.1564 24 ASN D CB 4811 C CG . ASN D 24 ? 1.2145 0.7604 1.2413 -0.1196 -0.4152 0.1920 24 ASN D CG 4812 O OD1 . ASN D 24 ? 1.2760 0.8071 1.2774 -0.1709 -0.4268 0.2528 24 ASN D OD1 4813 N ND2 . ASN D 24 ? 1.2261 0.7133 1.2895 -0.0899 -0.4481 0.1540 24 ASN D ND2 4814 N N . GLN D 25 ? 1.0401 0.7611 1.0981 -0.1542 -0.2958 0.1517 25 GLN D N 4815 C CA . GLN D 25 ? 1.0397 0.8091 1.1027 -0.2067 -0.2717 0.1832 25 GLN D CA 4816 C C . GLN D 25 ? 1.1240 0.8248 1.2045 -0.2478 -0.3159 0.2189 25 GLN D C 4817 O O . GLN D 25 ? 1.1483 0.7796 1.2558 -0.2275 -0.3538 0.1941 25 GLN D O 4818 C CB . GLN D 25 ? 0.9537 0.7961 1.0410 -0.1937 -0.2275 0.1437 25 GLN D CB 4819 C CG . GLN D 25 ? 0.9313 0.7394 1.0476 -0.1575 -0.2429 0.0967 25 GLN D CG 4820 C CD . GLN D 25 ? 0.9712 0.7551 1.1203 -0.1865 -0.2652 0.1035 25 GLN D CD 4821 O OE1 . GLN D 25 ? 1.0169 0.8125 1.1727 -0.2380 -0.2676 0.1456 25 GLN D OE1 4822 N NE2 . GLN D 25 ? 0.9581 0.7141 1.1271 -0.1558 -0.2816 0.0613 25 GLN D NE2 4823 N N . THR D 26 ? 1.1740 0.8977 1.2384 -0.3076 -0.3114 0.2763 26 THR D N 4824 C CA . THR D 26 ? 1.2630 0.9285 1.3441 -0.3609 -0.3511 0.3205 26 THR D CA 4825 C C . THR D 26 ? 1.2306 0.9749 1.3455 -0.4022 -0.3176 0.3228 26 THR D C 4826 O O . THR D 26 ? 1.3009 1.0293 1.4299 -0.4621 -0.3373 0.3676 26 THR D O 4827 C CB . THR D 26 ? 1.3650 0.9966 1.4040 -0.4103 -0.3766 0.3941 26 THR D CB 4828 O OG1 . THR D 26 ? 1.3356 1.0793 1.3408 -0.4400 -0.3223 0.4180 26 THR D OG1 4829 C CG2 . THR D 26 ? 1.4122 0.9547 1.4258 -0.3678 -0.4226 0.3928 26 THR D CG2 4830 N N . ASN D 27 ? 1.1297 0.9585 1.2604 -0.3707 -0.2701 0.2749 27 ASN D N 4831 C CA . ASN D 27 ? 1.0905 1.0028 1.2603 -0.3979 -0.2389 0.2666 27 ASN D CA 4832 C C . ASN D 27 ? 1.1045 0.9644 1.3210 -0.3966 -0.2737 0.2443 27 ASN D C 4833 O O . ASN D 27 ? 1.0938 1.0105 1.3497 -0.4287 -0.2612 0.2452 27 ASN D O 4834 C CB . ASN D 27 ? 0.9886 0.9966 1.1608 -0.3590 -0.1850 0.2216 27 ASN D CB 4835 C CG . ASN D 27 ? 0.9744 1.0448 1.1045 -0.3615 -0.1494 0.2362 27 ASN D CG 4836 O OD1 . ASN D 27 ? 1.0179 1.1345 1.1308 -0.4124 -0.1375 0.2806 27 ASN D OD1 4837 N ND2 . ASN D 27 ? 0.9161 0.9928 1.0281 -0.3090 -0.1323 0.1983 27 ASN D ND2 4838 N N . ASN D 28 ? 1.1311 0.8892 1.3449 -0.3579 -0.3181 0.2201 28 ASN D N 4839 C CA . ASN D 28 ? 1.1522 0.8519 1.4038 -0.3471 -0.3568 0.1886 28 ASN D CA 4840 C C . ASN D 28 ? 1.0655 0.8310 1.3392 -0.3117 -0.3266 0.1348 28 ASN D C 4841 O O . ASN D 28 ? 1.0720 0.8375 1.3830 -0.3235 -0.3432 0.1186 28 ASN D O 4842 C CB . ASN D 28 ? 1.2379 0.9041 1.5206 -0.4152 -0.3914 0.2323 28 ASN D CB 4843 C CG . ASN D 28 ? 1.2915 0.8605 1.6058 -0.4028 -0.4505 0.2026 28 ASN D CG 4844 O OD1 . ASN D 28 ? 1.3007 0.7975 1.6035 -0.3487 -0.4801 0.1636 28 ASN D OD1 4845 N ND2 . ASN D 28 ? 1.3279 0.9012 1.6853 -0.4534 -0.4683 0.2172 28 ASN D ND2 4846 N N . HIS D 29 ? 0.9908 0.8090 1.2407 -0.2700 -0.2862 0.1092 29 HIS D N 4847 C CA . HIS D 29 ? 0.9184 0.7891 1.1806 -0.2339 -0.2611 0.0634 29 HIS D CA 4848 C C . HIS D 29 ? 0.9196 0.7295 1.1734 -0.1841 -0.2882 0.0175 29 HIS D C 4849 O O . HIS D 29 ? 0.9493 0.7006 1.1811 -0.1602 -0.3086 0.0116 29 HIS D O 4850 C CB . HIS D 29 ? 0.8489 0.7964 1.0905 -0.2142 -0.2098 0.0572 29 HIS D CB 4851 C CG . HIS D 29 ? 0.8406 0.8725 1.0947 -0.2552 -0.1766 0.0867 29 HIS D CG 4852 N ND1 . HIS D 29 ? 0.8158 0.8991 1.0431 -0.2532 -0.1410 0.0967 29 HIS D ND1 4853 C CD2 . HIS D 29 ? 0.8554 0.9386 1.1479 -0.2993 -0.1729 0.1044 29 HIS D CD2 4854 C CE1 . HIS D 29 ? 0.8171 0.9827 1.0632 -0.2919 -0.1153 0.1165 29 HIS D CE1 4855 N NE2 . HIS D 29 ? 0.8392 1.0097 1.1270 -0.3216 -0.1327 0.1228 29 HIS D NE2 4856 N N . ASN D 30 ? 0.8922 0.7231 1.1636 -0.1676 -0.2893 -0.0163 30 ASN D N 4857 C CA . ASN D 30 ? 0.8931 0.6861 1.1508 -0.1212 -0.3090 -0.0635 30 ASN D CA 4858 C C . ASN D 30 ? 0.8323 0.6625 1.0567 -0.0795 -0.2731 -0.0849 30 ASN D C 4859 O O . ASN D 30 ? 0.8415 0.6403 1.0440 -0.0453 -0.2822 -0.1097 30 ASN D O 4860 C CB . ASN D 30 ? 0.8993 0.7022 1.1818 -0.1222 -0.3274 -0.0896 30 ASN D CB 4861 C CG . ASN D 30 ? 0.9680 0.7279 1.2885 -0.1649 -0.3692 -0.0734 30 ASN D CG 4862 O OD1 . ASN D 30 ? 1.0329 0.7181 1.3543 -0.1761 -0.4042 -0.0612 30 ASN D OD1 4863 N ND2 . ASN D 30 ? 0.9612 0.7663 1.3167 -0.1894 -0.3697 -0.0731 30 ASN D ND2 4864 N N . ASN D 31 ? 0.7757 0.6747 1.0009 -0.0832 -0.2343 -0.0768 31 ASN D N 4865 C CA . ASN D 31 ? 0.7251 0.6573 0.9227 -0.0503 -0.2023 -0.0934 31 ASN D CA 4866 C C . ASN D 31 ? 0.7090 0.6470 0.8866 -0.0486 -0.1806 -0.0763 31 ASN D C 4867 O O . ASN D 31 ? 0.7113 0.6695 0.8961 -0.0772 -0.1692 -0.0461 31 ASN D O 4868 C CB . ASN D 31 ? 0.6837 0.6769 0.8945 -0.0512 -0.1781 -0.0951 31 ASN D CB 4869 C CG . ASN D 31 ? 0.7030 0.6972 0.9325 -0.0502 -0.2016 -0.1128 31 ASN D CG 4870 O OD1 . ASN D 31 ? 0.7520 0.7018 0.9827 -0.0491 -0.2351 -0.1276 31 ASN D OD1 4871 N ND2 . ASN D 31 ? 0.6764 0.7208 0.9225 -0.0483 -0.1880 -0.1147 31 ASN D ND2 4872 N N . MET D 32 ? 0.6962 0.6238 0.8482 -0.0167 -0.1748 -0.0968 32 MET D N 4873 C CA . MET D 32 ? 0.6797 0.6179 0.8140 -0.0115 -0.1556 -0.0863 32 MET D CA 4874 C C . MET D 32 ? 0.6369 0.6071 0.7526 0.0144 -0.1284 -0.1069 32 MET D C 4875 O O . MET D 32 ? 0.6375 0.6061 0.7443 0.0347 -0.1322 -0.1319 32 MET D O 4876 C CB . MET D 32 ? 0.7251 0.6109 0.8542 -0.0045 -0.1851 -0.0844 32 MET D CB 4877 C CG . MET D 32 ? 0.7760 0.6271 0.9171 -0.0399 -0.2100 -0.0484 32 MET D CG 4878 S SD . MET D 32 ? 0.8468 0.6288 0.9793 -0.0314 -0.2500 -0.0374 32 MET D SD 4879 C CE . MET D 32 ? 0.8136 0.6420 0.9198 -0.0356 -0.2171 -0.0144 32 MET D CE 4880 N N . TYR D 33 ? 0.6069 0.6075 0.7149 0.0105 -0.1021 -0.0955 33 TYR D N 4881 C CA . TYR D 33 ? 0.5716 0.6010 0.6670 0.0262 -0.0768 -0.1089 33 TYR D CA 4882 C C . TYR D 33 ? 0.5625 0.6001 0.6454 0.0327 -0.0653 -0.1090 33 TYR D C 4883 O O . TYR D 33 ? 0.5771 0.6093 0.6591 0.0218 -0.0707 -0.0930 33 TYR D O 4884 C CB . TYR D 33 ? 0.5460 0.6092 0.6531 0.0165 -0.0576 -0.1021 33 TYR D CB 4885 C CG . TYR D 33 ? 0.5542 0.6193 0.6807 0.0095 -0.0704 -0.1021 33 TYR D CG 4886 C CD1 . TYR D 33 ? 0.5710 0.6406 0.7204 -0.0143 -0.0805 -0.0865 33 TYR D CD1 4887 C CD2 . TYR D 33 ? 0.5523 0.6180 0.6740 0.0237 -0.0739 -0.1152 33 TYR D CD2 4888 C CE1 . TYR D 33 ? 0.5801 0.6580 0.7543 -0.0227 -0.0939 -0.0885 33 TYR D CE1 4889 C CE2 . TYR D 33 ? 0.5621 0.6326 0.7034 0.0188 -0.0897 -0.1169 33 TYR D CE2 4890 C CZ . TYR D 33 ? 0.5758 0.6541 0.7469 -0.0038 -0.0995 -0.1057 33 TYR D CZ 4891 O OH . TYR D 33 ? 0.5937 0.6832 0.7909 -0.0107 -0.1165 -0.1092 33 TYR D OH 4892 N N . TRP D 34 ? 0.5448 0.5973 0.6169 0.0476 -0.0513 -0.1251 34 TRP D N 4893 C CA . TRP D 34 ? 0.5319 0.6005 0.5977 0.0524 -0.0396 -0.1286 34 TRP D CA 4894 C C . TRP D 34 ? 0.5077 0.6003 0.5695 0.0498 -0.0157 -0.1313 34 TRP D C 4895 O O . TRP D 34 ? 0.5078 0.6042 0.5620 0.0549 -0.0104 -0.1392 34 TRP D O 4896 C CB . TRP D 34 ? 0.5452 0.6108 0.6091 0.0720 -0.0510 -0.1489 34 TRP D CB 4897 C CG . TRP D 34 ? 0.5701 0.6114 0.6407 0.0781 -0.0763 -0.1458 34 TRP D CG 4898 C CD1 . TRP D 34 ? 0.6057 0.6134 0.6842 0.0916 -0.1065 -0.1567 34 TRP D CD1 4899 C CD2 . TRP D 34 ? 0.5718 0.6158 0.6404 0.0720 -0.0791 -0.1311 34 TRP D CD2 4900 N NE1 . TRP D 34 ? 0.6285 0.6108 0.7117 0.0943 -0.1305 -0.1460 34 TRP D NE1 4901 C CE2 . TRP D 34 ? 0.6106 0.6174 0.6848 0.0815 -0.1136 -0.1283 34 TRP D CE2 4902 C CE3 . TRP D 34 ? 0.5479 0.6201 0.6091 0.0604 -0.0594 -0.1216 34 TRP D CE3 4903 C CZ2 . TRP D 34 ? 0.6320 0.6290 0.7007 0.0782 -0.1293 -0.1106 34 TRP D CZ2 4904 C CZ3 . TRP D 34 ? 0.5652 0.6351 0.6196 0.0571 -0.0720 -0.1084 34 TRP D CZ3 4905 C CH2 . TRP D 34 ? 0.6090 0.6415 0.6651 0.0653 -0.1069 -0.1002 34 TRP D CH2 4906 N N . TYR D 35 ? 0.4967 0.6039 0.5615 0.0406 -0.0040 -0.1245 35 TYR D N 4907 C CA . TYR D 35 ? 0.4835 0.6040 0.5493 0.0385 0.0126 -0.1295 35 TYR D CA 4908 C C . TYR D 35 ? 0.4791 0.6146 0.5424 0.0375 0.0196 -0.1365 35 TYR D C 4909 O O . TYR D 35 ? 0.4846 0.6247 0.5449 0.0388 0.0118 -0.1350 35 TYR D O 4910 C CB . TYR D 35 ? 0.4782 0.6093 0.5559 0.0324 0.0190 -0.1262 35 TYR D CB 4911 C CG . TYR D 35 ? 0.4811 0.6079 0.5704 0.0318 0.0115 -0.1207 35 TYR D CG 4912 C CD1 . TYR D 35 ? 0.4932 0.6278 0.5906 0.0213 0.0049 -0.1103 35 TYR D CD1 4913 C CD2 . TYR D 35 ? 0.4840 0.6000 0.5767 0.0388 0.0084 -0.1235 35 TYR D CD2 4914 C CE1 . TYR D 35 ? 0.4917 0.6289 0.6063 0.0178 -0.0030 -0.1069 35 TYR D CE1 4915 C CE2 . TYR D 35 ? 0.4872 0.6039 0.5939 0.0396 -0.0019 -0.1206 35 TYR D CE2 4916 C CZ . TYR D 35 ? 0.4883 0.6186 0.6091 0.0291 -0.0068 -0.1144 35 TYR D CZ 4917 O OH . TYR D 35 ? 0.4974 0.6344 0.6382 0.0270 -0.0182 -0.1131 35 TYR D OH 4918 N N . ARG D 36 ? 0.4765 0.6163 0.5420 0.0340 0.0302 -0.1428 36 ARG D N 4919 C CA . ARG D 36 ? 0.4749 0.6305 0.5434 0.0293 0.0358 -0.1518 36 ARG D CA 4920 C C . ARG D 36 ? 0.4808 0.6320 0.5573 0.0246 0.0420 -0.1587 36 ARG D C 4921 O O . ARG D 36 ? 0.4880 0.6197 0.5690 0.0252 0.0414 -0.1555 36 ARG D O 4922 C CB . ARG D 36 ? 0.4773 0.6456 0.5473 0.0272 0.0387 -0.1580 36 ARG D CB 4923 C CG . ARG D 36 ? 0.4867 0.6464 0.5530 0.0186 0.0454 -0.1528 36 ARG D CG 4924 C CD . ARG D 36 ? 0.4933 0.6833 0.5631 0.0100 0.0529 -0.1587 36 ARG D CD 4925 N NE . ARG D 36 ? 0.4976 0.6965 0.5813 -0.0043 0.0566 -0.1642 36 ARG D NE 4926 C CZ . ARG D 36 ? 0.5038 0.7337 0.5980 -0.0198 0.0641 -0.1682 36 ARG D CZ 4927 N NH1 . ARG D 36 ? 0.5041 0.7679 0.5949 -0.0214 0.0723 -0.1689 36 ARG D NH1 4928 N NH2 . ARG D 36 ? 0.5113 0.7444 0.6214 -0.0348 0.0635 -0.1744 36 ARG D NH2 4929 N N . GLN D 37 ? 0.4859 0.6539 0.5641 0.0222 0.0439 -0.1704 37 GLN D N 4930 C CA . GLN D 37 ? 0.4999 0.6657 0.5886 0.0222 0.0465 -0.1864 37 GLN D CA 4931 C C . GLN D 37 ? 0.5170 0.6808 0.6128 0.0137 0.0449 -0.2004 37 GLN D C 4932 O O . GLN D 37 ? 0.5156 0.7030 0.6067 0.0103 0.0436 -0.2070 37 GLN D O 4933 C CB . GLN D 37 ? 0.5004 0.6959 0.5848 0.0261 0.0504 -0.1950 37 GLN D CB 4934 C CG . GLN D 37 ? 0.5095 0.7101 0.6102 0.0337 0.0529 -0.2196 37 GLN D CG 4935 C CD . GLN D 37 ? 0.5097 0.7590 0.6035 0.0356 0.0617 -0.2314 37 GLN D CD 4936 O OE1 . GLN D 37 ? 0.5101 0.7854 0.5805 0.0271 0.0636 -0.2241 37 GLN D OE1 4937 N NE2 . GLN D 37 ? 0.5214 0.7881 0.6355 0.0466 0.0661 -0.2496 37 GLN D NE2 4938 N N . ASP D 38 ? 0.5407 0.6736 0.6493 0.0092 0.0409 -0.2037 38 ASP D N 4939 C CA . ASP D 38 ? 0.5674 0.6892 0.6878 -0.0047 0.0358 -0.2146 38 ASP D CA 4940 C C . ASP D 38 ? 0.6023 0.6920 0.7397 0.0010 0.0251 -0.2344 38 ASP D C 4941 O O . ASP D 38 ? 0.6147 0.6787 0.7578 0.0121 0.0198 -0.2298 38 ASP D O 4942 C CB . ASP D 38 ? 0.5773 0.6852 0.6971 -0.0233 0.0370 -0.1930 38 ASP D CB 4943 C CG . ASP D 38 ? 0.5537 0.6967 0.6618 -0.0223 0.0461 -0.1816 38 ASP D CG 4944 O OD1 . ASP D 38 ? 0.5505 0.7274 0.6650 -0.0271 0.0479 -0.1905 38 ASP D OD1 4945 O OD2 . ASP D 38 ? 0.5518 0.6888 0.6474 -0.0147 0.0483 -0.1674 38 ASP D OD2 4946 N N . THR D 39 ? 0.6258 0.7167 0.7744 -0.0040 0.0181 -0.2598 39 THR D N 4947 C CA . THR D 39 ? 0.6676 0.7282 0.8366 0.0065 0.0035 -0.2894 39 THR D CA 4948 C C . THR D 39 ? 0.7050 0.7002 0.8886 0.0027 -0.0129 -0.2736 39 THR D C 4949 O O . THR D 39 ? 0.7198 0.6882 0.8999 -0.0223 -0.0161 -0.2447 39 THR D O 4950 C CB . THR D 39 ? 0.6952 0.7597 0.8750 -0.0022 -0.0065 -0.3209 39 THR D CB 4951 O OG1 . THR D 39 ? 0.7002 0.7645 0.8818 -0.0307 -0.0066 -0.3016 39 THR D OG1 4952 C CG2 . THR D 39 ? 0.6809 0.8060 0.8442 0.0111 0.0026 -0.3474 39 THR D CG2 4953 N N . GLY D 40 ? 0.7260 0.7012 0.9260 0.0275 -0.0241 -0.2925 40 GLY D N 4954 C CA . GLY D 40 ? 0.7717 0.6784 0.9870 0.0302 -0.0478 -0.2792 40 GLY D CA 4955 C C . GLY D 40 ? 0.7554 0.6542 0.9521 0.0264 -0.0434 -0.2369 40 GLY D C 4956 O O . GLY D 40 ? 0.8000 0.6418 0.9942 0.0142 -0.0618 -0.2088 40 GLY D O 4957 N N . HIS D 41 ? 0.6994 0.6525 0.8808 0.0349 -0.0220 -0.2312 41 HIS D N 4958 C CA . HIS D 41 ? 0.6840 0.6339 0.8477 0.0333 -0.0195 -0.1977 41 HIS D CA 4959 C C . HIS D 41 ? 0.6525 0.6360 0.8241 0.0572 -0.0146 -0.2062 41 HIS D C 4960 O O . HIS D 41 ? 0.6741 0.6336 0.8577 0.0715 -0.0308 -0.2009 41 HIS D O 4961 C CB . HIS D 41 ? 0.6577 0.6325 0.7931 0.0103 -0.0021 -0.1725 41 HIS D CB 4962 C CG . HIS D 41 ? 0.7004 0.6409 0.8234 -0.0172 -0.0087 -0.1449 41 HIS D CG 4963 N ND1 . HIS D 41 ? 0.7257 0.6635 0.8551 -0.0410 -0.0077 -0.1477 41 HIS D ND1 4964 C CD2 . HIS D 41 ? 0.7327 0.6453 0.8356 -0.0286 -0.0165 -0.1122 41 HIS D CD2 4965 C CE1 . HIS D 41 ? 0.7646 0.6772 0.8803 -0.0692 -0.0123 -0.1158 41 HIS D CE1 4966 N NE2 . HIS D 41 ? 0.7745 0.6713 0.8700 -0.0620 -0.0174 -0.0928 41 HIS D NE2 4967 N N . GLY D 42 ? 0.6058 0.6454 0.7717 0.0592 0.0051 -0.2168 42 GLY D N 4968 C CA . GLY D 42 ? 0.5711 0.6479 0.7408 0.0702 0.0124 -0.2149 42 GLY D CA 4969 C C . GLY D 42 ? 0.5403 0.6229 0.6833 0.0564 0.0197 -0.1858 42 GLY D C 4970 O O . GLY D 42 ? 0.5525 0.6060 0.6783 0.0453 0.0153 -0.1663 42 GLY D O 4971 N N . LEU D 43 ? 0.5083 0.6300 0.6479 0.0559 0.0300 -0.1841 43 LEU D N 4972 C CA . LEU D 43 ? 0.4861 0.6103 0.6048 0.0465 0.0323 -0.1633 43 LEU D CA 4973 C C . LEU D 43 ? 0.4952 0.5884 0.6028 0.0460 0.0222 -0.1464 43 LEU D C 4974 O O . LEU D 43 ? 0.5081 0.5861 0.6263 0.0544 0.0108 -0.1440 43 LEU D O 4975 C CB . LEU D 43 ? 0.4714 0.6292 0.5955 0.0450 0.0363 -0.1601 43 LEU D CB 4976 C CG . LEU D 43 ? 0.4649 0.6538 0.5775 0.0352 0.0455 -0.1597 43 LEU D CG 4977 C CD1 . LEU D 43 ? 0.4701 0.6860 0.5872 0.0380 0.0547 -0.1821 43 LEU D CD1 4978 C CD2 . LEU D 43 ? 0.4579 0.6715 0.5751 0.0261 0.0457 -0.1468 43 LEU D CD2 4979 N N . ARG D 44 ? 0.4897 0.5796 0.5759 0.0376 0.0251 -0.1369 44 ARG D N 4980 C CA . ARG D 44 ? 0.5026 0.5763 0.5699 0.0352 0.0189 -0.1234 44 ARG D CA 4981 C C . ARG D 44 ? 0.4907 0.5792 0.5455 0.0372 0.0188 -0.1234 44 ARG D C 4982 O O . ARG D 44 ? 0.4787 0.5831 0.5335 0.0364 0.0241 -0.1299 44 ARG D O 4983 C CB . ARG D 44 ? 0.5246 0.5864 0.5789 0.0217 0.0226 -0.1161 44 ARG D CB 4984 C CG . ARG D 44 ? 0.5553 0.5821 0.6190 0.0190 0.0123 -0.1110 44 ARG D CG 4985 C CD . ARG D 44 ? 0.5890 0.6030 0.6409 -0.0032 0.0151 -0.0990 44 ARG D CD 4986 N NE . ARG D 44 ? 0.5667 0.6075 0.6292 -0.0114 0.0281 -0.1136 44 ARG D NE 4987 C CZ . ARG D 44 ? 0.5836 0.6323 0.6427 -0.0340 0.0346 -0.1074 44 ARG D CZ 4988 N NH1 . ARG D 44 ? 0.6223 0.6544 0.6631 -0.0549 0.0319 -0.0827 44 ARG D NH1 4989 N NH2 . ARG D 44 ? 0.5650 0.6429 0.6387 -0.0383 0.0429 -0.1242 44 ARG D NH2 4990 N N . LEU D 45 ? 0.5010 0.5815 0.5462 0.0418 0.0084 -0.1182 45 LEU D N 4991 C CA . LEU D 45 ? 0.4976 0.5848 0.5357 0.0470 0.0016 -0.1239 45 LEU D CA 4992 C C . LEU D 45 ? 0.5082 0.6096 0.5255 0.0478 0.0069 -0.1314 45 LEU D C 4993 O O . LEU D 45 ? 0.5293 0.6352 0.5249 0.0422 0.0109 -0.1257 45 LEU D O 4994 C CB . LEU D 45 ? 0.5085 0.5857 0.5470 0.0519 -0.0144 -0.1210 45 LEU D CB 4995 C CG . LEU D 45 ? 0.5135 0.5888 0.5541 0.0563 -0.0287 -0.1294 45 LEU D CG 4996 C CD1 . LEU D 45 ? 0.5015 0.5777 0.5626 0.0516 -0.0295 -0.1291 45 LEU D CD1 4997 C CD2 . LEU D 45 ? 0.5263 0.5953 0.5728 0.0583 -0.0457 -0.1270 45 LEU D CD2 4998 N N . ILE D 46 ? 0.4986 0.6107 0.5231 0.0543 0.0055 -0.1438 46 ILE D N 4999 C CA . ILE D 46 ? 0.5078 0.6451 0.5227 0.0611 0.0093 -0.1600 46 ILE D CA 5000 C C . ILE D 46 ? 0.5284 0.6624 0.5344 0.0756 -0.0065 -0.1759 46 ILE D C 5001 O O . ILE D 46 ? 0.5502 0.7058 0.5340 0.0781 -0.0026 -0.1855 46 ILE D O 5002 C CB . ILE D 46 ? 0.4937 0.6453 0.5263 0.0662 0.0107 -0.1700 46 ILE D CB 5003 C CG1 . ILE D 46 ? 0.4749 0.6339 0.5147 0.0517 0.0248 -0.1601 46 ILE D CG1 5004 C CG2 . ILE D 46 ? 0.5105 0.6984 0.5428 0.0788 0.0125 -0.1940 46 ILE D CG2 5005 C CD1 . ILE D 46 ? 0.4602 0.6282 0.5156 0.0557 0.0209 -0.1659 46 ILE D CD1 5006 N N . HIS D 47 ? 0.5288 0.6366 0.5506 0.0825 -0.0256 -0.1787 47 HIS D N 5007 C CA . HIS D 47 ? 0.5546 0.6482 0.5747 0.0959 -0.0478 -0.1967 47 HIS D CA 5008 C C . HIS D 47 ? 0.5562 0.6135 0.5937 0.0878 -0.0670 -0.1829 47 HIS D C 5009 O O . HIS D 47 ? 0.5410 0.5898 0.5932 0.0764 -0.0644 -0.1646 47 HIS D O 5010 C CB . HIS D 47 ? 0.5710 0.6723 0.6011 0.1162 -0.0587 -0.2242 47 HIS D CB 5011 C CG . HIS D 47 ? 0.5788 0.7313 0.5954 0.1268 -0.0424 -0.2484 47 HIS D CG 5012 N ND1 . HIS D 47 ? 0.6023 0.7786 0.5929 0.1314 -0.0395 -0.2645 47 HIS D ND1 5013 C CD2 . HIS D 47 ? 0.5725 0.7659 0.5987 0.1318 -0.0279 -0.2603 47 HIS D CD2 5014 C CE1 . HIS D 47 ? 0.6120 0.8463 0.5946 0.1363 -0.0204 -0.2837 47 HIS D CE1 5015 N NE2 . HIS D 47 ? 0.5851 0.8318 0.5932 0.1367 -0.0131 -0.2823 47 HIS D NE2 5016 N N . TYR D 48 ? 0.5789 0.6213 0.6139 0.0913 -0.0861 -0.1923 48 TYR D N 5017 C CA . TYR D 48 ? 0.5892 0.6021 0.6461 0.0794 -0.1069 -0.1807 48 TYR D CA 5018 C C . TYR D 48 ? 0.6337 0.6181 0.6950 0.0902 -0.1396 -0.2045 48 TYR D C 5019 O O . TYR D 48 ? 0.6547 0.6501 0.6980 0.1103 -0.1441 -0.2346 48 TYR D O 5020 C CB . TYR D 48 ? 0.5724 0.5969 0.6344 0.0656 -0.0999 -0.1633 48 TYR D CB 5021 C CG . TYR D 48 ? 0.5859 0.6193 0.6271 0.0738 -0.1058 -0.1744 48 TYR D CG 5022 C CD1 . TYR D 48 ? 0.5791 0.6331 0.5915 0.0783 -0.0877 -0.1718 48 TYR D CD1 5023 C CD2 . TYR D 48 ? 0.6062 0.6266 0.6544 0.0737 -0.1322 -0.1846 48 TYR D CD2 5024 C CE1 . TYR D 48 ? 0.6026 0.6645 0.5873 0.0828 -0.0956 -0.1759 48 TYR D CE1 5025 C CE2 . TYR D 48 ? 0.6250 0.6560 0.6484 0.0815 -0.1407 -0.1943 48 TYR D CE2 5026 C CZ . TYR D 48 ? 0.6249 0.6768 0.6133 0.0861 -0.1223 -0.1882 48 TYR D CZ 5027 O OH . TYR D 48 ? 0.6539 0.7158 0.6095 0.0910 -0.1333 -0.1920 48 TYR D OH 5028 N N . SER D 49 ? 0.6533 0.6042 0.7391 0.0750 -0.1628 -0.1923 49 SER D N 5029 C CA . SER D 49 ? 0.7041 0.6140 0.8012 0.0821 -0.2011 -0.2139 49 SER D CA 5030 C C . SER D 49 ? 0.7202 0.6133 0.8403 0.0568 -0.2203 -0.1990 49 SER D C 5031 O O . SER D 49 ? 0.7012 0.6062 0.8381 0.0303 -0.2083 -0.1664 49 SER D O 5032 C CB . SER D 49 ? 0.7330 0.6033 0.8430 0.0877 -0.2214 -0.2132 49 SER D CB 5033 O OG . SER D 49 ? 0.7875 0.6046 0.9139 0.0938 -0.2656 -0.2332 49 SER D OG 5034 N N . TYR D 50 ? 0.7612 0.6339 0.8838 0.0648 -0.2503 -0.2265 50 TYR D N 5035 C CA . TYR D 50 ? 0.7838 0.6419 0.9343 0.0397 -0.2742 -0.2172 50 TYR D CA 5036 C C . TYR D 50 ? 0.8453 0.6392 1.0234 0.0258 -0.3165 -0.2169 50 TYR D C 5037 O O . TYR D 50 ? 0.8748 0.6513 1.0804 0.0013 -0.3424 -0.2117 50 TYR D O 5038 C CB . TYR D 50 ? 0.7951 0.6728 0.9314 0.0529 -0.2849 -0.2459 50 TYR D CB 5039 C CG . TYR D 50 ? 0.7486 0.6787 0.8714 0.0512 -0.2557 -0.2303 50 TYR D CG 5040 C CD1 . TYR D 50 ? 0.7221 0.6754 0.8766 0.0260 -0.2456 -0.2001 50 TYR D CD1 5041 C CD2 . TYR D 50 ? 0.7412 0.6991 0.8210 0.0743 -0.2407 -0.2463 50 TYR D CD2 5042 C CE1 . TYR D 50 ? 0.6902 0.6850 0.8384 0.0302 -0.2257 -0.1900 50 TYR D CE1 5043 C CE2 . TYR D 50 ? 0.7135 0.7061 0.7808 0.0725 -0.2218 -0.2281 50 TYR D CE2 5044 C CZ . TYR D 50 ? 0.6885 0.6951 0.7925 0.0535 -0.2168 -0.2020 50 TYR D CZ 5045 O OH . TYR D 50 ? 0.6653 0.7001 0.7631 0.0571 -0.2045 -0.1881 50 TYR D OH 5046 N N . GLY D 51 ? 0.8711 0.6282 1.0450 0.0405 -0.3271 -0.2217 51 GLY D N 5047 C CA . GLY D 51 ? 0.9433 0.6250 1.1418 0.0299 -0.3742 -0.2185 51 GLY D CA 5048 C C . GLY D 51 ? 0.9864 0.6293 1.1784 0.0709 -0.3983 -0.2559 51 GLY D C 5049 O O . GLY D 51 ? 0.9552 0.6413 1.1241 0.1061 -0.3743 -0.2868 51 GLY D O 5050 N N . ALA D 52 ? 1.0650 0.6277 1.2808 0.0653 -0.4480 -0.2533 52 ALA D N 5051 C CA . ALA D 52 ? 1.1215 0.6384 1.3419 0.1078 -0.4812 -0.2911 52 ALA D CA 5052 C C . ALA D 52 ? 1.1347 0.6796 1.3454 0.1565 -0.4855 -0.3645 52 ALA D C 5053 O O . ALA D 52 ? 1.1779 0.6988 1.3976 0.1588 -0.5159 -0.3970 52 ALA D O 5054 C CB . ALA D 52 ? 1.2164 0.6280 1.4674 0.0908 -0.5447 -0.2751 52 ALA D CB 5055 N N . GLY D 53 ? 1.1019 0.7048 1.2937 0.1925 -0.4543 -0.3908 53 GLY D N 5056 C CA . GLY D 53 ? 1.1126 0.7659 1.2882 0.2360 -0.4477 -0.4585 53 GLY D CA 5057 C C . GLY D 53 ? 1.0437 0.7913 1.1803 0.2305 -0.3892 -0.4527 53 GLY D C 5058 O O . GLY D 53 ? 1.0405 0.8502 1.1557 0.2619 -0.3695 -0.4966 53 GLY D O 5059 N N . SER D 54 ? 0.9955 0.7558 1.1242 0.1900 -0.3629 -0.3986 54 SER D N 5060 C CA . SER D 54 ? 0.9400 0.7739 1.0346 0.1818 -0.3157 -0.3866 54 SER D CA 5061 C C . SER D 54 ? 0.8837 0.7614 0.9672 0.1792 -0.2722 -0.3596 54 SER D C 5062 O O . SER D 54 ? 0.8697 0.7224 0.9711 0.1657 -0.2718 -0.3269 54 SER D O 5063 C CB . SER D 54 ? 0.9228 0.7514 1.0211 0.1455 -0.3144 -0.3507 54 SER D CB 5064 O OG . SER D 54 ? 0.8794 0.7681 0.9473 0.1401 -0.2762 -0.3369 54 SER D OG 5065 N N . THR D 55 ? 0.8589 0.8027 0.9104 0.1894 -0.2379 -0.3727 55 THR D N 5066 C CA . THR D 55 ? 0.8088 0.7980 0.8488 0.1826 -0.1963 -0.3484 55 THR D CA 5067 C C . THR D 55 ? 0.7921 0.8381 0.7927 0.1765 -0.1652 -0.3459 55 THR D C 5068 O O . THR D 55 ? 0.8249 0.9064 0.8004 0.1940 -0.1656 -0.3823 55 THR D O 5069 C CB . THR D 55 ? 0.8151 0.8238 0.8683 0.2092 -0.1943 -0.3749 55 THR D CB 5070 O OG1 . THR D 55 ? 0.7727 0.8405 0.8106 0.2016 -0.1523 -0.3602 55 THR D OG1 5071 C CG2 . THR D 55 ? 0.8676 0.8956 0.9199 0.2466 -0.2138 -0.4381 55 THR D CG2 5072 N N . GLU D 56 ? 0.7505 0.8045 0.7444 0.1515 -0.1410 -0.3033 56 GLU D N 5073 C CA . GLU D 56 ? 0.7460 0.8375 0.7029 0.1419 -0.1194 -0.2913 56 GLU D CA 5074 C C . GLU D 56 ? 0.7091 0.8256 0.6597 0.1270 -0.0856 -0.2617 56 GLU D C 5075 O O . GLU D 56 ? 0.6776 0.7761 0.6541 0.1178 -0.0796 -0.2408 56 GLU D O 5076 C CB . GLU D 56 ? 0.7503 0.8179 0.7063 0.1281 -0.1354 -0.2724 56 GLU D CB 5077 C CG . GLU D 56 ? 0.7949 0.8371 0.7582 0.1378 -0.1723 -0.3013 56 GLU D CG 5078 C CD . GLU D 56 ? 0.8484 0.9240 0.7710 0.1570 -0.1783 -0.3408 56 GLU D CD 5079 O OE1 . GLU D 56 ? 0.8526 0.9753 0.7348 0.1558 -0.1523 -0.3356 56 GLU D OE1 5080 O OE2 . GLU D 56 ? 0.8875 0.9433 0.8174 0.1713 -0.2104 -0.3773 56 GLU D OE2 5081 N N . LYS D 57 ? 0.7209 0.8793 0.6348 0.1222 -0.0654 -0.2593 57 LYS D N 5082 C CA . LYS D 57 ? 0.6995 0.8775 0.6061 0.1039 -0.0371 -0.2309 57 LYS D CA 5083 C C . LYS D 57 ? 0.6833 0.8267 0.5959 0.0867 -0.0389 -0.1933 57 LYS D C 5084 O O . LYS D 57 ? 0.7024 0.8291 0.6034 0.0855 -0.0551 -0.1853 57 LYS D O 5085 C CB . LYS D 57 ? 0.7304 0.9627 0.5934 0.0969 -0.0176 -0.2342 57 LYS D CB 5086 C CG . LYS D 57 ? 0.7452 1.0343 0.6082 0.1145 -0.0080 -0.2764 57 LYS D CG 5087 C CD . LYS D 57 ? 0.7803 1.1378 0.5966 0.1002 0.0163 -0.2754 57 LYS D CD 5088 C CE . LYS D 57 ? 0.7950 1.2278 0.6189 0.1190 0.0302 -0.3234 57 LYS D CE 5089 N NZ . LYS D 57 ? 0.8305 1.3452 0.6117 0.0958 0.0618 -0.3163 57 LYS D NZ 5090 N N . GLY D 58 ? 0.6522 0.7883 0.5858 0.0763 -0.0246 -0.1750 58 GLY D N 5091 C CA . GLY D 58 ? 0.6399 0.7502 0.5833 0.0642 -0.0248 -0.1470 58 GLY D CA 5092 C C . GLY D 58 ? 0.6617 0.7790 0.5783 0.0488 -0.0123 -0.1254 58 GLY D C 5093 O O . GLY D 58 ? 0.6952 0.8366 0.5742 0.0440 -0.0082 -0.1253 58 GLY D O 5094 N N . ASP D 59 ? 0.6499 0.7467 0.5846 0.0395 -0.0077 -0.1075 59 ASP D N 5095 C CA . ASP D 59 ? 0.6815 0.7697 0.5963 0.0215 -0.0021 -0.0831 59 ASP D CA 5096 C C . ASP D 59 ? 0.6818 0.8022 0.5901 0.0055 0.0203 -0.0844 59 ASP D C 5097 O O . ASP D 59 ? 0.7219 0.8514 0.6008 -0.0154 0.0268 -0.0645 59 ASP D O 5098 C CB . ASP D 59 ? 0.6784 0.7282 0.6206 0.0214 -0.0113 -0.0703 59 ASP D CB 5099 C CG . ASP D 59 ? 0.6944 0.7230 0.6460 0.0356 -0.0344 -0.0677 59 ASP D CG 5100 O OD1 . ASP D 59 ? 0.6738 0.6971 0.6641 0.0460 -0.0382 -0.0774 59 ASP D OD1 5101 O OD2 . ASP D 59 ? 0.7394 0.7640 0.6599 0.0358 -0.0487 -0.0571 59 ASP D OD2 5102 N N . ILE D 60 ? 0.6427 0.7829 0.5788 0.0131 0.0303 -0.1054 60 ILE D N 5103 C CA . ILE D 60 ? 0.6377 0.8180 0.5780 0.0007 0.0497 -0.1121 60 ILE D CA 5104 C C . ILE D 60 ? 0.6181 0.8396 0.5708 0.0198 0.0537 -0.1445 60 ILE D C 5105 O O . ILE D 60 ? 0.5913 0.8160 0.5733 0.0280 0.0536 -0.1571 60 ILE D O 5106 C CB . ILE D 60 ? 0.6207 0.7839 0.5888 -0.0113 0.0542 -0.1050 60 ILE D CB 5107 C CG1 . ILE D 60 ? 0.5820 0.7204 0.5778 0.0063 0.0444 -0.1156 60 ILE D CG1 5108 C CG2 . ILE D 60 ? 0.6577 0.7850 0.6137 -0.0335 0.0494 -0.0759 60 ILE D CG2 5109 C CD1 . ILE D 60 ? 0.5508 0.6986 0.5716 0.0022 0.0509 -0.1246 60 ILE D CD1 5110 N N . PRO D 61 ? 0.6396 0.8925 0.5691 0.0289 0.0538 -0.1602 61 PRO D N 5111 C CA . PRO D 61 ? 0.6295 0.9145 0.5761 0.0538 0.0506 -0.1974 61 PRO D CA 5112 C C . PRO D 61 ? 0.6311 0.9874 0.5885 0.0508 0.0709 -0.2172 61 PRO D C 5113 O O . PRO D 61 ? 0.6222 1.0027 0.6061 0.0755 0.0646 -0.2503 61 PRO D O 5114 C CB . PRO D 61 ? 0.6586 0.9452 0.5776 0.0683 0.0381 -0.2126 61 PRO D CB 5115 C CG . PRO D 61 ? 0.6922 0.9843 0.5686 0.0443 0.0467 -0.1842 61 PRO D CG 5116 C CD . PRO D 61 ? 0.6822 0.9399 0.5681 0.0203 0.0521 -0.1475 61 PRO D CD 5117 N N . ASP D 62 ? 0.6471 1.0365 0.5880 0.0200 0.0921 -0.1967 62 ASP D N 5118 C CA . ASP D 62 ? 0.6539 1.1274 0.6066 0.0098 0.1153 -0.2139 62 ASP D CA 5119 C C . ASP D 62 ? 0.6170 1.1072 0.6202 0.0211 0.1140 -0.2332 62 ASP D C 5120 O O . ASP D 62 ? 0.5968 1.0454 0.6170 0.0094 0.1090 -0.2137 62 ASP D O 5121 C CB . ASP D 62 ? 0.6878 1.1831 0.6139 -0.0358 0.1357 -0.1773 62 ASP D CB 5122 C CG . ASP D 62 ? 0.7436 1.2680 0.6146 -0.0476 0.1432 -0.1676 62 ASP D CG 5123 O OD1 . ASP D 62 ? 0.7882 1.3556 0.6341 -0.0869 0.1632 -0.1419 62 ASP D OD1 5124 O OD2 . ASP D 62 ? 0.7536 1.2594 0.6043 -0.0207 0.1279 -0.1841 62 ASP D OD2 5125 N N . GLY D 63 ? 0.6157 1.1697 0.6429 0.0466 0.1158 -0.2752 63 GLY D N 5126 C CA . GLY D 63 ? 0.5875 1.1630 0.6641 0.0635 0.1084 -0.2977 63 GLY D CA 5127 C C . GLY D 63 ? 0.5741 1.0877 0.6672 0.1004 0.0754 -0.3114 63 GLY D C 5128 O O . GLY D 63 ? 0.5618 1.0859 0.6917 0.1198 0.0615 -0.3297 63 GLY D O 5129 N N . TYR D 64 ? 0.5817 1.0314 0.6480 0.1074 0.0603 -0.3001 65 TYR D N 5130 C CA . TYR D 64 ? 0.5791 0.9636 0.6572 0.1326 0.0281 -0.3042 65 TYR D CA 5131 C C . TYR D 64 ? 0.6103 0.9836 0.6792 0.1595 0.0096 -0.3322 65 TYR D C 5132 O O . TYR D 64 ? 0.6295 1.0141 0.6666 0.1517 0.0196 -0.3319 65 TYR D O 5133 C CB . TYR D 64 ? 0.5636 0.8779 0.6265 0.1127 0.0230 -0.2641 65 TYR D CB 5134 C CG . TYR D 64 ? 0.5405 0.8542 0.6110 0.0889 0.0360 -0.2406 65 TYR D CG 5135 C CD1 . TYR D 64 ? 0.5294 0.8297 0.6215 0.0954 0.0230 -0.2397 65 TYR D CD1 5136 C CD2 . TYR D 64 ? 0.5410 0.8623 0.5949 0.0596 0.0568 -0.2189 65 TYR D CD2 5137 C CE1 . TYR D 64 ? 0.5147 0.8167 0.6122 0.0751 0.0327 -0.2243 65 TYR D CE1 5138 C CE2 . TYR D 64 ? 0.5313 0.8455 0.5955 0.0393 0.0639 -0.2029 65 TYR D CE2 5139 C CZ . TYR D 64 ? 0.5154 0.8232 0.6016 0.0481 0.0529 -0.2088 65 TYR D CZ 5140 O OH . TYR D 64 ? 0.5082 0.8119 0.6033 0.0297 0.0579 -0.1991 65 TYR D OH 5141 N N . LYS D 65 ? 0.6239 0.9706 0.7196 0.1910 -0.0215 -0.3562 66 LYS D N 5142 C CA . LYS D 65 ? 0.6576 0.9682 0.7500 0.2162 -0.0499 -0.3811 66 LYS D CA 5143 C C . LYS D 65 ? 0.6604 0.8804 0.7586 0.2131 -0.0816 -0.3536 66 LYS D C 5144 O O . LYS D 65 ? 0.6422 0.8395 0.7510 0.2019 -0.0846 -0.3263 66 LYS D O 5145 C CB . LYS D 65 ? 0.6899 1.0432 0.8130 0.2581 -0.0665 -0.4384 66 LYS D CB 5146 C CG . LYS D 65 ? 0.7082 1.1565 0.8185 0.2648 -0.0387 -0.4766 66 LYS D CG 5147 C CD . LYS D 65 ? 0.7527 1.2450 0.9003 0.3141 -0.0595 -0.5436 66 LYS D CD 5148 C CE . LYS D 65 ? 0.7835 1.3756 0.9117 0.3228 -0.0329 -0.5884 66 LYS D CE 5149 N N . ALA D 66 ? 0.6881 0.8615 0.7779 0.2201 -0.1053 -0.3606 67 ALA D N 5150 C CA . ALA D 66 ? 0.6991 0.7920 0.7961 0.2113 -0.1360 -0.3333 67 ALA D CA 5151 C C . ALA D 66 ? 0.7542 0.8009 0.8679 0.2388 -0.1800 -0.3660 67 ALA D C 5152 O O . ALA D 66 ? 0.7811 0.8570 0.8918 0.2625 -0.1833 -0.4109 67 ALA D O 5153 C CB . ALA D 66 ? 0.6777 0.7509 0.7520 0.1793 -0.1219 -0.2971 67 ALA D CB 5154 N N . SER D 67 ? 0.7791 0.7537 0.9088 0.2339 -0.2152 -0.3434 68 SER D N 5155 C CA . SER D 67 ? 0.8438 0.7557 0.9942 0.2568 -0.2662 -0.3695 68 SER D CA 5156 C C . SER D 67 ? 0.8687 0.6988 1.0218 0.2260 -0.2952 -0.3237 68 SER D C 5157 O O . SER D 67 ? 0.8578 0.6715 1.0085 0.2024 -0.2919 -0.2786 68 SER D O 5158 C CB . SER D 67 ? 0.8778 0.7897 1.0590 0.2971 -0.2939 -0.4036 68 SER D CB 5159 O OG . SER D 67 ? 0.9552 0.7917 1.1601 0.3206 -0.3511 -0.4276 68 SER D OG 5160 N N . ARG D 68 ? 0.9063 0.6915 1.0639 0.2239 -0.3234 -0.3365 69 ARG D N 5161 C CA . ARG D 68 ? 0.9385 0.6506 1.1040 0.1896 -0.3531 -0.2949 69 ARG D CA 5162 C C . ARG D 68 ? 1.0280 0.6582 1.2203 0.2107 -0.4165 -0.3228 69 ARG D C 5163 O O . ARG D 68 ? 1.0583 0.6681 1.2562 0.2155 -0.4367 -0.3527 69 ARG D O 5164 C CB . ARG D 68 ? 0.9057 0.6380 1.0575 0.1576 -0.3302 -0.2774 69 ARG D CB 5165 C CG . ARG D 68 ? 0.9263 0.6078 1.0895 0.1132 -0.3496 -0.2297 69 ARG D CG 5166 C CD . ARG D 68 ? 0.8664 0.5835 1.0179 0.0788 -0.3123 -0.1778 69 ARG D CD 5167 N NE . ARG D 68 ? 0.8881 0.5724 1.0514 0.0332 -0.3272 -0.1324 69 ARG D NE 5168 C CZ . ARG D 68 ? 0.8678 0.5748 1.0394 0.0048 -0.3154 -0.1200 69 ARG D CZ 5169 N NH1 . ARG D 68 ? 0.8217 0.5747 0.9873 0.0192 -0.2928 -0.1474 69 ARG D NH1 5170 N NH2 . ARG D 68 ? 0.8979 0.5856 1.0845 -0.0399 -0.3276 -0.0783 69 ARG D NH2 5171 N N . PRO D 69 ? 1.0765 0.6560 1.2863 0.2251 -0.4528 -0.3148 70 PRO D N 5172 C CA . PRO D 69 ? 1.1745 0.6631 1.4143 0.2488 -0.5215 -0.3414 70 PRO D CA 5173 C C . PRO D 69 ? 1.2309 0.6330 1.4772 0.2023 -0.5583 -0.2967 70 PRO D C 5174 O O . PRO D 69 ? 1.3091 0.6393 1.5793 0.2144 -0.6114 -0.3260 70 PRO D O 5175 C CB . PRO D 69 ? 1.2056 0.6685 1.4588 0.2724 -0.5476 -0.3325 70 PRO D CB 5176 C CG . PRO D 69 ? 1.1178 0.6748 1.3492 0.2680 -0.4876 -0.3167 70 PRO D CG 5177 C CD . PRO D 69 ? 1.0502 0.6514 1.2530 0.2222 -0.4367 -0.2824 70 PRO D CD 5178 N N . SER D 70 ? 1.1962 0.6108 1.4241 0.1488 -0.5303 -0.2293 71 SER D N 5179 C CA . SER D 70 ? 1.2474 0.5979 1.4824 0.0948 -0.5577 -0.1784 71 SER D CA 5180 C C . SER D 70 ? 1.1741 0.5944 1.3905 0.0459 -0.5023 -0.1347 71 SER D C 5181 O O . SER D 70 ? 1.0906 0.5944 1.2868 0.0550 -0.4481 -0.1396 71 SER D O 5182 C CB . SER D 70 ? 1.3289 0.5961 1.5671 0.0777 -0.6046 -0.1292 71 SER D CB 5183 O OG . SER D 70 ? 1.2840 0.6008 1.4957 0.0713 -0.5695 -0.0935 71 SER D OG 5184 N N . GLN D 71 ? 1.2119 0.5983 1.4396 -0.0058 -0.5188 -0.0940 72 GLN D N 5185 C CA . GLN D 71 ? 1.1546 0.6094 1.3745 -0.0535 -0.4720 -0.0538 72 GLN D CA 5186 C C . GLN D 71 ? 1.1172 0.6189 1.3099 -0.0710 -0.4345 -0.0090 72 GLN D C 5187 O O . GLN D 71 ? 1.0427 0.6276 1.2237 -0.0817 -0.3817 -0.0018 72 GLN D O 5188 C CB . GLN D 71 ? 1.2177 0.6270 1.4625 -0.1091 -0.5038 -0.0179 72 GLN D CB 5189 C CG . GLN D 71 ? 1.1670 0.6566 1.4156 -0.1585 -0.4590 0.0173 72 GLN D CG 5190 C CD . GLN D 71 ? 1.1141 0.6589 1.3776 -0.1450 -0.4381 -0.0241 72 GLN D CD 5191 O OE1 . GLN D 71 ? 1.0941 0.6396 1.3507 -0.0962 -0.4403 -0.0780 72 GLN D OE1 5192 N NE2 . GLN D 71 ? 1.0933 0.6914 1.3771 -0.1891 -0.4181 0.0011 72 GLN D NE2 5193 N N . GLU D 72 ? 1.1768 0.6226 1.3596 -0.0709 -0.4662 0.0178 73 GLU D N 5194 C CA . GLU D 72 ? 1.1609 0.6429 1.3134 -0.0910 -0.4402 0.0633 73 GLU D CA 5195 C C . GLU D 72 ? 1.0893 0.6311 1.2242 -0.0462 -0.4042 0.0313 73 GLU D C 5196 O O . GLU D 72 ? 1.0393 0.6478 1.1516 -0.0616 -0.3610 0.0524 73 GLU D O 5197 C CB . GLU D 72 ? 1.2664 0.6607 1.4104 -0.1123 -0.4946 0.1115 73 GLU D CB 5198 C CG . GLU D 72 ? 1.3455 0.6872 1.5011 -0.1749 -0.5258 0.1623 73 GLU D CG 5199 N N . ASN D 73 ? 1.0884 0.6116 1.2362 0.0075 -0.4222 -0.0219 74 ASN D N 5200 C CA . ASN D 73 ? 1.0324 0.6104 1.1698 0.0473 -0.3944 -0.0515 74 ASN D CA 5201 C C . ASN D 73 ? 0.9565 0.6013 1.0978 0.0764 -0.3547 -0.1032 74 ASN D C 5202 O O . ASN D 73 ? 0.9702 0.5993 1.1272 0.0973 -0.3701 -0.1430 74 ASN D O 5203 C CB . ASN D 73 ? 1.0943 0.6176 1.2433 0.0870 -0.4431 -0.0694 74 ASN D CB 5204 C CG . ASN D 73 ? 1.1563 0.6376 1.2865 0.0626 -0.4708 -0.0122 74 ASN D CG 5205 O OD1 . ASN D 73 ? 1.2517 0.6423 1.3917 0.0615 -0.5311 0.0059 74 ASN D OD1 5206 N ND2 . ASN D 73 ? 1.1100 0.6541 1.2110 0.0429 -0.4302 0.0162 74 ASN D ND2 5207 N N . PHE D 74 ? 0.8849 0.6025 1.0092 0.0759 -0.3062 -0.1012 75 PHE D N 5208 C CA . PHE D 74 ? 0.8203 0.6008 0.9427 0.0997 -0.2689 -0.1415 75 PHE D CA 5209 C C . PHE D 74 ? 0.7852 0.6120 0.9008 0.1190 -0.2477 -0.1512 75 PHE D C 5210 O O . PHE D 74 ? 0.7692 0.6129 0.8710 0.0994 -0.2329 -0.1197 75 PHE D O 5211 C CB . PHE D 74 ? 0.7715 0.5929 0.8848 0.0716 -0.2314 -0.1268 75 PHE D CB 5212 C CG . PHE D 74 ? 0.7267 0.5963 0.8344 0.0907 -0.2028 -0.1614 75 PHE D CG 5213 C CD1 . PHE D 74 ? 0.7439 0.6107 0.8561 0.1230 -0.2174 -0.2055 75 PHE D CD1 5214 C CD2 . PHE D 74 ? 0.6747 0.5926 0.7711 0.0756 -0.1635 -0.1495 75 PHE D CD2 5215 C CE1 . PHE D 74 ? 0.7165 0.6326 0.8149 0.1346 -0.1904 -0.2310 75 PHE D CE1 5216 C CE2 . PHE D 74 ? 0.6456 0.5998 0.7319 0.0885 -0.1418 -0.1728 75 PHE D CE2 5217 C CZ . PHE D 74 ? 0.6716 0.6270 0.7553 0.1152 -0.1538 -0.2103 75 PHE D CZ 5218 N N . SER D 75 ? 0.7770 0.6305 0.9036 0.1562 -0.2466 -0.1973 76 SER D N 5219 C CA . SER D 75 ? 0.7536 0.6534 0.8840 0.1758 -0.2331 -0.2116 76 SER D CA 5220 C C . SER D 75 ? 0.6976 0.6727 0.8229 0.1817 -0.1886 -0.2376 76 SER D C 5221 O O . SER D 75 ? 0.6939 0.6858 0.8170 0.1908 -0.1800 -0.2642 76 SER D O 5222 C CB . SER D 75 ? 0.8056 0.6794 0.9624 0.2156 -0.2765 -0.2429 76 SER D CB 5223 O OG . SER D 75 ? 0.8670 0.6688 1.0245 0.2067 -0.3201 -0.2082 76 SER D OG 5224 N N . LEU D 76 ? 0.6619 0.6809 0.7830 0.1737 -0.1631 -0.2278 77 LEU D N 5225 C CA . LEU D 76 ? 0.6194 0.7063 0.7379 0.1737 -0.1245 -0.2466 77 LEU D CA 5226 C C . LEU D 76 ? 0.6241 0.7566 0.7674 0.2005 -0.1290 -0.2782 77 LEU D C 5227 O O . LEU D 76 ? 0.6297 0.7595 0.7828 0.2035 -0.1428 -0.2683 77 LEU D O 5228 C CB . LEU D 76 ? 0.5787 0.6823 0.6801 0.1422 -0.0934 -0.2157 77 LEU D CB 5229 C CG . LEU D 76 ? 0.5464 0.7023 0.6413 0.1322 -0.0567 -0.2241 77 LEU D CG 5230 C CD1 . LEU D 76 ? 0.5445 0.6993 0.6246 0.1299 -0.0477 -0.2304 77 LEU D CD1 5231 C CD2 . LEU D 76 ? 0.5198 0.6806 0.6053 0.1067 -0.0366 -0.1987 77 LEU D CD2 5232 N N . ILE D 77 ? 0.6275 0.8091 0.7808 0.2197 -0.1179 -0.3177 78 ILE D N 5233 C CA . ILE D 77 ? 0.6378 0.8781 0.8237 0.2492 -0.1222 -0.3574 78 ILE D CA 5234 C C . ILE D 77 ? 0.6045 0.9318 0.7899 0.2324 -0.0777 -0.3657 78 ILE D C 5235 O O . ILE D 77 ? 0.5960 0.9491 0.7584 0.2167 -0.0503 -0.3661 78 ILE D O 5236 C CB . ILE D 77 ? 0.6814 0.9216 0.8879 0.2905 -0.1497 -0.4070 78 ILE D CB 5237 C CG1 . ILE D 77 ? 0.7291 0.8701 0.9391 0.3027 -0.2006 -0.3950 78 ILE D CG1 5238 C CG2 . ILE D 77 ? 0.6914 1.0061 0.9405 0.3256 -0.1539 -0.4547 78 ILE D CG2 5239 C CD1 . ILE D 77 ? 0.7832 0.9017 1.0061 0.3364 -0.2302 -0.4406 78 ILE D CD1 5240 N N . LEU D 78 ? 0.5940 0.9640 0.8041 0.2330 -0.0741 -0.3692 79 LEU D N 5241 C CA . LEU D 78 ? 0.5720 1.0279 0.7915 0.2142 -0.0368 -0.3778 79 LEU D CA 5242 C C . LEU D 78 ? 0.5900 1.1277 0.8557 0.2478 -0.0426 -0.4291 79 LEU D C 5243 O O . LEU D 78 ? 0.5961 1.1436 0.8963 0.2673 -0.0662 -0.4400 79 LEU D O 5244 C CB . LEU D 78 ? 0.5453 0.9948 0.7628 0.1850 -0.0280 -0.3457 79 LEU D CB 5245 C CG . LEU D 78 ? 0.5297 0.9237 0.7094 0.1500 -0.0142 -0.3024 79 LEU D CG 5246 C CD1 . LEU D 78 ? 0.5435 0.8558 0.7036 0.1560 -0.0407 -0.2796 79 LEU D CD1 5247 C CD2 . LEU D 78 ? 0.5083 0.9223 0.6949 0.1252 -0.0021 -0.2883 79 LEU D CD2 5248 N N . GLU D 79 ? 0.6058 1.2077 0.8721 0.2562 -0.0226 -0.4627 80 GLU D N 5249 C CA . GLU D 79 ? 0.6278 1.3231 0.9420 0.2929 -0.0256 -0.5215 80 GLU D CA 5250 C C . GLU D 79 ? 0.6060 1.3952 0.9567 0.2756 -0.0026 -0.5269 80 GLU D C 5251 O O . GLU D 79 ? 0.6153 1.4393 1.0171 0.3068 -0.0263 -0.5566 80 GLU D O 5252 C CB . GLU D 79 ? 0.6504 1.4051 0.9494 0.3024 -0.0046 -0.5580 80 GLU D CB 5253 C CG . GLU D 79 ? 0.6897 1.3735 0.9769 0.3389 -0.0401 -0.5811 80 GLU D CG 5254 N N . LEU D 80 ? 0.5861 1.4129 0.9128 0.2254 0.0392 -0.4976 81 LEU D N 5255 C CA . LEU D 80 ? 0.5696 1.4813 0.9296 0.1976 0.0623 -0.4968 81 LEU D CA 5256 C C . LEU D 80 ? 0.5488 1.3967 0.8793 0.1500 0.0712 -0.4409 81 LEU D C 5257 O O . LEU D 80 ? 0.5514 1.3975 0.8470 0.1076 0.1005 -0.4107 81 LEU D O 5258 C CB . LEU D 80 ? 0.5813 1.6174 0.9476 0.1776 0.1050 -0.5198 81 LEU D CB 5259 C CG . LEU D 80 ? 0.6039 1.7433 1.0144 0.2254 0.1025 -0.5892 81 LEU D CG 5260 N N . ALA D 81 ? 0.5377 1.3320 0.8809 0.1589 0.0425 -0.4287 82 ALA D N 5261 C CA . ALA D 81 ? 0.5211 1.2509 0.8376 0.1227 0.0450 -0.3846 82 ALA D CA 5262 C C . ALA D 81 ? 0.5135 1.3013 0.8418 0.0749 0.0756 -0.3729 82 ALA D C 5263 O O . ALA D 81 ? 0.5148 1.3985 0.8889 0.0716 0.0851 -0.3992 82 ALA D O 5264 C CB . ALA D 81 ? 0.5205 1.2035 0.8484 0.1431 0.0084 -0.3806 82 ALA D CB 5265 N N . THR D 82 ? 0.5116 1.2406 0.8023 0.0378 0.0883 -0.3344 83 THR D N 5266 C CA . THR D 82 ? 0.5165 1.2741 0.8148 -0.0119 0.1098 -0.3164 83 THR D CA 5267 C C . THR D 82 ? 0.5101 1.1940 0.7986 -0.0265 0.0943 -0.2948 83 THR D C 5268 O O . THR D 82 ? 0.5041 1.1131 0.7649 -0.0062 0.0768 -0.2844 83 THR D O 5269 C CB . THR D 82 ? 0.5383 1.2938 0.7999 -0.0464 0.1372 -0.2904 83 THR D CB 5270 O OG1 . THR D 82 ? 0.5399 1.2022 0.7543 -0.0357 0.1277 -0.2679 83 THR D OG1 5271 C CG2 . THR D 82 ? 0.5533 1.4061 0.8236 -0.0395 0.1584 -0.3156 83 THR D CG2 5272 N N . PRO D 83 ? 0.5173 1.2273 0.8300 -0.0630 0.1001 -0.2906 84 PRO D N 5273 C CA . PRO D 83 ? 0.5187 1.1650 0.8238 -0.0758 0.0843 -0.2786 84 PRO D CA 5274 C C . PRO D 83 ? 0.5278 1.0809 0.7871 -0.0840 0.0849 -0.2500 84 PRO D C 5275 O O . PRO D 83 ? 0.5262 1.0241 0.7718 -0.0748 0.0689 -0.2480 84 PRO D O 5276 C CB . PRO D 83 ? 0.5361 1.2311 0.8774 -0.1208 0.0933 -0.2796 84 PRO D CB 5277 C CG . PRO D 83 ? 0.5315 1.3369 0.9139 -0.1183 0.1070 -0.3029 84 PRO D CG 5278 C CD . PRO D 83 ? 0.5287 1.3381 0.8829 -0.0936 0.1197 -0.3022 84 PRO D CD 5279 N N . SER D 84 ? 0.5420 1.0846 0.7779 -0.0999 0.1021 -0.2299 85 SER D N 5280 C CA . SER D 84 ? 0.5528 1.0121 0.7501 -0.1040 0.0994 -0.2041 85 SER D CA 5281 C C . SER D 84 ? 0.5317 0.9474 0.7056 -0.0644 0.0870 -0.2073 85 SER D C 5282 O O . SER D 84 ? 0.5369 0.8891 0.6885 -0.0620 0.0806 -0.1931 85 SER D O 5283 C CB . SER D 84 ? 0.5814 1.0454 0.7558 -0.1299 0.1169 -0.1797 85 SER D CB 5284 O OG . SER D 84 ? 0.5709 1.0822 0.7352 -0.1080 0.1272 -0.1912 85 SER D OG 5285 N N . GLN D 85 ? 0.5135 0.9647 0.6968 -0.0340 0.0813 -0.2268 86 GLN D N 5286 C CA . GLN D 85 ? 0.5026 0.9122 0.6671 -0.0015 0.0659 -0.2271 86 GLN D CA 5287 C C . GLN D 85 ? 0.4971 0.8838 0.6642 0.0093 0.0471 -0.2304 86 GLN D C 5288 O O . GLN D 85 ? 0.4956 0.8576 0.6508 0.0322 0.0314 -0.2288 86 GLN D O 5289 C CB . GLN D 85 ? 0.5010 0.9461 0.6732 0.0267 0.0618 -0.2460 86 GLN D CB 5290 C CG . GLN D 85 ? 0.5106 0.9775 0.6674 0.0199 0.0798 -0.2445 86 GLN D CG 5291 C CD . GLN D 85 ? 0.5105 1.0232 0.6803 0.0514 0.0750 -0.2750 86 GLN D CD 5292 O OE1 . GLN D 85 ? 0.5014 1.0690 0.7072 0.0672 0.0690 -0.3018 86 GLN D OE1 5293 N NE2 . GLN D 85 ? 0.5234 1.0153 0.6672 0.0632 0.0744 -0.2751 86 GLN D NE2 5294 N N . THR D 86 ? 0.5034 0.8993 0.6840 -0.0101 0.0472 -0.2342 87 THR D N 5295 C CA . THR D 86 ? 0.5059 0.8821 0.6800 -0.0048 0.0318 -0.2377 87 THR D CA 5296 C C . THR D 86 ? 0.5133 0.8336 0.6603 -0.0087 0.0355 -0.2235 87 THR D C 5297 O O . THR D 86 ? 0.5259 0.8243 0.6738 -0.0278 0.0444 -0.2181 87 THR D O 5298 C CB . THR D 86 ? 0.5145 0.9209 0.7139 -0.0249 0.0289 -0.2526 87 THR D CB 5299 O OG1 . THR D 86 ? 0.5053 0.9766 0.7386 -0.0212 0.0262 -0.2686 87 THR D OG1 5300 C CG2 . THR D 86 ? 0.5203 0.9118 0.7059 -0.0184 0.0123 -0.2604 87 THR D CG2 5301 N N . SER D 87 ? 0.5118 0.8107 0.6374 0.0085 0.0263 -0.2168 88 SER D N 5302 C CA . SER D 87 ? 0.5141 0.7751 0.6196 0.0080 0.0306 -0.2067 88 SER D CA 5303 C C . SER D 87 ? 0.5167 0.7739 0.6015 0.0204 0.0198 -0.1992 88 SER D C 5304 O O . SER D 87 ? 0.5244 0.7979 0.6071 0.0291 0.0051 -0.1992 88 SER D O 5305 C CB . SER D 87 ? 0.5112 0.7487 0.6123 0.0079 0.0396 -0.1933 88 SER D CB 5306 O OG . SER D 87 ? 0.5192 0.7261 0.6106 0.0077 0.0424 -0.1871 88 SER D OG 5307 N N . VAL D 88 ? 0.5161 0.7543 0.5867 0.0195 0.0254 -0.1915 89 VAL D N 5308 C CA . VAL D 88 ? 0.5225 0.7593 0.5723 0.0234 0.0185 -0.1767 89 VAL D CA 5309 C C . VAL D 88 ? 0.5158 0.7279 0.5668 0.0270 0.0194 -0.1612 89 VAL D C 5310 O O . VAL D 88 ? 0.5081 0.7076 0.5670 0.0252 0.0297 -0.1629 89 VAL D O 5311 C CB . VAL D 88 ? 0.5331 0.7850 0.5690 0.0173 0.0262 -0.1831 89 VAL D CB 5312 C CG1 . VAL D 88 ? 0.5516 0.8142 0.5610 0.0132 0.0195 -0.1623 89 VAL D CG1 5313 C CG2 . VAL D 88 ? 0.5424 0.8154 0.5798 0.0144 0.0249 -0.2073 89 VAL D CG2 5314 N N . TYR D 89 ? 0.5258 0.7270 0.5699 0.0329 0.0038 -0.1470 90 TYR D N 5315 C CA . TYR D 89 ? 0.5236 0.6993 0.5711 0.0368 -0.0005 -0.1368 90 TYR D CA 5316 C C . TYR D 89 ? 0.5412 0.7070 0.5766 0.0262 -0.0053 -0.1157 90 TYR D C 5317 O O . TYR D 89 ? 0.5671 0.7357 0.5863 0.0194 -0.0171 -0.1005 90 TYR D O 5318 C CB . TYR D 89 ? 0.5300 0.6964 0.5861 0.0524 -0.0181 -0.1421 90 TYR D CB 5319 C CG . TYR D 89 ? 0.5117 0.7023 0.5836 0.0587 -0.0078 -0.1632 90 TYR D CG 5320 C CD1 . TYR D 89 ? 0.5080 0.7288 0.5896 0.0592 -0.0083 -0.1754 90 TYR D CD1 5321 C CD2 . TYR D 89 ? 0.5020 0.6916 0.5782 0.0605 0.0021 -0.1696 90 TYR D CD2 5322 C CE1 . TYR D 89 ? 0.4928 0.7452 0.5931 0.0582 0.0029 -0.1927 90 TYR D CE1 5323 C CE2 . TYR D 89 ? 0.4935 0.7144 0.5805 0.0592 0.0143 -0.1843 90 TYR D CE2 5324 C CZ . TYR D 89 ? 0.4886 0.7424 0.5902 0.0564 0.0157 -0.1953 90 TYR D CZ 5325 O OH . TYR D 89 ? 0.4836 0.7772 0.6000 0.0489 0.0295 -0.2078 90 TYR D OH 5326 N N . PHE D 90 ? 0.5323 0.6903 0.5756 0.0223 0.0025 -0.1127 91 PHE D N 5327 C CA . PHE D 90 ? 0.5466 0.7052 0.5867 0.0079 0.0003 -0.0936 91 PHE D CA 5328 C C . PHE D 90 ? 0.5568 0.6831 0.6064 0.0095 -0.0151 -0.0856 91 PHE D C 5329 O O . PHE D 90 ? 0.5432 0.6589 0.6026 0.0209 -0.0134 -0.0990 91 PHE D O 5330 C CB . PHE D 90 ? 0.5318 0.7213 0.5814 0.0020 0.0211 -0.1021 91 PHE D CB 5331 C CG . PHE D 90 ? 0.5319 0.7580 0.5705 -0.0020 0.0337 -0.1121 91 PHE D CG 5332 C CD1 . PHE D 90 ? 0.5151 0.7474 0.5615 0.0085 0.0430 -0.1374 91 PHE D CD1 5333 C CD2 . PHE D 90 ? 0.5562 0.8105 0.5743 -0.0187 0.0342 -0.0960 91 PHE D CD2 5334 C CE1 . PHE D 90 ? 0.5236 0.7891 0.5608 0.0068 0.0514 -0.1535 91 PHE D CE1 5335 C CE2 . PHE D 90 ? 0.5680 0.8636 0.5705 -0.0213 0.0457 -0.1097 91 PHE D CE2 5336 C CZ . PHE D 90 ? 0.5473 0.8482 0.5610 -0.0064 0.0537 -0.1421 91 PHE D CZ 5337 N N . CYS D 91 ? 0.5898 0.6996 0.6341 -0.0043 -0.0325 -0.0625 92 CYS D N 5338 C CA . CYS D 91 ? 0.6103 0.6855 0.6663 -0.0066 -0.0519 -0.0556 92 CYS D CA 5339 C C . CYS D 91 ? 0.6133 0.7080 0.6798 -0.0316 -0.0447 -0.0390 92 CYS D C 5340 O O . CYS D 91 ? 0.6223 0.7533 0.6808 -0.0514 -0.0312 -0.0242 92 CYS D O 5341 C CB . CYS D 91 ? 0.6551 0.6859 0.7047 -0.0046 -0.0854 -0.0423 92 CYS D CB 5342 S SG . CYS D 91 ? 0.7096 0.6874 0.7762 -0.0088 -0.1176 -0.0371 92 CYS D SG 5343 N N . ALA D 92 ? 0.6100 0.6893 0.6954 -0.0311 -0.0533 -0.0440 93 ALA D N 5344 C CA . ALA D 92 ? 0.6112 0.7170 0.7165 -0.0546 -0.0480 -0.0320 93 ALA D CA 5345 C C . ALA D 92 ? 0.6398 0.7065 0.7613 -0.0644 -0.0764 -0.0248 93 ALA D C 5346 O O . ALA D 92 ? 0.6477 0.6700 0.7664 -0.0445 -0.0973 -0.0399 93 ALA D O 5347 C CB . ALA D 92 ? 0.5720 0.7188 0.6938 -0.0428 -0.0250 -0.0531 93 ALA D CB 5348 N N . SER D 93 ? 0.6591 0.7486 0.7995 -0.0963 -0.0771 -0.0045 94 SER D N 5349 C CA . SER D 93 ? 0.6923 0.7486 0.8547 -0.1126 -0.1057 0.0027 94 SER D CA 5350 C C . SER D 93 ? 0.6814 0.7956 0.8788 -0.1355 -0.0927 0.0057 94 SER D C 5351 O O . SER D 93 ? 0.6676 0.8473 0.8705 -0.1516 -0.0649 0.0143 94 SER D O 5352 C CB . SER D 93 ? 0.7551 0.7615 0.9078 -0.1395 -0.1352 0.0358 94 SER D CB 5353 O OG . SER D 93 ? 0.7792 0.8303 0.9291 -0.1807 -0.1202 0.0714 94 SER D OG 5354 N N . GLY D 94 ? 0.6922 0.7883 0.9149 -0.1355 -0.1139 -0.0054 95 GLY D N 5355 C CA . GLY D 94 ? 0.6855 0.8397 0.9499 -0.1538 -0.1068 -0.0073 95 GLY D CA 5356 C C . GLY D 94 ? 0.7221 0.8436 1.0141 -0.1688 -0.1418 -0.0088 95 GLY D C 5357 O O . GLY D 94 ? 0.7456 0.7991 1.0227 -0.1505 -0.1710 -0.0226 95 GLY D O 5358 N N . ASP D 95 ? 0.7304 0.9071 1.0657 -0.2018 -0.1394 0.0011 96 ASP D N 5359 C CA . ASP D 95 ? 0.7654 0.9200 1.1351 -0.2220 -0.1740 -0.0008 96 ASP D CA 5360 C C . ASP D 95 ? 0.7334 0.9217 1.1289 -0.1944 -0.1772 -0.0347 96 ASP D C 5361 O O . ASP D 95 ? 0.7353 0.8745 1.1109 -0.1622 -0.1987 -0.0595 96 ASP D O 5362 C CB . ASP D 95 ? 0.8026 1.0003 1.2093 -0.2829 -0.1735 0.0343 96 ASP D CB 5363 N N . GLU D 102 ? 0.5855 1.0609 1.0088 -0.1289 -0.0303 -0.0773 103 GLU D N 5364 C CA . GLU D 102 ? 0.5819 1.0796 0.9756 -0.1321 -0.0008 -0.0716 103 GLU D CA 5365 C C . GLU D 102 ? 0.5973 1.0106 0.9325 -0.1357 -0.0101 -0.0498 103 GLU D C 5366 O O . GLU D 102 ? 0.6303 0.9983 0.9561 -0.1624 -0.0312 -0.0248 103 GLU D O 5367 C CB . GLU D 102 ? 0.5991 1.1922 1.0198 -0.1743 0.0231 -0.0573 103 GLU D CB 5368 C CG . GLU D 102 ? 0.5976 1.2381 0.9902 -0.1741 0.0562 -0.0601 103 GLU D CG 5369 C CD . GLU D 102 ? 0.6239 1.3724 1.0366 -0.2199 0.0831 -0.0450 103 GLU D CD 5370 O OE1 . GLU D 102 ? 0.6307 1.4375 1.0954 -0.2468 0.0809 -0.0410 103 GLU D OE1 5371 O OE2 . GLU D 102 ? 0.6367 1.4185 1.0125 -0.2312 0.1067 -0.0371 103 GLU D OE2 5372 N N . GLN D 103 ? 0.5778 0.9699 0.8788 -0.1078 0.0022 -0.0617 106 GLN D N 5373 C CA . GLN D 103 ? 0.5880 0.9138 0.8395 -0.1065 -0.0049 -0.0464 106 GLN D CA 5374 C C . GLN D 103 ? 0.6003 0.9617 0.8277 -0.1270 0.0159 -0.0301 106 GLN D C 5375 O O . GLN D 103 ? 0.5872 1.0194 0.8251 -0.1244 0.0422 -0.0453 106 GLN D O 5376 C CB . GLN D 103 ? 0.5652 0.8449 0.7939 -0.0668 -0.0076 -0.0681 106 GLN D CB 5377 C CG . GLN D 103 ? 0.5684 0.8018 0.8009 -0.0497 -0.0319 -0.0777 106 GLN D CG 5378 C CD . GLN D 103 ? 0.5631 0.7593 0.7678 -0.0183 -0.0317 -0.0929 106 GLN D CD 5379 O OE1 . GLN D 103 ? 0.5676 0.7468 0.7737 -0.0017 -0.0443 -0.1035 106 GLN D OE1 5380 N NE2 . GLN D 103 ? 0.5545 0.7413 0.7328 -0.0134 -0.0186 -0.0921 106 GLN D NE2 5381 N N . PHE D 104 ? 0.6298 0.9422 0.8245 -0.1454 0.0007 -0.0015 107 PHE D N 5382 C CA . PHE D 104 ? 0.6527 0.9894 0.8142 -0.1664 0.0136 0.0203 107 PHE D CA 5383 C C . PHE D 104 ? 0.6473 0.9283 0.7697 -0.1410 0.0049 0.0157 107 PHE D C 5384 O O . PHE D 104 ? 0.6615 0.8704 0.7740 -0.1318 -0.0226 0.0222 107 PHE D O 5385 C CB . PHE D 104 ? 0.7101 1.0407 0.8667 -0.2158 -0.0013 0.0656 107 PHE D CB 5386 C CG . PHE D 104 ? 0.7199 1.1254 0.9181 -0.2495 0.0120 0.0724 107 PHE D CG 5387 C CD1 . PHE D 104 ? 0.7308 1.2382 0.9293 -0.2748 0.0457 0.0775 107 PHE D CD1 5388 C CD2 . PHE D 104 ? 0.7210 1.1042 0.9601 -0.2560 -0.0090 0.0700 107 PHE D CD2 5389 C CE1 . PHE D 104 ? 0.7407 1.3338 0.9849 -0.3070 0.0607 0.0805 107 PHE D CE1 5390 C CE2 . PHE D 104 ? 0.7298 1.1908 1.0151 -0.2886 0.0022 0.0745 107 PHE D CE2 5391 C CZ . PHE D 104 ? 0.7373 1.3070 1.0279 -0.3147 0.0384 0.0801 107 PHE D CZ 5392 N N . PHE D 105 ? 0.6287 0.9492 0.7333 -0.1287 0.0275 0.0000 108 PHE D N 5393 C CA . PHE D 105 ? 0.6147 0.8969 0.6922 -0.1021 0.0227 -0.0126 108 PHE D CA 5394 C C . PHE D 105 ? 0.6552 0.9277 0.6921 -0.1183 0.0135 0.0143 108 PHE D C 5395 O O . PHE D 105 ? 0.6879 1.0085 0.7074 -0.1481 0.0244 0.0359 108 PHE D O 5396 C CB . PHE D 105 ? 0.5787 0.8988 0.6644 -0.0767 0.0460 -0.0499 108 PHE D CB 5397 C CG . PHE D 105 ? 0.5451 0.8586 0.6655 -0.0552 0.0468 -0.0740 108 PHE D CG 5398 C CD1 . PHE D 105 ? 0.5364 0.9030 0.6918 -0.0596 0.0583 -0.0845 108 PHE D CD1 5399 C CD2 . PHE D 105 ? 0.5259 0.7859 0.6440 -0.0314 0.0350 -0.0857 108 PHE D CD2 5400 C CE1 . PHE D 105 ? 0.5148 0.8715 0.7012 -0.0376 0.0528 -0.1046 108 PHE D CE1 5401 C CE2 . PHE D 105 ? 0.5099 0.7611 0.6517 -0.0143 0.0324 -0.1019 108 PHE D CE2 5402 C CZ . PHE D 105 ? 0.5014 0.7962 0.6769 -0.0159 0.0387 -0.1106 108 PHE D CZ 5403 N N . GLY D 106 ? 0.6566 0.8724 0.6783 -0.0984 -0.0072 0.0125 109 GLY D N 5404 C CA . GLY D 106 ? 0.6950 0.8943 0.6804 -0.1057 -0.0234 0.0348 109 GLY D CA 5405 C C . GLY D 106 ? 0.6823 0.9287 0.6466 -0.0960 -0.0033 0.0154 109 GLY D C 5406 O O . GLY D 106 ? 0.6428 0.9264 0.6239 -0.0820 0.0214 -0.0176 109 GLY D O 5407 N N . PRO D 107 ? 0.7215 0.9619 0.6494 -0.1023 -0.0186 0.0345 110 PRO D N 5408 C CA . PRO D 107 ? 0.7220 1.0121 0.6243 -0.0979 -0.0030 0.0172 110 PRO D CA 5409 C C . PRO D 107 ? 0.6840 0.9597 0.6009 -0.0643 -0.0038 -0.0206 110 PRO D C 5410 O O . PRO D 107 ? 0.6792 0.9942 0.5849 -0.0581 0.0096 -0.0448 110 PRO D O 5411 C CB . PRO D 107 ? 0.7894 1.0712 0.6447 -0.1193 -0.0271 0.0585 110 PRO D CB 5412 C CG . PRO D 107 ? 0.8259 1.0412 0.6876 -0.1333 -0.0590 0.0978 110 PRO D CG 5413 C CD . PRO D 107 ? 0.7755 0.9567 0.6853 -0.1110 -0.0575 0.0714 110 PRO D CD 5414 N N . GLY D 108 ? 0.6632 0.8878 0.6053 -0.0450 -0.0196 -0.0273 111 GLY D N 5415 C CA . GLY D 108 ? 0.6277 0.8465 0.5881 -0.0194 -0.0172 -0.0603 111 GLY D CA 5416 C C . GLY D 108 ? 0.6471 0.8493 0.5993 -0.0066 -0.0426 -0.0592 111 GLY D C 5417 O O . GLY D 108 ? 0.6934 0.8955 0.6162 -0.0160 -0.0616 -0.0356 111 GLY D O 5418 N N . THR D 109 ? 0.6170 0.8098 0.5956 0.0140 -0.0438 -0.0843 112 THR D N 5419 C CA . THR D 109 ? 0.6257 0.8164 0.6102 0.0307 -0.0657 -0.0931 112 THR D CA 5420 C C . THR D 109 ? 0.5937 0.8180 0.5958 0.0366 -0.0486 -0.1254 112 THR D C 5421 O O . THR D 109 ? 0.5621 0.7872 0.5858 0.0384 -0.0299 -0.1416 112 THR D O 5422 C CB . THR D 109 ? 0.6296 0.7851 0.6376 0.0500 -0.0866 -0.0956 112 THR D CB 5423 O OG1 . THR D 109 ? 0.6710 0.7847 0.6646 0.0430 -0.1117 -0.0646 112 THR D OG1 5424 C CG2 . THR D 109 ? 0.6363 0.8051 0.6631 0.0725 -0.1064 -0.1151 112 THR D CG2 5425 N N . ARG D 110 ? 0.6091 0.8592 0.6004 0.0367 -0.0581 -0.1322 113 ARG D N 5426 C CA . ARG D 110 ? 0.5873 0.8675 0.5998 0.0389 -0.0484 -0.1627 113 ARG D CA 5427 C C . ARG D 110 ? 0.5779 0.8665 0.6224 0.0559 -0.0641 -0.1758 113 ARG D C 5428 O O . ARG D 110 ? 0.6045 0.8950 0.6466 0.0685 -0.0928 -0.1702 113 ARG D O 5429 C CB . ARG D 110 ? 0.6119 0.9229 0.6001 0.0304 -0.0517 -0.1705 113 ARG D CB 5430 C CG . ARG D 110 ? 0.6219 0.9445 0.5949 0.0174 -0.0275 -0.1797 113 ARG D CG 5431 C CD . ARG D 110 ? 0.6701 1.0299 0.6204 0.0121 -0.0313 -0.1985 113 ARG D CD 5432 N NE . ARG D 110 ? 0.6658 1.0358 0.6294 0.0085 -0.0116 -0.2307 113 ARG D NE 5433 C CZ . ARG D 110 ? 0.6584 1.0247 0.6549 0.0085 -0.0111 -0.2579 113 ARG D CZ 5434 N NH1 . ARG D 110 ? 0.6482 1.0150 0.6692 0.0103 -0.0239 -0.2583 113 ARG D NH1 5435 N NH2 . ARG D 110 ? 0.6645 1.0281 0.6731 0.0061 0.0003 -0.2858 113 ARG D NH2 5436 N N . LEU D 111 ? 0.5444 0.8418 0.6192 0.0561 -0.0463 -0.1931 114 LEU D N 5437 C CA . LEU D 111 ? 0.5347 0.8590 0.6450 0.0700 -0.0537 -0.2113 114 LEU D CA 5438 C C . LEU D 111 ? 0.5182 0.8841 0.6547 0.0561 -0.0396 -0.2335 114 LEU D C 5439 O O . LEU D 111 ? 0.5060 0.8644 0.6421 0.0372 -0.0176 -0.2347 114 LEU D O 5440 C CB . LEU D 111 ? 0.5216 0.8318 0.6440 0.0795 -0.0458 -0.2119 114 LEU D CB 5441 C CG . LEU D 111 ? 0.5143 0.8677 0.6748 0.0940 -0.0462 -0.2370 114 LEU D CG 5442 C CD1 . LEU D 111 ? 0.5442 0.9073 0.7219 0.1229 -0.0811 -0.2467 114 LEU D CD1 5443 C CD2 . LEU D 111 ? 0.5073 0.8533 0.6694 0.0976 -0.0311 -0.2401 114 LEU D CD2 5444 N N . THR D 112 ? 0.5230 0.9305 0.6854 0.0649 -0.0563 -0.2503 115 THR D N 5445 C CA . THR D 112 ? 0.5106 0.9662 0.7080 0.0488 -0.0457 -0.2723 115 THR D CA 5446 C C . THR D 112 ? 0.5018 1.0097 0.7435 0.0624 -0.0473 -0.2909 115 THR D C 5447 O O . THR D 112 ? 0.5149 1.0435 0.7729 0.0891 -0.0740 -0.3007 115 THR D O 5448 C CB . THR D 112 ? 0.5277 1.0046 0.7237 0.0427 -0.0635 -0.2834 115 THR D CB 5449 O OG1 . THR D 112 ? 0.5429 0.9831 0.6979 0.0315 -0.0588 -0.2735 115 THR D OG1 5450 C CG2 . THR D 112 ? 0.5201 1.0455 0.7588 0.0209 -0.0548 -0.3064 115 THR D CG2 5451 N N . VAL D 113 ? 0.4856 1.0175 0.7463 0.0444 -0.0200 -0.2958 116 VAL D N 5452 C CA . VAL D 113 ? 0.4790 1.0822 0.7842 0.0510 -0.0133 -0.3183 116 VAL D CA 5453 C C . VAL D 113 ? 0.4775 1.1409 0.8207 0.0208 -0.0042 -0.3322 116 VAL D C 5454 O O . VAL D 113 ? 0.4802 1.1257 0.8150 -0.0153 0.0139 -0.3200 116 VAL D O 5455 C CB . VAL D 113 ? 0.4722 1.0762 0.7693 0.0473 0.0120 -0.3135 116 VAL D CB 5456 C CG1 . VAL D 113 ? 0.4718 1.1652 0.8140 0.0578 0.0203 -0.3429 116 VAL D CG1 5457 C CG2 . VAL D 113 ? 0.4779 1.0161 0.7389 0.0720 0.0011 -0.2996 116 VAL D CG2 5458 N N . LEU D 114 ? 0.4780 1.2103 0.8664 0.0359 -0.0209 -0.3583 117 LEU D N 5459 C CA . LEU D 114 ? 0.4780 1.2769 0.9113 0.0071 -0.0175 -0.3747 117 LEU D CA 5460 C C . LEU D 114 ? 0.4715 1.3719 0.9597 0.0010 0.0019 -0.3972 117 LEU D C 5461 O O . LEU D 114 ? 0.4691 1.3965 0.9655 0.0321 0.0047 -0.4102 117 LEU D O 5462 C CB . LEU D 114 ? 0.4892 1.3013 0.9360 0.0255 -0.0546 -0.3897 117 LEU D CB 5463 C CG . LEU D 114 ? 0.5024 1.2377 0.8957 0.0244 -0.0722 -0.3721 117 LEU D CG 5464 C CD1 . LEU D 114 ? 0.5209 1.2714 0.9168 0.0527 -0.1137 -0.3829 117 LEU D CD1 5465 C CD2 . LEU D 114 ? 0.5087 1.2276 0.8979 -0.0185 -0.0583 -0.3701 117 LEU D CD2 5466 N N . GLU D 115 ? 0.4739 1.4341 1.0011 -0.0405 0.0151 -0.4039 118 GLU D N 5467 C CA . GLU D 115 ? 0.4707 1.5480 1.0560 -0.0546 0.0367 -0.4259 118 GLU D CA 5468 C C . GLU D 115 ? 0.4661 1.6299 1.1126 -0.0171 0.0098 -0.4664 118 GLU D C 5469 O O . GLU D 115 ? 0.4629 1.7187 1.1529 0.0034 0.0196 -0.4951 118 GLU D O 5470 C CB . GLU D 115 ? 0.4858 1.5936 1.0920 -0.1211 0.0592 -0.4124 118 GLU D CB 5471 N N . ASP D 116 ? 0.4708 1.6082 1.1204 -0.0061 -0.0259 -0.4713 119 ASP D N 5472 C CA . ASP D 116 ? 0.4730 1.6809 1.1773 0.0323 -0.0613 -0.5066 119 ASP D CA 5473 C C . ASP D 116 ? 0.4880 1.6173 1.1532 0.0627 -0.1071 -0.4974 119 ASP D C 5474 O O . ASP D 116 ? 0.4952 1.5567 1.1158 0.0370 -0.1105 -0.4760 119 ASP D O 5475 C CB . ASP D 116 ? 0.4748 1.7965 1.2542 -0.0035 -0.0555 -0.5313 119 ASP D CB 5476 C CG . ASP D 116 ? 0.4856 1.7632 1.2481 -0.0563 -0.0558 -0.5128 119 ASP D CG 5477 N N . LEU D 117 ? 0.8270 1.0976 0.8778 0.2034 0.1863 -0.2720 120 LEU D N 5478 C CA . LEU D 117 ? 0.7870 1.0521 0.8743 0.2029 0.1567 -0.2702 120 LEU D CA 5479 C C . LEU D 117 ? 0.7530 1.0534 0.8984 0.1941 0.1573 -0.2612 120 LEU D C 5480 O O . LEU D 117 ? 0.7240 1.0219 0.8967 0.1941 0.1335 -0.2559 120 LEU D O 5481 C CB . LEU D 117 ? 0.8029 1.0525 0.8964 0.2225 0.1474 -0.2911 120 LEU D CB 5482 C CG . LEU D 117 ? 0.8373 1.0553 0.8797 0.2266 0.1430 -0.3093 120 LEU D CG 5483 C CD1 . LEU D 117 ? 0.8646 1.0601 0.9171 0.2437 0.1444 -0.3315 120 LEU D CD1 5484 C CD2 . LEU D 117 ? 0.8222 1.0210 0.8382 0.2122 0.1179 -0.3030 120 LEU D CD2 5485 N N . LYS D 118 ? 0.7614 1.0976 0.9236 0.1847 0.1857 -0.2612 121 LYS D N 5486 C CA . LYS D 118 ? 0.7334 1.1206 0.9542 0.1717 0.1890 -0.2593 121 LYS D CA 5487 C C . LYS D 118 ? 0.7085 1.0829 0.9271 0.1441 0.1792 -0.2422 121 LYS D C 5488 O O . LYS D 118 ? 0.6863 1.1040 0.9505 0.1282 0.1790 -0.2428 121 LYS D O 5489 C CB . LYS D 118 ? 0.7562 1.1930 0.9984 0.1639 0.2265 -0.2701 121 LYS D CB 5490 C CG . LYS D 118 ? 0.7979 1.2053 0.9863 0.1433 0.2600 -0.2626 121 LYS D CG 5491 C CD . LYS D 118 ? 0.8261 1.2796 1.0331 0.1375 0.3004 -0.2768 121 LYS D CD 5492 N N . ASN D 119 ? 0.7156 1.0356 0.8805 0.1400 0.1709 -0.2288 122 ASN D N 5493 C CA . ASN D 119 ? 0.7000 0.9968 0.8531 0.1187 0.1629 -0.2117 122 ASN D CA 5494 C C . ASN D 119 ? 0.6677 0.9415 0.8211 0.1271 0.1254 -0.2056 122 ASN D C 5495 O O . ASN D 119 ? 0.6559 0.9080 0.7968 0.1131 0.1164 -0.1917 122 ASN D O 5496 C CB . ASN D 119 ? 0.7421 0.9946 0.8293 0.1106 0.1869 -0.1975 122 ASN D CB 5497 C CG . ASN D 119 ? 0.7858 1.0498 0.8663 0.0950 0.2307 -0.2008 122 ASN D CG 5498 O OD1 . ASN D 119 ? 0.7820 1.0871 0.9101 0.0724 0.2452 -0.2096 122 ASN D OD1 5499 N ND2 . ASN D 119 ? 0.8384 1.0700 0.8578 0.1060 0.2531 -0.1950 122 ASN D ND2 5500 N N . VAL D 120 ? 0.6599 0.9335 0.8242 0.1486 0.1076 -0.2170 123 VAL D N 5501 C CA . VAL D 120 ? 0.6404 0.8861 0.7998 0.1541 0.0775 -0.2142 123 VAL D CA 5502 C C . VAL D 120 ? 0.6112 0.8748 0.8159 0.1526 0.0598 -0.2097 123 VAL D C 5503 O O . VAL D 120 ? 0.6110 0.9051 0.8525 0.1679 0.0603 -0.2178 123 VAL D O 5504 C CB . VAL D 120 ? 0.6627 0.8875 0.8038 0.1728 0.0715 -0.2308 123 VAL D CB 5505 C CG1 . VAL D 120 ? 0.6496 0.8434 0.7874 0.1725 0.0459 -0.2310 123 VAL D CG1 5506 C CG2 . VAL D 120 ? 0.6888 0.9028 0.7796 0.1741 0.0840 -0.2361 123 VAL D CG2 5507 N N . PHE D 121 ? 0.5920 0.8390 0.7907 0.1379 0.0445 -0.1962 124 PHE D N 5508 C CA . PHE D 121 ? 0.5692 0.8310 0.8020 0.1358 0.0261 -0.1905 124 PHE D CA 5509 C C . PHE D 121 ? 0.5611 0.7819 0.7759 0.1368 0.0026 -0.1833 124 PHE D C 5510 O O . PHE D 121 ? 0.5600 0.7530 0.7411 0.1272 0.0005 -0.1782 124 PHE D O 5511 C CB . PHE D 121 ? 0.5559 0.8424 0.8024 0.1098 0.0342 -0.1832 124 PHE D CB 5512 C CG . PHE D 121 ? 0.5658 0.9063 0.8441 0.1023 0.0569 -0.1939 124 PHE D CG 5513 C CD1 . PHE D 121 ? 0.5563 0.9582 0.8866 0.1087 0.0488 -0.2022 124 PHE D CD1 5514 C CD2 . PHE D 121 ? 0.5952 0.9296 0.8501 0.0895 0.0877 -0.1961 124 PHE D CD2 5515 C CE1 . PHE D 121 ? 0.5672 1.0341 0.9334 0.0991 0.0704 -0.2161 124 PHE D CE1 5516 C CE2 . PHE D 121 ? 0.6109 0.9973 0.8964 0.0772 0.1131 -0.2084 124 PHE D CE2 5517 C CZ . PHE D 121 ? 0.5932 1.0512 0.9384 0.0802 0.1042 -0.2203 124 PHE D CZ 5518 N N . PRO D 122 ? 0.5606 0.7790 0.7955 0.1508 -0.0133 -0.1827 125 PRO D N 5519 C CA . PRO D 122 ? 0.5569 0.7370 0.7764 0.1466 -0.0321 -0.1744 125 PRO D CA 5520 C C . PRO D 122 ? 0.5330 0.7257 0.7597 0.1271 -0.0408 -0.1609 125 PRO D C 5521 O O . PRO D 122 ? 0.5223 0.7564 0.7732 0.1190 -0.0345 -0.1605 125 PRO D O 5522 C CB . PRO D 122 ? 0.5775 0.7463 0.8099 0.1724 -0.0398 -0.1760 125 PRO D CB 5523 C CG . PRO D 122 ? 0.5765 0.8012 0.8450 0.1889 -0.0323 -0.1801 125 PRO D CG 5524 C CD . PRO D 122 ? 0.5725 0.8211 0.8399 0.1760 -0.0122 -0.1891 125 PRO D CD 5525 N N . PRO D 123 ? 0.5280 0.6874 0.7336 0.1168 -0.0531 -0.1526 126 PRO D N 5526 C CA . PRO D 123 ? 0.5109 0.6760 0.7181 0.0989 -0.0594 -0.1410 126 PRO D CA 5527 C C . PRO D 123 ? 0.5083 0.6898 0.7386 0.1045 -0.0747 -0.1357 126 PRO D C 5528 O O . PRO D 123 ? 0.5251 0.6928 0.7580 0.1253 -0.0836 -0.1356 126 PRO D O 5529 C CB . PRO D 123 ? 0.5087 0.6368 0.6849 0.0907 -0.0659 -0.1358 126 PRO D CB 5530 C CG . PRO D 123 ? 0.5265 0.6305 0.6949 0.1023 -0.0702 -0.1453 126 PRO D CG 5531 C CD . PRO D 123 ? 0.5419 0.6605 0.7214 0.1179 -0.0588 -0.1569 126 PRO D CD 5532 N N . GLU D 124 ? 0.4963 0.7048 0.7383 0.0870 -0.0756 -0.1321 127 GLU D N 5533 C CA . GLU D 124 ? 0.4961 0.7219 0.7514 0.0892 -0.0934 -0.1265 127 GLU D CA 5534 C C . GLU D 124 ? 0.4902 0.6724 0.7166 0.0751 -0.1012 -0.1155 127 GLU D C 5535 O O . GLU D 124 ? 0.4856 0.6494 0.6929 0.0564 -0.0907 -0.1135 127 GLU D O 5536 C CB . GLU D 124 ? 0.4895 0.7781 0.7749 0.0733 -0.0899 -0.1346 127 GLU D CB 5537 C CG . GLU D 124 ? 0.5077 0.8534 0.8277 0.0855 -0.0800 -0.1479 127 GLU D CG 5538 C CD . GLU D 124 ? 0.5251 0.9529 0.8843 0.0745 -0.0836 -0.1596 127 GLU D CD 5539 O OE1 . GLU D 124 ? 0.5363 0.9966 0.9097 0.0450 -0.0628 -0.1728 127 GLU D OE1 5540 O OE2 . GLU D 124 ? 0.5312 0.9932 0.9049 0.0947 -0.1058 -0.1569 127 GLU D OE2 5541 N N . VAL D 125 ? 0.4982 0.6610 0.7175 0.0873 -0.1173 -0.1075 128 VAL D N 5542 C CA . VAL D 125 ? 0.4967 0.6181 0.6889 0.0752 -0.1231 -0.0980 128 VAL D CA 5543 C C . VAL D 125 ? 0.4971 0.6324 0.6901 0.0704 -0.1368 -0.0907 128 VAL D C 5544 O O . VAL D 125 ? 0.5105 0.6703 0.7156 0.0896 -0.1486 -0.0886 128 VAL D O 5545 C CB . VAL D 125 ? 0.5167 0.5896 0.6889 0.0866 -0.1243 -0.0963 128 VAL D CB 5546 C CG1 . VAL D 125 ? 0.5177 0.5575 0.6660 0.0706 -0.1273 -0.0894 128 VAL D CG1 5547 C CG2 . VAL D 125 ? 0.5181 0.5846 0.6881 0.0890 -0.1118 -0.1080 128 VAL D CG2 5548 N N . ALA D 126 ? 0.4876 0.6090 0.6644 0.0478 -0.1347 -0.0870 129 ALA D N 5549 C CA . ALA D 126 ? 0.4909 0.6223 0.6624 0.0388 -0.1461 -0.0824 129 ALA D CA 5550 C C . ALA D 126 ? 0.4942 0.5799 0.6352 0.0274 -0.1455 -0.0733 129 ALA D C 5551 O O . ALA D 126 ? 0.4889 0.5527 0.6170 0.0178 -0.1330 -0.0736 129 ALA D O 5552 C CB . ALA D 126 ? 0.4832 0.6572 0.6700 0.0163 -0.1394 -0.0934 129 ALA D CB 5553 N N . VAL D 127 ? 0.5087 0.5838 0.6363 0.0320 -0.1584 -0.0648 130 VAL D N 5554 C CA . VAL D 127 ? 0.5148 0.5523 0.6146 0.0200 -0.1569 -0.0571 130 VAL D CA 5555 C C . VAL D 127 ? 0.5174 0.5706 0.6090 0.0029 -0.1605 -0.0583 130 VAL D C 5556 O O . VAL D 127 ? 0.5268 0.6160 0.6274 0.0067 -0.1733 -0.0610 130 VAL D O 5557 C CB . VAL D 127 ? 0.5403 0.5398 0.6210 0.0338 -0.1626 -0.0467 130 VAL D CB 5558 C CG1 . VAL D 127 ? 0.5502 0.5216 0.6038 0.0203 -0.1617 -0.0391 130 VAL D CG1 5559 C CG2 . VAL D 127 ? 0.5444 0.5189 0.6264 0.0387 -0.1527 -0.0510 130 VAL D CG2 5560 N N . PHE D 128 ? 0.5144 0.5437 0.5874 -0.0143 -0.1486 -0.0580 131 PHE D N 5561 C CA . PHE D 128 ? 0.5264 0.5588 0.5848 -0.0340 -0.1468 -0.0618 131 PHE D CA 5562 C C . PHE D 128 ? 0.5431 0.5426 0.5724 -0.0358 -0.1492 -0.0521 131 PHE D C 5563 O O . PHE D 128 ? 0.5405 0.5106 0.5573 -0.0341 -0.1393 -0.0466 131 PHE D O 5564 C CB . PHE D 128 ? 0.5248 0.5484 0.5779 -0.0516 -0.1248 -0.0700 131 PHE D CB 5565 C CG . PHE D 128 ? 0.5115 0.5690 0.5907 -0.0561 -0.1186 -0.0814 131 PHE D CG 5566 C CD1 . PHE D 128 ? 0.4852 0.5458 0.5796 -0.0397 -0.1148 -0.0796 131 PHE D CD1 5567 C CD2 . PHE D 128 ? 0.5153 0.6063 0.6043 -0.0793 -0.1154 -0.0968 131 PHE D CD2 5568 C CE1 . PHE D 128 ? 0.4790 0.5717 0.5967 -0.0438 -0.1068 -0.0903 131 PHE D CE1 5569 C CE2 . PHE D 128 ? 0.5051 0.6338 0.6214 -0.0868 -0.1068 -0.1097 131 PHE D CE2 5570 C CZ . PHE D 128 ? 0.4896 0.6172 0.6197 -0.0677 -0.1020 -0.1050 131 PHE D CZ 5571 N N . GLU D 129 ? 0.5650 0.5769 0.5837 -0.0383 -0.1627 -0.0512 132 GLU D N 5572 C CA . GLU D 129 ? 0.5892 0.5711 0.5772 -0.0384 -0.1657 -0.0410 132 GLU D CA 5573 C C . GLU D 129 ? 0.5954 0.5542 0.5602 -0.0585 -0.1503 -0.0452 132 GLU D C 5574 O O . GLU D 129 ? 0.6002 0.5679 0.5663 -0.0752 -0.1406 -0.0574 132 GLU D O 5575 C CB . GLU D 129 ? 0.6160 0.6209 0.5939 -0.0288 -0.1860 -0.0374 132 GLU D CB 5576 C CG . GLU D 129 ? 0.6361 0.6554 0.6278 0.0002 -0.1991 -0.0297 132 GLU D CG 5577 C CD . GLU D 129 ? 0.6914 0.7333 0.6647 0.0196 -0.2193 -0.0222 132 GLU D CD 5578 O OE1 . GLU D 129 ? 0.7015 0.7995 0.6964 0.0353 -0.2339 -0.0280 132 GLU D OE1 5579 O OE2 . GLU D 129 ? 0.7319 0.7398 0.6677 0.0215 -0.2203 -0.0104 132 GLU D OE2 5580 N N . PRO D 130 ? 0.6048 0.5307 0.5460 -0.0574 -0.1444 -0.0361 133 PRO D N 5581 C CA . PRO D 130 ? 0.6170 0.5179 0.5331 -0.0700 -0.1279 -0.0384 133 PRO D CA 5582 C C . PRO D 130 ? 0.6441 0.5487 0.5394 -0.0887 -0.1288 -0.0485 133 PRO D C 5583 O O . PRO D 130 ? 0.6568 0.5863 0.5499 -0.0895 -0.1473 -0.0501 133 PRO D O 5584 C CB . PRO D 130 ? 0.6238 0.5024 0.5232 -0.0641 -0.1259 -0.0274 133 PRO D CB 5585 C CG . PRO D 130 ? 0.6136 0.4969 0.5333 -0.0516 -0.1326 -0.0219 133 PRO D CG 5586 C CD . PRO D 130 ? 0.6113 0.5188 0.5475 -0.0446 -0.1486 -0.0241 133 PRO D CD 5587 N N . SER D 131 ? 0.6599 0.5393 0.5361 -0.1021 -0.1078 -0.0563 134 SER D N 5588 C CA . SER D 131 ? 0.6975 0.5716 0.5477 -0.1259 -0.1031 -0.0703 134 SER D CA 5589 C C . SER D 131 ? 0.7213 0.5747 0.5384 -0.1256 -0.1047 -0.0642 134 SER D C 5590 O O . SER D 131 ? 0.7164 0.5477 0.5267 -0.1108 -0.0978 -0.0509 134 SER D O 5591 C CB . SER D 131 ? 0.7229 0.5606 0.5551 -0.1407 -0.0730 -0.0811 134 SER D CB 5592 O OG . SER D 131 ? 0.7350 0.5299 0.5460 -0.1236 -0.0532 -0.0692 134 SER D OG 5593 N N . GLU D 132 ? 0.7493 0.6164 0.5463 -0.1435 -0.1134 -0.0762 135 GLU D N 5594 C CA . GLU D 132 ? 0.7776 0.6237 0.5363 -0.1458 -0.1130 -0.0727 135 GLU D CA 5595 C C . GLU D 132 ? 0.8006 0.5936 0.5292 -0.1523 -0.0818 -0.0759 135 GLU D C 5596 O O . GLU D 132 ? 0.8142 0.5827 0.5194 -0.1437 -0.0743 -0.0663 135 GLU D O 5597 C CB . GLU D 132 ? 0.8066 0.6880 0.5483 -0.1633 -0.1308 -0.0881 135 GLU D CB 5598 N N . ALA D 133 ? 0.8112 0.5839 0.5376 -0.1654 -0.0609 -0.0888 136 ALA D N 5599 C CA . ALA D 133 ? 0.8447 0.5579 0.5361 -0.1647 -0.0269 -0.0904 136 ALA D CA 5600 C C . ALA D 133 ? 0.8198 0.5200 0.5189 -0.1312 -0.0179 -0.0697 136 ALA D C 5601 O O . ALA D 133 ? 0.8467 0.5144 0.5164 -0.1211 0.0008 -0.0656 136 ALA D O 5602 C CB . ALA D 133 ? 0.8728 0.5573 0.5548 -0.1836 -0.0025 -0.1061 136 ALA D CB 5603 N N . GLU D 134 ? 0.7700 0.5014 0.5087 -0.1144 -0.0308 -0.0592 137 GLU D N 5604 C CA . GLU D 134 ? 0.7453 0.4820 0.4969 -0.0864 -0.0257 -0.0446 137 GLU D CA 5605 C C . GLU D 134 ? 0.7353 0.4866 0.4874 -0.0833 -0.0362 -0.0370 137 GLU D C 5606 O O . GLU D 134 ? 0.7433 0.4886 0.4855 -0.0697 -0.0219 -0.0317 137 GLU D O 5607 C CB . GLU D 134 ? 0.7046 0.4722 0.4958 -0.0736 -0.0364 -0.0396 137 GLU D CB 5608 C CG . GLU D 134 ? 0.6895 0.4710 0.4925 -0.0466 -0.0291 -0.0301 137 GLU D CG 5609 C CD . GLU D 134 ? 0.6551 0.4748 0.4978 -0.0383 -0.0448 -0.0278 137 GLU D CD 5610 O OE1 . GLU D 134 ? 0.6445 0.4776 0.5065 -0.0503 -0.0624 -0.0305 137 GLU D OE1 5611 O OE2 . GLU D 134 ? 0.6395 0.4796 0.4928 -0.0178 -0.0392 -0.0244 137 GLU D OE2 5612 N N . ILE D 135 ? 0.7244 0.4953 0.4854 -0.0940 -0.0590 -0.0361 138 ILE D N 5613 C CA . ILE D 135 ? 0.7264 0.5002 0.4791 -0.0931 -0.0660 -0.0272 138 ILE D CA 5614 C C . ILE D 135 ? 0.7657 0.5125 0.4780 -0.0989 -0.0498 -0.0294 138 ILE D C 5615 O O . ILE D 135 ? 0.7686 0.5138 0.4766 -0.0920 -0.0387 -0.0231 138 ILE D O 5616 C CB . ILE D 135 ? 0.7268 0.5163 0.4827 -0.0974 -0.0912 -0.0236 138 ILE D CB 5617 C CG1 . ILE D 135 ? 0.6906 0.5024 0.4858 -0.0868 -0.1030 -0.0196 138 ILE D CG1 5618 C CG2 . ILE D 135 ? 0.7487 0.5242 0.4782 -0.0971 -0.0927 -0.0128 138 ILE D CG2 5619 C CD1 . ILE D 135 ? 0.6884 0.5196 0.4891 -0.0835 -0.1267 -0.0174 138 ILE D CD1 5620 N N . SER D 136 ? 0.7968 0.5252 0.4799 -0.1137 -0.0462 -0.0413 139 SER D N 5621 C CA . SER D 136 ? 0.8419 0.5393 0.4811 -0.1205 -0.0289 -0.0464 139 SER D CA 5622 C C . SER D 136 ? 0.8513 0.5250 0.4825 -0.1034 0.0004 -0.0446 139 SER D C 5623 O O . SER D 136 ? 0.8735 0.5376 0.4851 -0.0969 0.0143 -0.0411 139 SER D O 5624 C CB . SER D 136 ? 0.8807 0.5637 0.4897 -0.1447 -0.0290 -0.0653 139 SER D CB 5625 O OG . SER D 136 ? 0.8801 0.5996 0.4965 -0.1553 -0.0583 -0.0680 139 SER D OG 5626 N N . HIS D 137 ? 0.8402 0.5065 0.4842 -0.0929 0.0108 -0.0462 140 HIS D N 5627 C CA . HIS D 137 ? 0.8641 0.5018 0.4891 -0.0699 0.0407 -0.0440 140 HIS D CA 5628 C C . HIS D 137 ? 0.8315 0.5084 0.4862 -0.0408 0.0424 -0.0320 140 HIS D C 5629 O O . HIS D 137 ? 0.8554 0.5260 0.4933 -0.0192 0.0637 -0.0292 140 HIS D O 5630 C CB . HIS D 137 ? 0.8843 0.4879 0.4981 -0.0690 0.0558 -0.0495 140 HIS D CB 5631 C CG . HIS D 137 ? 0.9219 0.4852 0.5056 -0.0376 0.0892 -0.0438 140 HIS D CG 5632 N ND1 . HIS D 137 ? 0.9769 0.4954 0.5142 -0.0300 0.1157 -0.0468 140 HIS D ND1 5633 C CD2 . HIS D 137 ? 0.9227 0.4819 0.5103 -0.0069 0.1016 -0.0342 140 HIS D CD2 5634 C CE1 . HIS D 137 ? 1.0139 0.5014 0.5280 0.0072 0.1435 -0.0380 140 HIS D CE1 5635 N NE2 . HIS D 137 ? 0.9829 0.4953 0.5255 0.0225 0.1348 -0.0296 140 HIS D NE2 5636 N N . THR D 138 ? 0.7820 0.5033 0.4805 -0.0405 0.0211 -0.0273 141 THR D N 5637 C CA . THR D 138 ? 0.7522 0.5205 0.4833 -0.0184 0.0218 -0.0218 141 THR D CA 5638 C C . THR D 138 ? 0.7294 0.5330 0.4855 -0.0328 0.0086 -0.0207 141 THR D C 5639 O O . THR D 138 ? 0.7100 0.5581 0.4921 -0.0228 0.0125 -0.0214 141 THR D O 5640 C CB . THR D 138 ? 0.7234 0.5124 0.4819 -0.0045 0.0143 -0.0201 141 THR D CB 5641 O OG1 . THR D 138 ? 0.6865 0.4899 0.4720 -0.0248 -0.0095 -0.0215 141 THR D OG1 5642 C CG2 . THR D 138 ? 0.7551 0.4967 0.4822 0.0063 0.0316 -0.0200 141 THR D CG2 5643 N N . GLN D 139 ? 0.7394 0.5240 0.4848 -0.0561 -0.0052 -0.0198 142 GLN D N 5644 C CA . GLN D 139 ? 0.7342 0.5334 0.4926 -0.0699 -0.0152 -0.0159 142 GLN D CA 5645 C C . GLN D 139 ? 0.7015 0.5342 0.5022 -0.0671 -0.0253 -0.0168 142 GLN D C 5646 O O . GLN D 139 ? 0.7009 0.5493 0.5162 -0.0769 -0.0236 -0.0173 142 GLN D O 5647 C CB . GLN D 139 ? 0.7540 0.5583 0.4991 -0.0735 0.0027 -0.0157 142 GLN D CB 5648 C CG . GLN D 139 ? 0.7957 0.5623 0.4933 -0.0787 0.0124 -0.0155 142 GLN D CG 5649 C CD . GLN D 139 ? 0.8162 0.5534 0.4860 -0.0951 -0.0052 -0.0115 142 GLN D CD 5650 O OE1 . GLN D 139 ? 0.8108 0.5487 0.4857 -0.1024 -0.0171 -0.0040 142 GLN D OE1 5651 N NE2 . GLN D 139 ? 0.8423 0.5536 0.4788 -0.0996 -0.0055 -0.0177 142 GLN D NE2 5652 N N . LYS D 140 ? 0.6845 0.5237 0.5007 -0.0564 -0.0327 -0.0187 143 LYS D N 5653 C CA . LYS D 140 ? 0.6563 0.5230 0.5079 -0.0534 -0.0435 -0.0211 143 LYS D CA 5654 C C . LYS D 140 ? 0.6513 0.5019 0.5051 -0.0561 -0.0594 -0.0197 143 LYS D C 5655 O O . LYS D 140 ? 0.6691 0.4969 0.5014 -0.0593 -0.0594 -0.0202 143 LYS D O 5656 C CB . LYS D 140 ? 0.6391 0.5435 0.5095 -0.0321 -0.0345 -0.0257 143 LYS D CB 5657 C CG . LYS D 140 ? 0.6418 0.5873 0.5224 -0.0279 -0.0212 -0.0310 143 LYS D CG 5658 C CD . LYS D 140 ? 0.6312 0.6258 0.5277 0.0011 -0.0154 -0.0351 143 LYS D CD 5659 C CE . LYS D 140 ? 0.6663 0.6351 0.5293 0.0295 0.0000 -0.0275 143 LYS D CE 5660 N NZ . LYS D 140 ? 0.6894 0.6675 0.5379 0.0366 0.0172 -0.0281 143 LYS D NZ 5661 N N . ALA D 141 ? 0.6337 0.4990 0.5136 -0.0566 -0.0711 -0.0208 144 ALA D N 5662 C CA . ALA D 141 ? 0.6293 0.4891 0.5166 -0.0569 -0.0862 -0.0203 144 ALA D CA 5663 C C . ALA D 141 ? 0.6036 0.4872 0.5210 -0.0475 -0.0894 -0.0250 144 ALA D C 5664 O O . ALA D 141 ? 0.5946 0.4923 0.5295 -0.0483 -0.0902 -0.0282 144 ALA D O 5665 C CB . ALA D 141 ? 0.6461 0.4900 0.5241 -0.0636 -0.0988 -0.0140 144 ALA D CB 5666 N N . THR D 142 ? 0.5986 0.4837 0.5184 -0.0415 -0.0885 -0.0274 145 THR D N 5667 C CA . THR D 142 ? 0.5806 0.4862 0.5231 -0.0310 -0.0897 -0.0312 145 THR D CA 5668 C C . THR D 142 ? 0.5735 0.4820 0.5314 -0.0345 -0.1027 -0.0331 145 THR D C 5669 O O . THR D 142 ? 0.5846 0.4867 0.5354 -0.0420 -0.1050 -0.0345 145 THR D O 5670 C CB . THR D 142 ? 0.5890 0.4907 0.5184 -0.0178 -0.0740 -0.0309 145 THR D CB 5671 O OG1 . THR D 142 ? 0.6076 0.5075 0.5187 -0.0082 -0.0609 -0.0280 145 THR D OG1 5672 C CG2 . THR D 142 ? 0.5725 0.4988 0.5197 -0.0030 -0.0743 -0.0337 145 THR D CG2 5673 N N . LEU D 143 ? 0.5606 0.4824 0.5397 -0.0298 -0.1098 -0.0357 146 LEU D N 5674 C CA . LEU D 143 ? 0.5542 0.4843 0.5507 -0.0264 -0.1197 -0.0381 146 LEU D CA 5675 C C . LEU D 143 ? 0.5400 0.4869 0.5493 -0.0180 -0.1128 -0.0437 146 LEU D C 5676 O O . LEU D 143 ? 0.5359 0.4935 0.5464 -0.0109 -0.1063 -0.0464 146 LEU D O 5677 C CB . LEU D 143 ? 0.5610 0.4834 0.5648 -0.0235 -0.1276 -0.0372 146 LEU D CB 5678 C CG . LEU D 143 ? 0.5902 0.4880 0.5742 -0.0259 -0.1339 -0.0281 146 LEU D CG 5679 C CD1 . LEU D 143 ? 0.6027 0.4817 0.5707 -0.0366 -0.1232 -0.0265 146 LEU D CD1 5680 C CD2 . LEU D 143 ? 0.6046 0.4905 0.5920 -0.0133 -0.1417 -0.0249 146 LEU D CD2 5681 N N . VAL D 144 ? 0.5385 0.4929 0.5561 -0.0190 -0.1134 -0.0465 147 VAL D N 5682 C CA . VAL D 144 ? 0.5315 0.4965 0.5563 -0.0115 -0.1039 -0.0507 147 VAL D CA 5683 C C . VAL D 144 ? 0.5244 0.5085 0.5748 -0.0068 -0.1130 -0.0561 147 VAL D C 5684 O O . VAL D 144 ? 0.5288 0.5236 0.5903 -0.0107 -0.1221 -0.0575 147 VAL D O 5685 C CB . VAL D 144 ? 0.5479 0.4993 0.5557 -0.0198 -0.0877 -0.0513 147 VAL D CB 5686 C CG1 . VAL D 144 ? 0.5451 0.5022 0.5566 -0.0131 -0.0753 -0.0543 147 VAL D CG1 5687 C CG2 . VAL D 144 ? 0.5648 0.4891 0.5409 -0.0171 -0.0739 -0.0450 147 VAL D CG2 5688 N N . CYS D 145 ? 0.5203 0.5134 0.5790 0.0036 -0.1108 -0.0604 148 CYS D N 5689 C CA . CYS D 145 ? 0.5208 0.5287 0.6006 0.0107 -0.1152 -0.0667 148 CYS D CA 5690 C C . CYS D 145 ? 0.5196 0.5399 0.6013 0.0141 -0.1024 -0.0706 148 CYS D C 5691 O O . CYS D 145 ? 0.5226 0.5392 0.5875 0.0202 -0.0918 -0.0694 148 CYS D O 5692 C CB . CYS D 145 ? 0.5241 0.5277 0.6083 0.0171 -0.1192 -0.0723 148 CYS D CB 5693 S SG . CYS D 145 ? 0.5416 0.5524 0.6458 0.0297 -0.1221 -0.0799 148 CYS D SG 5694 N N . LEU D 146 ? 0.5192 0.5574 0.6198 0.0122 -0.1025 -0.0754 149 LEU D N 5695 C CA . LEU D 146 ? 0.5250 0.5735 0.6272 0.0114 -0.0864 -0.0800 149 LEU D CA 5696 C C . LEU D 146 ? 0.5196 0.5907 0.6450 0.0237 -0.0892 -0.0881 149 LEU D C 5697 O O . LEU D 146 ? 0.5182 0.6097 0.6672 0.0278 -0.1001 -0.0917 149 LEU D O 5698 C CB . LEU D 146 ? 0.5365 0.5918 0.6408 -0.0086 -0.0769 -0.0832 149 LEU D CB 5699 C CG . LEU D 146 ? 0.5653 0.6035 0.6490 -0.0190 -0.0489 -0.0844 149 LEU D CG 5700 C CD1 . LEU D 146 ? 0.5904 0.5867 0.6326 -0.0087 -0.0367 -0.0727 149 LEU D CD1 5701 C CD2 . LEU D 146 ? 0.5813 0.6265 0.6688 -0.0482 -0.0382 -0.0936 149 LEU D CD2 5702 N N . ALA D 147 ? 0.5212 0.5897 0.6363 0.0333 -0.0794 -0.0908 150 ALA D N 5703 C CA . ALA D 147 ? 0.5206 0.6071 0.6522 0.0445 -0.0772 -0.1002 150 ALA D CA 5704 C C . ALA D 147 ? 0.5318 0.6281 0.6596 0.0402 -0.0561 -0.1025 150 ALA D C 5705 O O . ALA D 147 ? 0.5480 0.6261 0.6452 0.0419 -0.0414 -0.0970 150 ALA D O 5706 C CB . ALA D 147 ? 0.5233 0.6020 0.6433 0.0558 -0.0807 -0.1057 150 ALA D CB 5707 N N . THR D 148 ? 0.5281 0.6542 0.6847 0.0365 -0.0528 -0.1103 151 THR D N 5708 C CA . THR D 148 ? 0.5409 0.6784 0.6973 0.0230 -0.0286 -0.1147 151 THR D CA 5709 C C . THR D 148 ? 0.5430 0.7127 0.7221 0.0323 -0.0201 -0.1258 151 THR D C 5710 O O . THR D 148 ? 0.5317 0.7273 0.7393 0.0474 -0.0348 -0.1320 151 THR D O 5711 C CB . THR D 148 ? 0.5425 0.6991 0.7152 -0.0023 -0.0259 -0.1190 151 THR D CB 5712 O OG1 . THR D 148 ? 0.5202 0.7127 0.7260 0.0049 -0.0511 -0.1227 151 THR D OG1 5713 C CG2 . THR D 148 ? 0.5554 0.6687 0.6930 -0.0167 -0.0195 -0.1094 151 THR D CG2 5714 N N . GLY D 149 ? 0.5653 0.7276 0.7263 0.0255 0.0067 -0.1271 152 GLY D N 5715 C CA . GLY D 149 ? 0.5706 0.7659 0.7520 0.0288 0.0218 -0.1387 152 GLY D CA 5716 C C . GLY D 149 ? 0.5660 0.7644 0.7484 0.0561 0.0133 -0.1433 152 GLY D C 5717 O O . GLY D 149 ? 0.5627 0.7970 0.7785 0.0670 0.0103 -0.1542 152 GLY D O 5718 N N . PHE D 150 ? 0.5709 0.7351 0.7156 0.0681 0.0105 -0.1370 153 PHE D N 5719 C CA . PHE D 150 ? 0.5721 0.7372 0.7116 0.0884 0.0046 -0.1459 153 PHE D CA 5720 C C . PHE D 150 ? 0.5998 0.7551 0.7008 0.0961 0.0245 -0.1460 153 PHE D C 5721 O O . PHE D 150 ? 0.6164 0.7497 0.6810 0.0926 0.0380 -0.1336 153 PHE D O 5722 C CB . PHE D 150 ? 0.5604 0.7071 0.6929 0.0949 -0.0189 -0.1459 153 PHE D CB 5723 C CG . PHE D 150 ? 0.5606 0.6873 0.6604 0.0909 -0.0225 -0.1348 153 PHE D CG 5724 C CD1 . PHE D 150 ? 0.5472 0.6627 0.6494 0.0787 -0.0286 -0.1233 153 PHE D CD1 5725 C CD2 . PHE D 150 ? 0.5788 0.7034 0.6444 0.1022 -0.0207 -0.1372 153 PHE D CD2 5726 C CE1 . PHE D 150 ? 0.5463 0.6444 0.6180 0.0796 -0.0302 -0.1130 153 PHE D CE1 5727 C CE2 . PHE D 150 ? 0.5779 0.6945 0.6147 0.1054 -0.0248 -0.1269 153 PHE D CE2 5728 C CZ . PHE D 150 ? 0.5649 0.6660 0.6052 0.0950 -0.0285 -0.1142 153 PHE D CZ 5729 N N . TYR D 151 ? 0.6104 0.7783 0.7143 0.1096 0.0278 -0.1593 154 TYR D N 5730 C CA . TYR D 151 ? 0.6429 0.8061 0.7076 0.1202 0.0451 -0.1615 154 TYR D CA 5731 C C . TYR D 151 ? 0.6505 0.8215 0.7153 0.1346 0.0364 -0.1803 154 TYR D C 5732 O O . TYR D 151 ? 0.6455 0.8273 0.7437 0.1384 0.0347 -0.1919 154 TYR D O 5733 C CB . TYR D 151 ? 0.6648 0.8370 0.7310 0.1127 0.0760 -0.1604 154 TYR D CB 5734 C CG . TYR D 151 ? 0.7105 0.8667 0.7229 0.1235 0.0990 -0.1559 154 TYR D CG 5735 C CD1 . TYR D 151 ? 0.7367 0.8590 0.6980 0.1250 0.1121 -0.1368 154 TYR D CD1 5736 C CD2 . TYR D 151 ? 0.7325 0.9038 0.7389 0.1361 0.1095 -0.1698 154 TYR D CD2 5737 C CE1 . TYR D 151 ? 0.7924 0.8964 0.6952 0.1415 0.1343 -0.1292 154 TYR D CE1 5738 C CE2 . TYR D 151 ? 0.7780 0.9351 0.7287 0.1485 0.1308 -0.1647 154 TYR D CE2 5739 C CZ . TYR D 151 ? 0.8098 0.9334 0.7075 0.1525 0.1427 -0.1432 154 TYR D CZ 5740 O OH . TYR D 151 ? 0.8710 0.9769 0.7049 0.1710 0.1647 -0.1348 154 TYR D OH 5741 N N . PRO D 152 ? 0.6694 0.8366 0.6945 0.1439 0.0315 -0.1848 155 PRO D N 5742 C CA . PRO D 152 ? 0.6834 0.8441 0.6647 0.1495 0.0320 -0.1702 155 PRO D CA 5743 C C . PRO D 152 ? 0.6588 0.8160 0.6469 0.1432 0.0093 -0.1647 155 PRO D C 5744 O O . PRO D 152 ? 0.6325 0.7861 0.6570 0.1317 -0.0043 -0.1701 155 PRO D O 5745 C CB . PRO D 152 ? 0.7149 0.8917 0.6580 0.1657 0.0322 -0.1843 155 PRO D CB 5746 C CG . PRO D 152 ? 0.7146 0.8981 0.6834 0.1631 0.0314 -0.2090 155 PRO D CG 5747 C CD . PRO D 152 ? 0.6845 0.8575 0.7038 0.1515 0.0250 -0.2080 155 PRO D CD 5748 N N . ASP D 153 ? 0.6743 0.8327 0.6246 0.1540 0.0069 -0.1530 156 ASP D N 5749 C CA . ASP D 153 ? 0.6562 0.8170 0.6121 0.1495 -0.0120 -0.1479 156 ASP D CA 5750 C C . ASP D 153 ? 0.6459 0.8347 0.6117 0.1452 -0.0333 -0.1711 156 ASP D C 5751 O O . ASP D 153 ? 0.6573 0.8766 0.5994 0.1554 -0.0431 -0.1755 156 ASP D O 5752 C CB . ASP D 153 ? 0.6800 0.8322 0.5919 0.1670 -0.0043 -0.1258 156 ASP D CB 5753 C CG . ASP D 153 ? 0.7323 0.9038 0.5929 0.1954 0.0025 -0.1251 156 ASP D CG 5754 O OD1 . ASP D 153 ? 0.7557 0.9425 0.6134 0.1976 0.0060 -0.1410 156 ASP D OD1 5755 O OD2 . ASP D 153 ? 0.7652 0.9366 0.5844 0.2190 0.0048 -0.1081 156 ASP D OD2 5756 N N . HIS D 154 ? 0.6330 0.8118 0.6325 0.1300 -0.0383 -0.1869 157 HIS D N 5757 C CA . HIS D 154 ? 0.6354 0.8246 0.6428 0.1180 -0.0513 -0.2120 157 HIS D CA 5758 C C . HIS D 154 ? 0.6137 0.7751 0.6514 0.1007 -0.0596 -0.2100 157 HIS D C 5759 O O . HIS D 154 ? 0.6227 0.7573 0.6773 0.0952 -0.0565 -0.2198 157 HIS D O 5760 C CB . HIS D 154 ? 0.6636 0.8512 0.6679 0.1192 -0.0429 -0.2354 157 HIS D CB 5761 C CG . HIS D 154 ? 0.6944 0.9182 0.6624 0.1318 -0.0405 -0.2477 157 HIS D CG 5762 N ND1 . HIS D 154 ? 0.7236 0.9745 0.6794 0.1224 -0.0481 -0.2791 157 HIS D ND1 5763 C CD2 . HIS D 154 ? 0.7138 0.9510 0.6503 0.1531 -0.0299 -0.2336 157 HIS D CD2 5764 C CE1 . HIS D 154 ? 0.7506 1.0388 0.6706 0.1400 -0.0461 -0.2840 157 HIS D CE1 5765 N NE2 . HIS D 154 ? 0.7467 1.0227 0.6516 0.1611 -0.0343 -0.2544 157 HIS D NE2 5766 N N . VAL D 155 ? 0.5905 0.7551 0.6298 0.0958 -0.0682 -0.1960 158 VAL D N 5767 C CA . VAL D 155 ? 0.5747 0.7126 0.6359 0.0803 -0.0755 -0.1918 158 VAL D CA 5768 C C . VAL D 155 ? 0.5697 0.7250 0.6273 0.0667 -0.0857 -0.1994 158 VAL D C 5769 O O . VAL D 155 ? 0.5651 0.7572 0.6075 0.0752 -0.0896 -0.1957 158 VAL D O 5770 C CB . VAL D 155 ? 0.5560 0.6746 0.6303 0.0830 -0.0738 -0.1666 158 VAL D CB 5771 C CG1 . VAL D 155 ? 0.5570 0.6670 0.6465 0.0907 -0.0642 -0.1648 158 VAL D CG1 5772 C CG2 . VAL D 155 ? 0.5477 0.6784 0.6024 0.0907 -0.0705 -0.1489 158 VAL D CG2 5773 N N . GLU D 156 ? 0.5769 0.7052 0.6462 0.0474 -0.0874 -0.2099 159 GLU D N 5774 C CA . GLU D 156 ? 0.5736 0.7144 0.6441 0.0279 -0.0932 -0.2183 159 GLU D CA 5775 C C . GLU D 156 ? 0.5637 0.6610 0.6443 0.0201 -0.0942 -0.2004 159 GLU D C 5776 O O . GLU D 156 ? 0.5845 0.6337 0.6677 0.0148 -0.0888 -0.2018 159 GLU D O 5777 C CB . GLU D 156 ? 0.6070 0.7522 0.6736 0.0046 -0.0886 -0.2531 159 GLU D CB 5778 C CG . GLU D 156 ? 0.6228 0.8305 0.6772 0.0089 -0.0917 -0.2757 159 GLU D CG 5779 C CD . GLU D 156 ? 0.6712 0.8784 0.7201 -0.0185 -0.0841 -0.3159 159 GLU D CD 5780 O OE1 . GLU D 156 ? 0.7020 0.8444 0.7481 -0.0265 -0.0712 -0.3226 159 GLU D OE1 5781 O OE2 . GLU D 156 ? 0.6777 0.9513 0.7227 -0.0311 -0.0899 -0.3425 159 GLU D OE2 5782 N N . LEU D 157 ? 0.5372 0.6492 0.6182 0.0230 -0.0998 -0.1828 160 LEU D N 5783 C CA . LEU D 157 ? 0.5281 0.6043 0.6144 0.0177 -0.1018 -0.1644 160 LEU D CA 5784 C C . LEU D 157 ? 0.5347 0.6074 0.6202 -0.0050 -0.1013 -0.1731 160 LEU D C 5785 O O . LEU D 157 ? 0.5319 0.6507 0.6171 -0.0124 -0.1028 -0.1862 160 LEU D O 5786 C CB . LEU D 157 ? 0.5043 0.5897 0.5877 0.0317 -0.1041 -0.1413 160 LEU D CB 5787 C CG . LEU D 157 ? 0.5061 0.5600 0.5936 0.0287 -0.1067 -0.1227 160 LEU D CG 5788 C CD1 . LEU D 157 ? 0.5029 0.5595 0.5879 0.0394 -0.1034 -0.1077 160 LEU D CD1 5789 C CD2 . LEU D 157 ? 0.5100 0.5613 0.5921 0.0162 -0.1091 -0.1190 160 LEU D CD2 5790 N N . SER D 158 ? 0.5488 0.5707 0.6323 -0.0144 -0.0982 -0.1657 161 SER D N 5791 C CA . SER D 158 ? 0.5644 0.5718 0.6427 -0.0390 -0.0927 -0.1723 161 SER D CA 5792 C C . SER D 158 ? 0.5727 0.5300 0.6422 -0.0376 -0.0928 -0.1499 161 SER D C 5793 O O . SER D 158 ? 0.5842 0.5066 0.6502 -0.0209 -0.0949 -0.1365 161 SER D O 5794 C CB . SER D 158 ? 0.6086 0.5952 0.6803 -0.0631 -0.0794 -0.2006 161 SER D CB 5795 O OG . SER D 158 ? 0.6428 0.5651 0.7028 -0.0541 -0.0716 -0.1970 161 SER D OG 5796 N N . TRP D 159 ? 0.5708 0.5314 0.6361 -0.0533 -0.0905 -0.1471 162 TRP D N 5797 C CA . TRP D 159 ? 0.5833 0.4992 0.6343 -0.0535 -0.0898 -0.1269 162 TRP D CA 5798 C C . TRP D 159 ? 0.6427 0.5013 0.6732 -0.0754 -0.0730 -0.1343 162 TRP D C 5799 O O . TRP D 159 ? 0.6602 0.5315 0.6924 -0.1036 -0.0605 -0.1572 162 TRP D O 5800 C CB . TRP D 159 ? 0.5523 0.5002 0.6054 -0.0560 -0.0942 -0.1174 162 TRP D CB 5801 C CG . TRP D 159 ? 0.5097 0.4833 0.5689 -0.0342 -0.1051 -0.1033 162 TRP D CG 5802 C CD1 . TRP D 159 ? 0.4764 0.4964 0.5432 -0.0233 -0.1072 -0.1073 162 TRP D CD1 5803 C CD2 . TRP D 159 ? 0.4941 0.4460 0.5473 -0.0220 -0.1122 -0.0842 162 TRP D CD2 5804 N NE1 . TRP D 159 ? 0.4587 0.4752 0.5215 -0.0081 -0.1109 -0.0914 162 TRP D NE1 5805 C CE2 . TRP D 159 ? 0.4664 0.4474 0.5245 -0.0103 -0.1149 -0.0797 162 TRP D CE2 5806 C CE3 . TRP D 159 ? 0.5102 0.4233 0.5512 -0.0192 -0.1158 -0.0713 162 TRP D CE3 5807 C CZ2 . TRP D 159 ? 0.4609 0.4343 0.5160 -0.0039 -0.1191 -0.0674 162 TRP D CZ2 5808 C CZ3 . TRP D 159 ? 0.4965 0.4153 0.5375 -0.0084 -0.1251 -0.0588 162 TRP D CZ3 5809 C CH2 . TRP D 159 ? 0.4746 0.4239 0.5246 -0.0048 -0.1258 -0.0592 162 TRP D CH2 5810 N N . TRP D 160 ? 0.6811 0.4779 0.6895 -0.0622 -0.0709 -0.1157 163 TRP D N 5811 C CA . TRP D 160 ? 0.7558 0.4778 0.7317 -0.0773 -0.0500 -0.1171 163 TRP D CA 5812 C C . TRP D 160 ? 0.7813 0.4654 0.7311 -0.0708 -0.0503 -0.0917 163 TRP D C 5813 O O . TRP D 160 ? 0.7792 0.4548 0.7219 -0.0402 -0.0645 -0.0695 163 TRP D O 5814 C CB . TRP D 160 ? 0.8045 0.4711 0.7640 -0.0593 -0.0416 -0.1184 163 TRP D CB 5815 C CG . TRP D 160 ? 0.7979 0.4896 0.7742 -0.0713 -0.0360 -0.1474 163 TRP D CG 5816 C CD1 . TRP D 160 ? 0.7394 0.4965 0.7459 -0.0578 -0.0519 -0.1543 163 TRP D CD1 5817 C CD2 . TRP D 160 ? 0.8565 0.5056 0.8151 -0.1011 -0.0105 -0.1750 163 TRP D CD2 5818 N NE1 . TRP D 160 ? 0.7598 0.5231 0.7686 -0.0742 -0.0409 -0.1836 163 TRP D NE1 5819 C CE2 . TRP D 160 ? 0.8263 0.5259 0.8077 -0.1028 -0.0157 -0.1989 163 TRP D CE2 5820 C CE3 . TRP D 160 ? 0.9368 0.5056 0.8582 -0.1290 0.0194 -0.1834 163 TRP D CE3 5821 C CZ2 . TRP D 160 ? 0.8750 0.5544 0.8460 -0.1327 0.0051 -0.2335 163 TRP D CZ2 5822 C CZ3 . TRP D 160 ? 0.9915 0.5338 0.9022 -0.1621 0.0438 -0.2184 163 TRP D CZ3 5823 C CH2 . TRP D 160 ? 0.9598 0.5608 0.8966 -0.1642 0.0352 -0.2445 163 TRP D CH2 5824 N N . VAL D 161 ? 0.8092 0.4777 0.7450 -0.1007 -0.0342 -0.0970 164 VAL D N 5825 C CA . VAL D 161 ? 0.8422 0.4702 0.7465 -0.0975 -0.0308 -0.0741 164 VAL D CA 5826 C C . VAL D 161 ? 0.9422 0.4721 0.7975 -0.1095 -0.0012 -0.0712 164 VAL D C 5827 O O . VAL D 161 ? 0.9770 0.4882 0.8275 -0.1480 0.0244 -0.0942 164 VAL D O 5828 C CB . VAL D 161 ? 0.8037 0.4834 0.7227 -0.1188 -0.0319 -0.0779 164 VAL D CB 5829 C CG1 . VAL D 161 ? 0.8400 0.4741 0.7215 -0.1164 -0.0264 -0.0550 164 VAL D CG1 5830 C CG2 . VAL D 161 ? 0.7224 0.4812 0.6777 -0.1022 -0.0560 -0.0774 164 VAL D CG2 5831 N N . ASN D 162 ? 0.9953 0.4645 0.8120 -0.0754 -0.0035 -0.0437 165 ASN D N 5832 C CA . ASN D 162 ? 1.1098 0.4676 0.8648 -0.0736 0.0263 -0.0323 165 ASN D CA 5833 C C . ASN D 162 ? 1.1731 0.4715 0.9142 -0.0875 0.0535 -0.0534 165 ASN D C 5834 O O . ASN D 162 ? 1.2757 0.4737 0.9634 -0.1023 0.0894 -0.0525 165 ASN D O 5835 C CB . ASN D 162 ? 1.1530 0.4742 0.8758 -0.1050 0.0488 -0.0280 165 ASN D CB 5836 C CG . ASN D 162 ? 1.1183 0.4739 0.8369 -0.0851 0.0261 -0.0034 165 ASN D CG 5837 O OD1 . ASN D 162 ? 1.1164 0.4742 0.8230 -0.0416 0.0034 0.0199 165 ASN D OD1 5838 N ND2 . ASN D 162 ? 1.0932 0.4805 0.8216 -0.1177 0.0330 -0.0111 165 ASN D ND2 5839 N N . GLY D 163 ? 1.1221 0.4760 0.9058 -0.0834 0.0395 -0.0726 166 GLY D N 5840 C CA . GLY D 163 ? 1.1807 0.4847 0.9526 -0.0950 0.0631 -0.0956 166 GLY D CA 5841 C C . GLY D 163 ? 1.1554 0.5113 0.9614 -0.1477 0.0736 -0.1377 166 GLY D C 5842 O O . GLY D 163 ? 1.1921 0.5218 0.9938 -0.1616 0.0905 -0.1630 166 GLY D O 5843 N N . LYS D 164 ? 1.0981 0.5312 0.9363 -0.1751 0.0640 -0.1465 167 LYS D N 5844 C CA . LYS D 164 ? 1.0664 0.5754 0.9425 -0.2192 0.0681 -0.1862 167 LYS D CA 5845 C C . LYS D 164 ? 0.9598 0.5882 0.8894 -0.2009 0.0318 -0.1865 167 LYS D C 5846 O O . LYS D 164 ? 0.9110 0.5689 0.8494 -0.1767 0.0114 -0.1607 167 LYS D O 5847 C CB . LYS D 164 ? 1.1019 0.6045 0.9682 -0.2691 0.0945 -0.2014 167 LYS D CB 5848 C CG . LYS D 164 ? 1.2250 0.6065 1.0353 -0.3016 0.1408 -0.2114 167 LYS D CG 5849 N N . GLU D 165 ? 0.9343 0.6258 0.8935 -0.2125 0.0264 -0.2163 168 GLU D N 5850 C CA . GLU D 165 ? 0.8510 0.6462 0.8512 -0.1922 -0.0031 -0.2168 168 GLU D CA 5851 C C . GLU D 165 ? 0.8138 0.6869 0.8371 -0.2103 -0.0074 -0.2241 168 GLU D C 5852 O O . GLU D 165 ? 0.8426 0.7382 0.8708 -0.2517 0.0105 -0.2529 168 GLU D O 5853 C CB . GLU D 165 ? 0.8433 0.6797 0.8598 -0.1962 -0.0059 -0.2460 168 GLU D CB 5854 C CG . GLU D 165 ? 0.7781 0.6837 0.8197 -0.1589 -0.0338 -0.2350 168 GLU D CG 5855 C CD . GLU D 165 ? 0.7701 0.7410 0.8278 -0.1671 -0.0373 -0.2673 168 GLU D CD 5856 O OE1 . GLU D 165 ? 0.7883 0.7345 0.8392 -0.1533 -0.0368 -0.2720 168 GLU D OE1 5857 O OE2 . GLU D 165 ? 0.7493 0.8012 0.8253 -0.1850 -0.0409 -0.2887 168 GLU D OE2 5858 N N . VAL D 166 ? 0.7579 0.6725 0.7944 -0.1801 -0.0290 -0.1999 169 VAL D N 5859 C CA . VAL D 166 ? 0.7240 0.7100 0.7791 -0.1865 -0.0333 -0.2023 169 VAL D CA 5860 C C . VAL D 166 ? 0.6719 0.7526 0.7543 -0.1653 -0.0519 -0.2108 169 VAL D C 5861 O O . VAL D 166 ? 0.6521 0.7336 0.7358 -0.1383 -0.0649 -0.2029 169 VAL D O 5862 C CB . VAL D 166 ? 0.7124 0.6682 0.7529 -0.1686 -0.0386 -0.1691 169 VAL D CB 5863 C CG1 . VAL D 166 ? 0.7761 0.6514 0.7847 -0.1912 -0.0173 -0.1619 169 VAL D CG1 5864 C CG2 . VAL D 166 ? 0.6795 0.6145 0.7150 -0.1298 -0.0578 -0.1425 169 VAL D CG2 5865 N N . HIS D 167 ? 0.6572 0.8184 0.7588 -0.1751 -0.0514 -0.2263 170 HIS D N 5866 C CA . HIS D 167 ? 0.6182 0.8703 0.7377 -0.1463 -0.0679 -0.2298 170 HIS D CA 5867 C C . HIS D 167 ? 0.5942 0.8796 0.7152 -0.1248 -0.0717 -0.2109 170 HIS D C 5868 O O . HIS D 167 ? 0.5696 0.8876 0.6884 -0.0866 -0.0835 -0.1963 170 HIS D O 5869 C CB . HIS D 167 ? 0.6251 0.9651 0.7662 -0.1685 -0.0661 -0.2706 170 HIS D CB 5870 C CG . HIS D 167 ? 0.6598 0.9677 0.7955 -0.1891 -0.0607 -0.2928 170 HIS D CG 5871 N ND1 . HIS D 167 ? 0.7128 0.9931 0.8464 -0.2392 -0.0391 -0.3232 170 HIS D ND1 5872 C CD2 . HIS D 167 ? 0.6561 0.9487 0.7842 -0.1670 -0.0704 -0.2897 170 HIS D CD2 5873 C CE1 . HIS D 167 ? 0.7417 0.9889 0.8654 -0.2454 -0.0362 -0.3382 170 HIS D CE1 5874 N NE2 . HIS D 167 ? 0.7074 0.9654 0.8295 -0.2012 -0.0560 -0.3182 170 HIS D NE2 5875 N N . SER D 168 ? 0.6109 0.8799 0.7302 -0.1490 -0.0581 -0.2108 171 SER D N 5876 C CA . SER D 168 ? 0.5946 0.8869 0.7122 -0.1315 -0.0578 -0.1944 171 SER D CA 5877 C C . SER D 168 ? 0.5837 0.8102 0.6768 -0.1001 -0.0661 -0.1590 171 SER D C 5878 O O . SER D 168 ? 0.5993 0.7475 0.6752 -0.1068 -0.0658 -0.1452 171 SER D O 5879 C CB . SER D 168 ? 0.6222 0.9012 0.7395 -0.1689 -0.0381 -0.2029 171 SER D CB 5880 O OG . SER D 168 ? 0.6075 0.9301 0.7285 -0.1531 -0.0359 -0.1944 171 SER D OG 5881 N N . GLY D 169 ? 0.5636 0.8241 0.6530 -0.0652 -0.0719 -0.1459 172 GLY D N 5882 C CA . GLY D 169 ? 0.5589 0.7619 0.6236 -0.0406 -0.0755 -0.1174 172 GLY D CA 5883 C C . GLY D 169 ? 0.5516 0.7246 0.6096 -0.0245 -0.0850 -0.1089 172 GLY D C 5884 O O . GLY D 169 ? 0.5534 0.6744 0.5940 -0.0154 -0.0867 -0.0902 172 GLY D O 5885 N N . VAL D 170 ? 0.5468 0.7575 0.6189 -0.0234 -0.0901 -0.1252 173 VAL D N 5886 C CA . VAL D 170 ? 0.5423 0.7307 0.6089 -0.0085 -0.0968 -0.1193 173 VAL D CA 5887 C C . VAL D 170 ? 0.5390 0.7740 0.5976 0.0263 -0.0989 -0.1167 173 VAL D C 5888 O O . VAL D 170 ? 0.5358 0.8424 0.6031 0.0350 -0.1006 -0.1313 173 VAL D O 5889 C CB . VAL D 170 ? 0.5506 0.7295 0.6299 -0.0306 -0.0987 -0.1378 173 VAL D CB 5890 C CG1 . VAL D 170 ? 0.5391 0.7109 0.6152 -0.0121 -0.1043 -0.1351 173 VAL D CG1 5891 C CG2 . VAL D 170 ? 0.5688 0.6809 0.6429 -0.0542 -0.0941 -0.1326 173 VAL D CG2 5892 N N . CYS D 171 ? 0.5448 0.7399 0.5837 0.0465 -0.0970 -0.0982 174 CYS D N 5893 C CA . CYS D 171 ? 0.5579 0.7769 0.5798 0.0796 -0.0954 -0.0933 174 CYS D CA 5894 C C . CYS D 171 ? 0.5592 0.7367 0.5761 0.0785 -0.0948 -0.0881 174 CYS D C 5895 O O . CYS D 171 ? 0.5640 0.6875 0.5759 0.0691 -0.0907 -0.0762 174 CYS D O 5896 C CB . CYS D 171 ? 0.5780 0.7854 0.5687 0.1112 -0.0840 -0.0734 174 CYS D CB 5897 S SG . CYS D 171 ? 0.6198 0.8752 0.5819 0.1618 -0.0806 -0.0685 174 CYS D SG 5898 N N . THR D 172 ? 0.5608 0.7709 0.5801 0.0873 -0.0988 -0.0995 175 THR D N 5899 C CA . THR D 172 ? 0.5657 0.7455 0.5798 0.0897 -0.0958 -0.0961 175 THR D CA 5900 C C . THR D 172 ? 0.5914 0.7822 0.5722 0.1252 -0.0869 -0.0849 175 THR D C 5901 O O . THR D 172 ? 0.6035 0.8477 0.5735 0.1484 -0.0902 -0.0891 175 THR D O 5902 C CB . THR D 172 ? 0.5583 0.7566 0.5946 0.0719 -0.1039 -0.1186 175 THR D CB 5903 O OG1 . THR D 172 ? 0.5501 0.7324 0.6072 0.0425 -0.1079 -0.1280 175 THR D OG1 5904 C CG2 . THR D 172 ? 0.5618 0.7276 0.5967 0.0737 -0.0996 -0.1151 175 THR D CG2 5905 N N . ASP D 173 ? 0.6109 0.7533 0.5732 0.1305 -0.0739 -0.0708 176 ASP D N 5906 C CA . ASP D 173 ? 0.6512 0.7875 0.5727 0.1633 -0.0595 -0.0582 176 ASP D CA 5907 C C . ASP D 173 ? 0.6548 0.8477 0.5767 0.1777 -0.0692 -0.0732 176 ASP D C 5908 O O . ASP D 173 ? 0.6372 0.8395 0.5853 0.1566 -0.0772 -0.0903 176 ASP D O 5909 C CB . ASP D 173 ? 0.6691 0.7455 0.5771 0.1544 -0.0410 -0.0475 176 ASP D CB 5910 C CG . ASP D 173 ? 0.6827 0.7060 0.5831 0.1393 -0.0287 -0.0358 176 ASP D CG 5911 O OD1 . ASP D 173 ? 0.7005 0.7192 0.5860 0.1498 -0.0269 -0.0281 176 ASP D OD1 5912 O OD2 . ASP D 173 ? 0.6875 0.6785 0.5969 0.1165 -0.0201 -0.0365 176 ASP D OD2 5913 N N . PRO D 174 ? 0.6842 0.9170 0.5740 0.2160 -0.0682 -0.0678 177 PRO D N 5914 C CA . PRO D 174 ? 0.6938 0.9871 0.5780 0.2317 -0.0780 -0.0834 177 PRO D CA 5915 C C . PRO D 174 ? 0.7185 0.9729 0.5803 0.2363 -0.0644 -0.0773 177 PRO D C 5916 O O . PRO D 174 ? 0.7127 0.9978 0.5879 0.2267 -0.0729 -0.0971 177 PRO D O 5917 C CB . PRO D 174 ? 0.7273 1.0693 0.5742 0.2808 -0.0783 -0.0729 177 PRO D CB 5918 C CG . PRO D 174 ? 0.7529 1.0294 0.5700 0.2971 -0.0588 -0.0444 177 PRO D CG 5919 C CD . PRO D 174 ? 0.7141 0.9440 0.5705 0.2495 -0.0592 -0.0488 177 PRO D CD 5920 N N . GLN D 175 ? 0.7527 0.9375 0.5796 0.2473 -0.0404 -0.0522 178 GLN D N 5921 C CA . GLN D 175 ? 0.7816 0.9258 0.5845 0.2492 -0.0212 -0.0453 178 GLN D CA 5922 C C . GLN D 175 ? 0.7658 0.8504 0.5925 0.2121 -0.0081 -0.0428 178 GLN D C 5923 O O . GLN D 175 ? 0.7609 0.8118 0.5927 0.1990 -0.0031 -0.0343 178 GLN D O 5924 C CB . GLN D 175 ? 0.8523 0.9646 0.5829 0.2947 0.0031 -0.0193 178 GLN D CB 5925 C CG . GLN D 175 ? 0.8820 1.0620 0.5817 0.3427 -0.0102 -0.0180 178 GLN D CG 5926 C CD . GLN D 175 ? 0.8781 1.1280 0.5854 0.3476 -0.0278 -0.0402 178 GLN D CD 5927 O OE1 . GLN D 175 ? 0.8705 1.1024 0.5902 0.3246 -0.0227 -0.0503 178 GLN D OE1 5928 N NE2 . GLN D 175 ? 0.8825 1.2183 0.5821 0.3781 -0.0480 -0.0501 178 GLN D NE2 5929 N N . PRO D 176 ? 0.7597 0.8384 0.6018 0.1957 -0.0027 -0.0522 179 PRO D N 5930 C CA . PRO D 176 ? 0.7518 0.7878 0.6144 0.1651 0.0116 -0.0508 179 PRO D CA 5931 C C . PRO D 176 ? 0.8111 0.7884 0.6227 0.1729 0.0480 -0.0319 179 PRO D C 5932 O O . PRO D 176 ? 0.8607 0.8273 0.6183 0.2065 0.0622 -0.0188 179 PRO D O 5933 C CB . PRO D 176 ? 0.7266 0.7902 0.6247 0.1512 0.0035 -0.0699 179 PRO D CB 5934 C CG . PRO D 176 ? 0.7501 0.8445 0.6187 0.1788 0.0013 -0.0743 179 PRO D CG 5935 C CD . PRO D 176 ? 0.7603 0.8789 0.6038 0.2040 -0.0101 -0.0678 179 PRO D CD 5936 N N . LEU D 177 ? 0.8126 0.7521 0.6369 0.1421 0.0649 -0.0313 180 LEU D N 5937 C CA . LEU D 177 ? 0.8802 0.7576 0.6560 0.1393 0.1060 -0.0183 180 LEU D CA 5938 C C . LEU D 177 ? 0.8775 0.7610 0.6790 0.1118 0.1212 -0.0311 180 LEU D C 5939 O O . LEU D 177 ? 0.8241 0.7507 0.6869 0.0883 0.1012 -0.0489 180 LEU D O 5940 C CB . LEU D 177 ? 0.9108 0.7319 0.6650 0.1245 0.1243 -0.0088 180 LEU D CB 5941 C CG . LEU D 177 ? 0.8843 0.7059 0.6845 0.0783 0.1213 -0.0232 180 LEU D CG 5942 C CD1 . LEU D 177 ? 0.9527 0.6993 0.7059 0.0651 0.1553 -0.0137 180 LEU D CD1 5943 C CD2 . LEU D 177 ? 0.8212 0.6942 0.6742 0.0737 0.0800 -0.0328 180 LEU D CD2 5944 N N . LYS D 178 ? 0.9421 0.7824 0.6930 0.1183 0.1584 -0.0212 181 LYS D N 5945 C CA . LYS D 178 ? 0.9500 0.7959 0.7204 0.0914 0.1801 -0.0335 181 LYS D CA 5946 C C . LYS D 178 ? 0.9566 0.7817 0.7501 0.0444 0.2002 -0.0432 181 LYS D C 5947 O O . LYS D 178 ? 1.0174 0.7749 0.7633 0.0350 0.2310 -0.0323 181 LYS D O 5948 C CB . LYS D 178 ? 1.0280 0.8297 0.7293 0.1128 0.2177 -0.0191 181 LYS D CB 5949 C CG . LYS D 178 ? 1.0214 0.8620 0.7059 0.1545 0.1976 -0.0167 181 LYS D CG 5950 C CD . LYS D 178 ? 1.1008 0.8998 0.7162 0.1740 0.2365 -0.0032 181 LYS D CD 5951 N N . GLU D 179 ? 0.9009 0.7858 0.7651 0.0165 0.1835 -0.0651 182 GLU D N 5952 C CA . GLU D 179 ? 0.9010 0.7918 0.7975 -0.0299 0.1974 -0.0806 182 GLU D CA 5953 C C . GLU D 179 ? 0.9766 0.8220 0.8370 -0.0582 0.2516 -0.0831 182 GLU D C 5954 O O . GLU D 179 ? 1.0098 0.8292 0.8666 -0.0985 0.2766 -0.0926 182 GLU D O 5955 C CB . GLU D 179 ? 0.8306 0.8073 0.8085 -0.0428 0.1657 -0.1022 182 GLU D CB 5956 C CG . GLU D 179 ? 0.7746 0.7811 0.7835 -0.0253 0.1192 -0.1007 182 GLU D CG 5957 C CD . GLU D 179 ? 0.7258 0.8057 0.8036 -0.0294 0.0910 -0.1179 182 GLU D CD 5958 O OE1 . GLU D 179 ? 0.7301 0.8483 0.8351 -0.0342 0.1017 -0.1304 182 GLU D OE1 5959 O OE2 . GLU D 179 ? 0.6858 0.7832 0.7871 -0.0247 0.0598 -0.1178 182 GLU D OE2 5960 N N . GLN D 180 ? 1.0088 0.8430 0.8395 -0.0394 0.2718 -0.0765 183 GLN D N 5961 C CA . GLN D 180 ? 1.0976 0.8690 0.8736 -0.0589 0.3298 -0.0726 183 GLN D CA 5962 C C . GLN D 180 ? 1.1558 0.8677 0.8492 -0.0101 0.3460 -0.0447 183 GLN D C 5963 O O . GLN D 180 ? 1.1503 0.8916 0.8434 0.0108 0.3435 -0.0449 183 GLN D O 5964 C CB . GLN D 180 ? 1.0869 0.9177 0.9151 -0.0922 0.3455 -0.0972 183 GLN D CB 5965 C CG . GLN D 180 ? 1.0698 0.9482 0.9600 -0.1471 0.3478 -0.1252 183 GLN D CG 5966 C CD . GLN D 180 ? 1.0541 1.0200 1.0108 -0.1709 0.3527 -0.1517 183 GLN D CD 5967 O OE1 . GLN D 180 ? 0.9987 1.0329 1.0020 -0.1424 0.3184 -0.1560 183 GLN D OE1 5968 N NE2 . GLN D 180 ? 1.1102 1.0751 1.0711 -0.2243 0.3981 -0.1715 183 GLN D NE2 5969 N N . PRO D 181 ? 1.2161 0.8464 0.8363 0.0116 0.3625 -0.0209 184 PRO D N 5970 C CA . PRO D 181 ? 1.2748 0.8558 0.8116 0.0690 0.3719 0.0084 184 PRO D CA 5971 C C . PRO D 181 ? 1.3639 0.8922 0.8355 0.0746 0.4221 0.0190 184 PRO D C 5972 O O . PRO D 181 ? 1.4025 0.9167 0.8152 0.1264 0.4219 0.0398 184 PRO D O 5973 C CB . PRO D 181 ? 1.3332 0.8325 0.8091 0.0828 0.3881 0.0287 184 PRO D CB 5974 C CG . PRO D 181 ? 1.3415 0.8168 0.8464 0.0206 0.4104 0.0093 184 PRO D CG 5975 C CD . PRO D 181 ? 1.2351 0.8195 0.8468 -0.0139 0.3719 -0.0216 184 PRO D CD 5976 N N . ALA D 182 ? 1.3978 0.9025 0.8792 0.0210 0.4652 0.0034 185 ALA D N 5977 C CA . ALA D 182 ? 1.4878 0.9379 0.9080 0.0174 0.5201 0.0113 185 ALA D CA 5978 C C . ALA D 182 ? 1.4326 0.9687 0.9032 0.0200 0.5031 -0.0047 185 ALA D C 5979 O O . ALA D 182 ? 1.5044 1.0055 0.9256 0.0222 0.5447 0.0018 185 ALA D O 5980 C CB . ALA D 182 ? 1.5645 0.9478 0.9683 -0.0470 0.5813 -0.0013 185 ALA D CB 5981 N N . LEU D 183 ? 1.3121 0.9528 0.8745 0.0211 0.4456 -0.0249 186 LEU D N 5982 C CA . LEU D 183 ? 1.2579 0.9793 0.8714 0.0253 0.4278 -0.0425 186 LEU D CA 5983 C C . LEU D 183 ? 1.2195 0.9771 0.8212 0.0814 0.3847 -0.0336 186 LEU D C 5984 O O . LEU D 183 ? 1.1771 0.9488 0.7862 0.1052 0.3450 -0.0274 186 LEU D O 5985 C CB . LEU D 183 ? 1.1670 0.9792 0.8897 -0.0142 0.4010 -0.0748 186 LEU D CB 5986 C CG . LEU D 183 ? 1.1923 1.0120 0.9481 -0.0752 0.4417 -0.0963 186 LEU D CG 5987 C CD1 . LEU D 183 ? 1.0992 1.0164 0.9588 -0.1007 0.4028 -0.1240 186 LEU D CD1 5988 C CD2 . LEU D 183 ? 1.2458 1.0682 0.9867 -0.0871 0.4858 -0.1035 186 LEU D CD2 5989 N N . ASN D 184 ? 1.2362 1.0125 0.8203 0.0986 0.3947 -0.0362 187 ASN D N 5990 C CA . ASN D 184 ? 1.2089 1.0244 0.7783 0.1464 0.3583 -0.0339 187 ASN D CA 5991 C C . ASN D 184 ? 1.0993 1.0002 0.7565 0.1439 0.3035 -0.0584 187 ASN D C 5992 O O . ASN D 184 ? 1.0707 0.9984 0.7226 0.1750 0.2660 -0.0576 187 ASN D O 5993 C CB . ASN D 184 ? 1.2685 1.0784 0.7912 0.1624 0.3873 -0.0325 187 ASN D CB 5994 C CG . ASN D 184 ? 1.3898 1.1060 0.7996 0.1850 0.4363 -0.0008 187 ASN D CG 5995 O OD1 . ASN D 184 ? 1.4286 1.0915 0.7838 0.2087 0.4377 0.0232 187 ASN D OD1 5996 N ND2 . ASN D 184 ? 1.4557 1.1479 0.8253 0.1809 0.4795 0.0005 187 ASN D ND2 5997 N N . ASP D 185 ? 1.0437 0.9877 0.7787 0.1076 0.3013 -0.0809 188 ASP D N 5998 C CA . ASP D 185 ? 0.9523 0.9643 0.7645 0.1069 0.2551 -0.1018 188 ASP D CA 5999 C C . ASP D 185 ? 0.8984 0.9245 0.7684 0.0777 0.2389 -0.1075 188 ASP D C 6000 O O . ASP D 185 ? 0.8506 0.9295 0.7904 0.0609 0.2251 -0.1267 188 ASP D O 6001 C CB . ASP D 185 ? 0.9376 1.0002 0.7900 0.1049 0.2585 -0.1239 188 ASP D CB 6002 C CG . ASP D 185 ? 0.9507 1.0280 0.8377 0.0688 0.2947 -0.1348 188 ASP D CG 6003 O OD1 . ASP D 185 ? 0.9969 1.0299 0.8545 0.0440 0.3296 -0.1243 188 ASP D OD1 6004 O OD2 . ASP D 185 ? 0.9177 1.0525 0.8608 0.0650 0.2901 -0.1557 188 ASP D OD2 6005 N N . SER D 186 ? 0.9102 0.8893 0.7464 0.0760 0.2409 -0.0902 189 SER D N 6006 C CA . SER D 186 ? 0.8643 0.8508 0.7437 0.0502 0.2254 -0.0944 189 SER D CA 6007 C C . SER D 186 ? 0.7870 0.8205 0.7164 0.0631 0.1752 -0.1032 189 SER D C 6008 O O . SER D 186 ? 0.7758 0.8152 0.6871 0.0927 0.1529 -0.1002 189 SER D O 6009 C CB . SER D 186 ? 0.9118 0.8275 0.7324 0.0502 0.2428 -0.0731 189 SER D CB 6010 O OG . SER D 186 ? 0.8674 0.7917 0.7257 0.0296 0.2226 -0.0777 189 SER D OG 6011 N N . ARG D 187 ? 0.7386 0.8056 0.7272 0.0398 0.1594 -0.1151 190 ARG D N 6012 C CA . ARG D 187 ? 0.6786 0.7740 0.7053 0.0497 0.1170 -0.1197 190 ARG D CA 6013 C C . ARG D 187 ? 0.6768 0.7343 0.6716 0.0549 0.1054 -0.1039 190 ARG D C 6014 O O . ARG D 187 ? 0.7183 0.7294 0.6712 0.0465 0.1302 -0.0911 190 ARG D O 6015 C CB . ARG D 187 ? 0.6426 0.7867 0.7351 0.0295 0.1046 -0.1347 190 ARG D CB 6016 C CG . ARG D 187 ? 0.6451 0.8389 0.7763 0.0287 0.1152 -0.1516 190 ARG D CG 6017 C CD . ARG D 187 ? 0.6107 0.8593 0.8034 0.0322 0.0875 -0.1636 190 ARG D CD 6018 N NE . ARG D 187 ? 0.6198 0.9295 0.8587 0.0168 0.1029 -0.1802 190 ARG D NE 6019 C CZ . ARG D 187 ? 0.5961 0.9663 0.8888 0.0175 0.0837 -0.1908 190 ARG D CZ 6020 N NH1 . ARG D 187 ? 0.5668 0.9326 0.8681 0.0328 0.0504 -0.1841 190 ARG D NH1 6021 N NH2 . ARG D 187 ? 0.6040 1.0434 0.9406 0.0042 0.0990 -0.2083 190 ARG D NH2 6022 N N . TYR D 188 ? 0.6335 0.7067 0.6451 0.0685 0.0712 -0.1055 191 TYR D N 6023 C CA . TYR D 188 ? 0.6285 0.6760 0.6116 0.0777 0.0591 -0.0924 191 TYR D CA 6024 C C . TYR D 188 ? 0.5913 0.6455 0.6085 0.0615 0.0382 -0.0940 191 TYR D C 6025 O O . TYR D 188 ? 0.5622 0.6465 0.6256 0.0495 0.0262 -0.1053 191 TYR D O 6026 C CB . TYR D 188 ? 0.6223 0.6845 0.5879 0.1049 0.0403 -0.0941 191 TYR D CB 6027 C CG . TYR D 188 ? 0.6615 0.7160 0.5787 0.1268 0.0594 -0.0891 191 TYR D CG 6028 C CD1 . TYR D 188 ? 0.7055 0.7283 0.5631 0.1474 0.0739 -0.0700 191 TYR D CD1 6029 C CD2 . TYR D 188 ? 0.6635 0.7403 0.5891 0.1313 0.0641 -0.1025 191 TYR D CD2 6030 C CE1 . TYR D 188 ? 0.7565 0.7712 0.5613 0.1733 0.0915 -0.0626 191 TYR D CE1 6031 C CE2 . TYR D 188 ? 0.7115 0.7814 0.5871 0.1527 0.0819 -0.0976 191 TYR D CE2 6032 C CZ . TYR D 188 ? 0.7549 0.7944 0.5690 0.1743 0.0949 -0.0769 191 TYR D CZ 6033 O OH . TYR D 188 ? 0.8070 0.8389 0.5641 0.2009 0.1124 -0.0696 191 TYR D OH 6034 N N . ALA D 189 ? 0.5967 0.6236 0.5868 0.0651 0.0349 -0.0817 192 ALA D N 6035 C CA . ALA D 189 ? 0.5670 0.5959 0.5799 0.0524 0.0155 -0.0817 192 ALA D CA 6036 C C . ALA D 189 ? 0.5598 0.5827 0.5519 0.0703 0.0001 -0.0739 192 ALA D C 6037 O O . ALA D 189 ? 0.5901 0.5940 0.5385 0.0896 0.0124 -0.0627 192 ALA D O 6038 C CB . ALA D 189 ? 0.5888 0.5908 0.5936 0.0273 0.0347 -0.0783 192 ALA D CB 6039 N N . LEU D 190 ? 0.5252 0.5665 0.5465 0.0658 -0.0249 -0.0799 193 LEU D N 6040 C CA . LEU D 190 ? 0.5161 0.5614 0.5262 0.0762 -0.0390 -0.0768 193 LEU D CA 6041 C C . LEU D 190 ? 0.4984 0.5342 0.5238 0.0605 -0.0505 -0.0741 193 LEU D C 6042 O O . LEU D 190 ? 0.4827 0.5241 0.5375 0.0467 -0.0600 -0.0796 193 LEU D O 6043 C CB . LEU D 190 ? 0.5007 0.5769 0.5250 0.0840 -0.0549 -0.0909 193 LEU D CB 6044 C CG . LEU D 190 ? 0.5012 0.5983 0.5144 0.0931 -0.0662 -0.0938 193 LEU D CG 6045 C CD1 . LEU D 190 ? 0.5220 0.6333 0.4962 0.1199 -0.0567 -0.0872 193 LEU D CD1 6046 C CD2 . LEU D 190 ? 0.4866 0.6063 0.5229 0.0841 -0.0809 -0.1138 193 LEU D CD2 6047 N N . SER D 191 ? 0.5056 0.5294 0.5080 0.0665 -0.0492 -0.0651 194 SER D N 6048 C CA . SER D 191 ? 0.4937 0.5079 0.5051 0.0527 -0.0589 -0.0625 194 SER D CA 6049 C C . SER D 191 ? 0.4826 0.5161 0.4943 0.0601 -0.0715 -0.0648 194 SER D C 6050 O O . SER D 191 ? 0.4873 0.5437 0.4851 0.0785 -0.0703 -0.0664 194 SER D O 6051 C CB . SER D 191 ? 0.5194 0.4970 0.5043 0.0458 -0.0413 -0.0523 194 SER D CB 6052 O OG . SER D 191 ? 0.5471 0.5100 0.4953 0.0664 -0.0304 -0.0417 194 SER D OG 6053 N N . SER D 192 ? 0.4701 0.4993 0.4968 0.0452 -0.0828 -0.0661 195 SER D N 6054 C CA . SER D 192 ? 0.4641 0.5109 0.4941 0.0442 -0.0912 -0.0707 195 SER D CA 6055 C C . SER D 192 ? 0.4662 0.4917 0.4945 0.0305 -0.0940 -0.0642 195 SER D C 6056 O O . SER D 192 ? 0.4670 0.4701 0.4981 0.0199 -0.0955 -0.0597 195 SER D O 6057 C CB . SER D 192 ? 0.4562 0.5201 0.5075 0.0363 -0.1010 -0.0862 195 SER D CB 6058 O OG . SER D 192 ? 0.4497 0.5242 0.5059 0.0247 -0.1054 -0.0934 195 SER D OG 6059 N N . ARG D 193 ? 0.4678 0.5078 0.4920 0.0308 -0.0947 -0.0656 196 ARG D N 6060 C CA . ARG D 193 ? 0.4744 0.4949 0.4913 0.0198 -0.0944 -0.0591 196 ARG D CA 6061 C C . ARG D 193 ? 0.4701 0.5035 0.4989 0.0056 -0.0994 -0.0676 196 ARG D C 6062 O O . ARG D 193 ? 0.4682 0.5395 0.5066 0.0067 -0.0994 -0.0801 196 ARG D O 6063 C CB . ARG D 193 ? 0.4894 0.5063 0.4807 0.0353 -0.0819 -0.0499 196 ARG D CB 6064 C CG . ARG D 193 ? 0.5203 0.4975 0.4901 0.0363 -0.0704 -0.0406 196 ARG D CG 6065 C CD . ARG D 193 ? 0.5676 0.5391 0.5084 0.0626 -0.0534 -0.0333 196 ARG D CD 6066 N NE . ARG D 193 ? 0.5832 0.5669 0.5286 0.0715 -0.0529 -0.0361 196 ARG D NE 6067 C CZ . ARG D 193 ? 0.6221 0.5982 0.5376 0.0972 -0.0374 -0.0283 196 ARG D CZ 6068 N NH1 . ARG D 193 ? 0.6251 0.6125 0.5440 0.1032 -0.0369 -0.0315 196 ARG D NH1 6069 N NH2 . ARG D 193 ? 0.6619 0.6146 0.5388 0.1201 -0.0203 -0.0161 196 ARG D NH2 6070 N N . LEU D 194 ? 0.4749 0.4780 0.5001 -0.0092 -0.1022 -0.0624 197 LEU D N 6071 C CA . LEU D 194 ? 0.4829 0.4842 0.5091 -0.0254 -0.1003 -0.0673 197 LEU D CA 6072 C C . LEU D 194 ? 0.4942 0.4754 0.5016 -0.0296 -0.0963 -0.0564 197 LEU D C 6073 O O . LEU D 194 ? 0.5032 0.4530 0.4985 -0.0317 -0.1010 -0.0466 197 LEU D O 6074 C CB . LEU D 194 ? 0.4985 0.4698 0.5284 -0.0375 -0.1038 -0.0705 197 LEU D CB 6075 C CG . LEU D 194 ? 0.5245 0.4700 0.5435 -0.0572 -0.0963 -0.0717 197 LEU D CG 6076 C CD1 . LEU D 194 ? 0.5172 0.4966 0.5484 -0.0745 -0.0858 -0.0915 197 LEU D CD1 6077 C CD2 . LEU D 194 ? 0.5519 0.4469 0.5593 -0.0584 -0.0978 -0.0658 197 LEU D CD2 6078 N N . ARG D 195 ? 0.4952 0.5015 0.5006 -0.0300 -0.0879 -0.0600 198 ARG D N 6079 C CA . ARG D 195 ? 0.5085 0.4968 0.4940 -0.0331 -0.0812 -0.0513 198 ARG D CA 6080 C C . ARG D 195 ? 0.5256 0.5106 0.5107 -0.0544 -0.0749 -0.0560 198 ARG D C 6081 O O . ARG D 195 ? 0.5221 0.5457 0.5246 -0.0634 -0.0686 -0.0703 198 ARG D O 6082 C CB . ARG D 195 ? 0.5076 0.5207 0.4842 -0.0121 -0.0716 -0.0493 198 ARG D CB 6083 C CG . ARG D 195 ? 0.5255 0.5058 0.4740 -0.0111 -0.0630 -0.0393 198 ARG D CG 6084 C CD . ARG D 195 ? 0.5346 0.5254 0.4662 0.0163 -0.0496 -0.0353 198 ARG D CD 6085 N NE . ARG D 195 ? 0.5705 0.5114 0.4680 0.0164 -0.0390 -0.0270 198 ARG D NE 6086 C CZ . ARG D 195 ? 0.5989 0.5243 0.4682 0.0400 -0.0215 -0.0214 198 ARG D CZ 6087 N NH1 . ARG D 195 ? 0.6276 0.5002 0.4628 0.0335 -0.0095 -0.0177 198 ARG D NH1 6088 N NH2 . ARG D 195 ? 0.6036 0.5652 0.4745 0.0718 -0.0148 -0.0201 198 ARG D NH2 6089 N N . VAL D 196 ? 0.5474 0.4882 0.5103 -0.0637 -0.0752 -0.0453 199 VAL D N 6090 C CA . VAL D 196 ? 0.5747 0.4972 0.5259 -0.0838 -0.0650 -0.0457 199 VAL D CA 6091 C C . VAL D 196 ? 0.5907 0.4995 0.5165 -0.0835 -0.0581 -0.0367 199 VAL D C 6092 O O . VAL D 196 ? 0.5831 0.4897 0.4987 -0.0693 -0.0615 -0.0312 199 VAL D O 6093 C CB . VAL D 196 ? 0.6049 0.4766 0.5413 -0.0920 -0.0691 -0.0388 199 VAL D CB 6094 C CG1 . VAL D 196 ? 0.6009 0.4792 0.5582 -0.0963 -0.0693 -0.0511 199 VAL D CG1 6095 C CG2 . VAL D 196 ? 0.6064 0.4523 0.5261 -0.0768 -0.0847 -0.0244 199 VAL D CG2 6096 N N . SER D 197 ? 0.6201 0.5148 0.5320 -0.1012 -0.0450 -0.0367 200 SER D N 6097 C CA . SER D 197 ? 0.6443 0.5185 0.5261 -0.1023 -0.0378 -0.0278 200 SER D CA 6098 C C . SER D 197 ? 0.6705 0.4956 0.5205 -0.0985 -0.0509 -0.0132 200 SER D C 6099 O O . SER D 197 ? 0.6813 0.4828 0.5289 -0.0979 -0.0604 -0.0082 200 SER D O 6100 C CB . SER D 197 ? 0.6728 0.5472 0.5473 -0.1242 -0.0170 -0.0325 200 SER D CB 6101 O OG . SER D 197 ? 0.7132 0.5354 0.5649 -0.1400 -0.0130 -0.0256 200 SER D OG 6102 N N . ALA D 198 ? 0.6860 0.4995 0.5102 -0.0943 -0.0509 -0.0079 201 ALA D N 6103 C CA . ALA D 198 ? 0.7123 0.4955 0.5063 -0.0914 -0.0651 0.0016 201 ALA D CA 6104 C C . ALA D 198 ? 0.7575 0.5039 0.5240 -0.0956 -0.0663 0.0134 201 ALA D C 6105 O O . ALA D 198 ? 0.7692 0.5032 0.5267 -0.0850 -0.0832 0.0210 201 ALA D O 6106 C CB . ALA D 198 ? 0.7291 0.5048 0.4945 -0.0924 -0.0596 0.0007 201 ALA D CB 6107 N N . THR D 199 ? 0.7896 0.5191 0.5409 -0.1093 -0.0462 0.0151 202 THR D N 6108 C CA . THR D 199 ? 0.8511 0.5302 0.5645 -0.1139 -0.0389 0.0285 202 THR D CA 6109 C C . THR D 199 ? 0.8595 0.5187 0.5842 -0.1099 -0.0420 0.0306 202 THR D C 6110 O O . THR D 199 ? 0.9095 0.5236 0.5987 -0.0974 -0.0465 0.0462 202 THR D O 6111 C CB . THR D 199 ? 0.8843 0.5490 0.5818 -0.1360 -0.0095 0.0264 202 THR D CB 6112 O OG1 . THR D 199 ? 0.8595 0.5623 0.6018 -0.1514 0.0042 0.0084 202 THR D OG1 6113 C CG2 . THR D 199 ? 0.8889 0.5657 0.5673 -0.1369 -0.0038 0.0258 202 THR D CG2 6114 N N . PHE D 200 ? 0.8186 0.5110 0.5885 -0.1172 -0.0386 0.0148 203 PHE D N 6115 C CA . PHE D 200 ? 0.8243 0.5007 0.6076 -0.1145 -0.0404 0.0123 203 PHE D CA 6116 C C . PHE D 200 ? 0.8137 0.4898 0.5972 -0.0870 -0.0662 0.0217 203 PHE D C 6117 O O . PHE D 200 ? 0.8557 0.4917 0.6195 -0.0741 -0.0679 0.0318 203 PHE D O 6118 C CB . PHE D 200 ? 0.7796 0.5053 0.6116 -0.1273 -0.0346 -0.0097 203 PHE D CB 6119 C CG . PHE D 200 ? 0.8001 0.5026 0.6400 -0.1349 -0.0272 -0.0178 203 PHE D CG 6120 C CD1 . PHE D 200 ? 0.7716 0.4862 0.6331 -0.1169 -0.0442 -0.0201 203 PHE D CD1 6121 C CD2 . PHE D 200 ? 0.8527 0.5177 0.6760 -0.1629 0.0005 -0.0252 203 PHE D CD2 6122 C CE1 . PHE D 200 ? 0.7961 0.4846 0.6611 -0.1234 -0.0352 -0.0293 203 PHE D CE1 6123 C CE2 . PHE D 200 ? 0.8832 0.5171 0.7081 -0.1734 0.0117 -0.0359 203 PHE D CE2 6124 C CZ . PHE D 200 ? 0.8539 0.4989 0.6990 -0.1520 -0.0069 -0.0377 203 PHE D CZ 6125 N N . TRP D 201 ? 0.7668 0.4867 0.5704 -0.0779 -0.0832 0.0176 204 TRP D N 6126 C CA . TRP D 201 ? 0.7526 0.4865 0.5612 -0.0573 -0.1063 0.0221 204 TRP D CA 6127 C C . TRP D 201 ? 0.8018 0.5115 0.5668 -0.0428 -0.1171 0.0384 204 TRP D C 6128 O O . TRP D 201 ? 0.8176 0.5276 0.5784 -0.0208 -0.1324 0.0457 204 TRP D O 6129 C CB . TRP D 201 ? 0.7025 0.4821 0.5373 -0.0583 -0.1149 0.0111 204 TRP D CB 6130 C CG . TRP D 201 ? 0.6948 0.4949 0.5315 -0.0456 -0.1356 0.0121 204 TRP D CG 6131 C CD1 . TRP D 201 ? 0.7078 0.5199 0.5247 -0.0476 -0.1451 0.0116 204 TRP D CD1 6132 C CD2 . TRP D 201 ? 0.6824 0.5008 0.5429 -0.0308 -0.1484 0.0105 204 TRP D CD2 6133 N NE1 . TRP D 201 ? 0.7013 0.5462 0.5320 -0.0374 -0.1636 0.0078 204 TRP D NE1 6134 C CE2 . TRP D 201 ? 0.6841 0.5338 0.5425 -0.0250 -0.1658 0.0084 204 TRP D CE2 6135 C CE3 . TRP D 201 ? 0.6704 0.4853 0.5539 -0.0230 -0.1457 0.0083 204 TRP D CE3 6136 C CZ2 . TRP D 201 ? 0.6719 0.5558 0.5544 -0.0103 -0.1805 0.0047 204 TRP D CZ2 6137 C CZ3 . TRP D 201 ? 0.6602 0.4995 0.5634 -0.0061 -0.1595 0.0066 204 TRP D CZ3 6138 C CH2 . TRP D 201 ? 0.6598 0.5363 0.5643 0.0008 -0.1767 0.0053 204 TRP D CH2 6139 N N . GLN D 202 ? 0.8298 0.5234 0.5611 -0.0521 -0.1093 0.0437 205 GLN D N 6140 C CA . GLN D 202 ? 0.8806 0.5572 0.5638 -0.0376 -0.1204 0.0584 205 GLN D CA 6141 C C . GLN D 202 ? 0.9506 0.5687 0.5907 -0.0204 -0.1130 0.0786 205 GLN D C 6142 O O . GLN D 202 ? 1.0066 0.6066 0.5982 -0.0014 -0.1215 0.0947 205 GLN D O 6143 C CB . GLN D 202 ? 0.8919 0.5670 0.5481 -0.0532 -0.1120 0.0565 205 GLN D CB 6144 C CG . GLN D 202 ? 0.8518 0.5730 0.5296 -0.0616 -0.1222 0.0399 205 GLN D CG 6145 C CD . GLN D 202 ? 0.8623 0.5765 0.5217 -0.0788 -0.1052 0.0338 205 GLN D CD 6146 O OE1 . GLN D 202 ? 0.8870 0.5745 0.5310 -0.0873 -0.0845 0.0391 205 GLN D OE1 6147 N NE2 . GLN D 202 ? 0.8430 0.5800 0.5029 -0.0855 -0.1107 0.0208 205 GLN D NE2 6148 N N . ASN D 203 ? 0.9574 0.5433 0.6102 -0.0263 -0.0955 0.0771 206 ASN D N 6149 C CA . ASN D 203 ? 1.0359 0.5494 0.6436 -0.0119 -0.0806 0.0949 206 ASN D CA 6150 C C . ASN D 203 ? 1.0426 0.5595 0.6594 0.0220 -0.0975 0.1006 206 ASN D C 6151 O O . ASN D 203 ? 1.0006 0.5356 0.6616 0.0163 -0.0968 0.0863 206 ASN D O 6152 C CB . ASN D 203 ? 1.0517 0.5247 0.6647 -0.0446 -0.0463 0.0849 206 ASN D CB 6153 C CG . ASN D 203 ? 1.1507 0.5277 0.7037 -0.0387 -0.0194 0.1022 206 ASN D CG 6154 O OD1 . ASN D 203 ? 1.2129 0.5501 0.7200 -0.0011 -0.0277 0.1248 206 ASN D OD1 6155 N ND2 . ASN D 203 ? 1.1731 0.5132 0.7240 -0.0758 0.0151 0.0905 206 ASN D ND2 6156 N N . PRO D 204 ? 1.0989 0.6032 0.6722 0.0607 -0.1129 0.1214 207 PRO D N 6157 C CA . PRO D 204 ? 1.1118 0.6305 0.6927 0.1009 -0.1307 0.1280 207 PRO D CA 6158 C C . PRO D 204 ? 1.1650 0.6094 0.7315 0.1104 -0.1063 0.1335 207 PRO D C 6159 O O . PRO D 204 ? 1.1598 0.6201 0.7458 0.1387 -0.1170 0.1330 207 PRO D O 6160 C CB . PRO D 204 ? 1.1760 0.6953 0.7007 0.1420 -0.1486 0.1511 207 PRO D CB 6161 C CG . PRO D 204 ? 1.2298 0.6904 0.6980 0.1248 -0.1276 0.1632 207 PRO D CG 6162 C CD . PRO D 204 ? 1.1574 0.6409 0.6701 0.0721 -0.1151 0.1396 207 PRO D CD 6163 N N . ARG D 205 ? 1.2212 0.5856 0.7531 0.0845 -0.0711 0.1364 208 ARG D N 6164 C CA . ARG D 205 ? 1.2836 0.5672 0.7974 0.0816 -0.0404 0.1358 208 ARG D CA 6165 C C . ARG D 205 ? 1.2100 0.5347 0.7927 0.0493 -0.0373 0.1050 208 ARG D C 6166 O O . ARG D 205 ? 1.2448 0.5209 0.8238 0.0495 -0.0185 0.0987 208 ARG D O 6167 C CB . ARG D 205 ? 1.3747 0.5595 0.8263 0.0567 0.0008 0.1452 208 ARG D CB 6168 C CG . ARG D 205 ? 1.4831 0.5984 0.8473 0.0966 0.0060 0.1807 208 ARG D CG 6169 N N . ASN D 206 ? 1.1168 0.5270 0.7560 0.0239 -0.0542 0.0862 209 ASN D N 6170 C CA . ASN D 206 ? 1.0480 0.5066 0.7486 -0.0023 -0.0537 0.0587 209 ASN D CA 6171 C C . ASN D 206 ? 1.0023 0.5131 0.7434 0.0238 -0.0781 0.0531 209 ASN D C 6172 O O . ASN D 206 ? 0.9635 0.5311 0.7207 0.0436 -0.1049 0.0582 209 ASN D O 6173 C CB . ASN D 206 ? 0.9797 0.4985 0.7147 -0.0355 -0.0560 0.0433 209 ASN D CB 6174 C CG . ASN D 206 ? 1.0169 0.4979 0.7316 -0.0724 -0.0244 0.0367 209 ASN D CG 6175 O OD1 . ASN D 206 ? 1.0783 0.4978 0.7710 -0.0876 0.0028 0.0322 209 ASN D OD1 6176 N ND2 . ASN D 206 ? 0.9767 0.4941 0.6983 -0.0891 -0.0249 0.0339 209 ASN D ND2 6177 N N . HIS D 207 ? 1.0118 0.5041 0.7687 0.0200 -0.0661 0.0398 210 HIS D N 6178 C CA . HIS D 207 ? 0.9789 0.5120 0.7709 0.0441 -0.0831 0.0335 210 HIS D CA 6179 C C . HIS D 207 ? 0.9038 0.4948 0.7501 0.0166 -0.0846 0.0072 210 HIS D C 6180 O O . HIS D 207 ? 0.9104 0.4846 0.7606 -0.0143 -0.0646 -0.0096 210 HIS D O 6181 C CB . HIS D 207 ? 1.0593 0.5187 0.8175 0.0705 -0.0670 0.0410 210 HIS D CB 6182 C CG . HIS D 207 ? 1.0371 0.5344 0.8305 0.0944 -0.0794 0.0322 210 HIS D CG 6183 N ND1 . HIS D 207 ? 1.0269 0.5772 0.8350 0.1339 -0.1055 0.0431 210 HIS D ND1 6184 C CD2 . HIS D 207 ? 1.0354 0.5293 0.8517 0.0833 -0.0681 0.0117 210 HIS D CD2 6185 C CE1 . HIS D 207 ? 1.0090 0.5853 0.8489 0.1465 -0.1082 0.0309 210 HIS D CE1 6186 N NE2 . HIS D 207 ? 1.0156 0.5550 0.8587 0.1174 -0.0860 0.0126 210 HIS D NE2 6187 N N . PHE D 208 ? 0.8400 0.5013 0.7253 0.0280 -0.1070 0.0030 211 PHE D N 6188 C CA . PHE D 208 ? 0.7761 0.4916 0.7050 0.0097 -0.1092 -0.0173 211 PHE D CA 6189 C C . PHE D 208 ? 0.7628 0.5020 0.7167 0.0305 -0.1168 -0.0237 211 PHE D C 6190 O O . PHE D 208 ? 0.7647 0.5233 0.7222 0.0574 -0.1315 -0.0137 211 PHE D O 6191 C CB . PHE D 208 ? 0.7200 0.4899 0.6669 0.0005 -0.1217 -0.0173 211 PHE D CB 6192 C CG . PHE D 208 ? 0.7285 0.4817 0.6526 -0.0177 -0.1140 -0.0118 211 PHE D CG 6193 C CD1 . PHE D 208 ? 0.7591 0.4908 0.6511 -0.0075 -0.1200 0.0053 211 PHE D CD1 6194 C CD2 . PHE D 208 ? 0.7085 0.4752 0.6429 -0.0430 -0.1009 -0.0250 211 PHE D CD2 6195 C CE1 . PHE D 208 ? 0.7766 0.4915 0.6449 -0.0245 -0.1108 0.0101 211 PHE D CE1 6196 C CE2 . PHE D 208 ? 0.7247 0.4817 0.6405 -0.0590 -0.0917 -0.0211 211 PHE D CE2 6197 C CZ . PHE D 208 ? 0.7583 0.4849 0.6398 -0.0509 -0.0955 -0.0032 211 PHE D CZ 6198 N N . ARG D 209 ? 0.7533 0.4977 0.7247 0.0177 -0.1067 -0.0423 212 ARG D N 6199 C CA . ARG D 209 ? 0.7443 0.5083 0.7370 0.0356 -0.1104 -0.0504 212 ARG D CA 6200 C C . ARG D 209 ? 0.6947 0.5081 0.7175 0.0195 -0.1102 -0.0692 212 ARG D C 6201 O O . ARG D 209 ? 0.6908 0.5066 0.7132 -0.0046 -0.1004 -0.0829 212 ARG D O 6202 C CB . ARG D 209 ? 0.8123 0.5109 0.7800 0.0471 -0.0941 -0.0527 212 ARG D CB 6203 C CG . ARG D 209 ? 0.8150 0.5296 0.8010 0.0711 -0.0963 -0.0599 212 ARG D CG 6204 C CD . ARG D 209 ? 0.9141 0.5516 0.8654 0.0922 -0.0786 -0.0571 212 ARG D CD 6205 N NE . ARG D 209 ? 0.9731 0.5524 0.9017 0.0606 -0.0529 -0.0755 212 ARG D NE 6206 C CZ . ARG D 209 ? 0.9783 0.5623 0.9187 0.0453 -0.0420 -0.1010 212 ARG D CZ 6207 N NH1 . ARG D 209 ? 1.0262 0.5622 0.9451 0.0108 -0.0178 -0.1218 212 ARG D NH1 6208 N NH2 . ARG D 209 ? 0.9355 0.5743 0.9078 0.0615 -0.0537 -0.1081 212 ARG D NH2 6209 N N . CYS D 210 ? 0.6626 0.5196 0.7096 0.0340 -0.1200 -0.0701 213 CYS D N 6210 C CA . CYS D 210 ? 0.6271 0.5254 0.6948 0.0266 -0.1183 -0.0844 213 CYS D CA 6211 C C . CYS D 210 ? 0.6396 0.5324 0.7141 0.0392 -0.1125 -0.0960 213 CYS D C 6212 O O . CYS D 210 ? 0.6461 0.5435 0.7290 0.0614 -0.1168 -0.0902 213 CYS D O 6213 C CB . CYS D 210 ? 0.5867 0.5284 0.6696 0.0301 -0.1268 -0.0778 213 CYS D CB 6214 S SG . CYS D 210 ? 0.5809 0.5618 0.6765 0.0283 -0.1207 -0.0898 213 CYS D SG 6215 N N . GLN D 211 ? 0.6455 0.5345 0.7169 0.0251 -0.1025 -0.1147 214 GLN D N 6216 C CA . GLN D 211 ? 0.6684 0.5447 0.7402 0.0336 -0.0939 -0.1295 214 GLN D CA 6217 C C . GLN D 211 ? 0.6324 0.5599 0.7196 0.0331 -0.0950 -0.1425 214 GLN D C 6218 O O . GLN D 211 ? 0.6165 0.5745 0.7034 0.0177 -0.0955 -0.1517 214 GLN D O 6219 C CB . GLN D 211 ? 0.7227 0.5473 0.7717 0.0147 -0.0775 -0.1458 214 GLN D CB 6220 C CG . GLN D 211 ? 0.7754 0.5556 0.8121 0.0291 -0.0643 -0.1557 214 GLN D CG 6221 C CD . GLN D 211 ? 0.8400 0.5655 0.8503 0.0019 -0.0423 -0.1785 214 GLN D CD 6222 O OE1 . GLN D 211 ? 0.9049 0.5570 0.8849 0.0001 -0.0276 -0.1716 214 GLN D OE1 6223 N NE2 . GLN D 211 ? 0.8272 0.5875 0.8451 -0.0206 -0.0381 -0.2072 214 GLN D NE2 6224 N N . VAL D 212 ? 0.6239 0.5639 0.7223 0.0528 -0.0945 -0.1426 215 VAL D N 6225 C CA . VAL D 212 ? 0.5954 0.5765 0.7014 0.0552 -0.0923 -0.1531 215 VAL D CA 6226 C C . VAL D 212 ? 0.6248 0.5915 0.7269 0.0634 -0.0818 -0.1712 215 VAL D C 6227 O O . VAL D 212 ? 0.6396 0.5941 0.7491 0.0838 -0.0785 -0.1671 215 VAL D O 6228 C CB . VAL D 212 ? 0.5620 0.5778 0.6831 0.0661 -0.0962 -0.1388 215 VAL D CB 6229 C CG1 . VAL D 212 ? 0.5489 0.5954 0.6688 0.0706 -0.0888 -0.1476 215 VAL D CG1 6230 C CG2 . VAL D 212 ? 0.5370 0.5607 0.6552 0.0557 -0.1029 -0.1244 215 VAL D CG2 6231 N N . GLN D 213 ? 0.6332 0.6066 0.7235 0.0481 -0.0763 -0.1931 216 GLN D N 6232 C CA . GLN D 213 ? 0.6615 0.6249 0.7436 0.0517 -0.0650 -0.2149 216 GLN D CA 6233 C C . GLN D 213 ? 0.6347 0.6451 0.7236 0.0662 -0.0656 -0.2145 216 GLN D C 6234 O O . GLN D 213 ? 0.6090 0.6607 0.6942 0.0624 -0.0711 -0.2130 216 GLN D O 6235 C CB . GLN D 213 ? 0.6896 0.6492 0.7551 0.0237 -0.0588 -0.2435 216 GLN D CB 6236 C CG . GLN D 213 ? 0.7245 0.6793 0.7769 0.0219 -0.0466 -0.2723 216 GLN D CG 6237 C CD . GLN D 213 ? 0.7813 0.6609 0.8198 0.0295 -0.0292 -0.2782 216 GLN D CD 6238 O OE1 . GLN D 213 ? 0.7922 0.6640 0.8330 0.0550 -0.0231 -0.2760 216 GLN D OE1 6239 N NE2 . GLN D 213 ? 0.8241 0.6451 0.8449 0.0090 -0.0179 -0.2854 216 GLN D NE2 6240 N N . PHE D 214 ? 0.6472 0.6494 0.7430 0.0858 -0.0577 -0.2147 217 PHE D N 6241 C CA . PHE D 214 ? 0.6319 0.6720 0.7314 0.0981 -0.0527 -0.2155 217 PHE D CA 6242 C C . PHE D 214 ? 0.6721 0.7041 0.7561 0.1008 -0.0407 -0.2412 217 PHE D C 6243 O O . PHE D 214 ? 0.7128 0.7006 0.7905 0.1027 -0.0323 -0.2535 217 PHE D O 6244 C CB . PHE D 214 ? 0.6153 0.6664 0.7394 0.1161 -0.0511 -0.1983 217 PHE D CB 6245 C CG . PHE D 214 ? 0.6053 0.6885 0.7336 0.1267 -0.0393 -0.2016 217 PHE D CG 6246 C CD1 . PHE D 214 ? 0.5805 0.6909 0.6965 0.1208 -0.0361 -0.1957 217 PHE D CD1 6247 C CD2 . PHE D 214 ? 0.6201 0.7030 0.7608 0.1453 -0.0284 -0.2094 217 PHE D CD2 6248 C CE1 . PHE D 214 ? 0.5839 0.7160 0.6972 0.1291 -0.0206 -0.1975 217 PHE D CE1 6249 C CE2 . PHE D 214 ? 0.6179 0.7322 0.7628 0.1529 -0.0145 -0.2133 217 PHE D CE2 6250 C CZ . PHE D 214 ? 0.6010 0.7377 0.7310 0.1427 -0.0098 -0.2073 217 PHE D CZ 6251 N N . TYR D 215 ? 0.6699 0.7390 0.7414 0.1023 -0.0378 -0.2491 218 TYR D N 6252 C CA . TYR D 215 ? 0.7088 0.7773 0.7627 0.1057 -0.0260 -0.2746 218 TYR D CA 6253 C C . TYR D 215 ? 0.7078 0.7972 0.7667 0.1262 -0.0146 -0.2674 218 TYR D C 6254 O O . TYR D 215 ? 0.6850 0.8056 0.7407 0.1302 -0.0147 -0.2520 218 TYR D O 6255 C CB . TYR D 215 ? 0.7173 0.8179 0.7456 0.0903 -0.0316 -0.2955 218 TYR D CB 6256 C CG . TYR D 215 ? 0.7276 0.8140 0.7535 0.0639 -0.0383 -0.3108 218 TYR D CG 6257 C CD1 . TYR D 215 ? 0.6933 0.8016 0.7268 0.0545 -0.0519 -0.2965 218 TYR D CD1 6258 C CD2 . TYR D 215 ? 0.7767 0.8231 0.7903 0.0463 -0.0268 -0.3407 218 TYR D CD2 6259 C CE1 . TYR D 215 ? 0.7083 0.8078 0.7416 0.0271 -0.0550 -0.3119 218 TYR D CE1 6260 C CE2 . TYR D 215 ? 0.7966 0.8260 0.8062 0.0156 -0.0274 -0.3572 218 TYR D CE2 6261 C CZ . TYR D 215 ? 0.7613 0.8216 0.7830 0.0056 -0.0420 -0.3427 218 TYR D CZ 6262 O OH . TYR D 215 ? 0.7885 0.8366 0.8080 -0.0275 -0.0398 -0.3604 218 TYR D OH 6263 N N . GLY D 216 ? 0.7421 0.8095 0.8060 0.1395 -0.0013 -0.2784 219 GLY D N 6264 C CA . GLY D 216 ? 0.7482 0.8385 0.8206 0.1580 0.0130 -0.2754 219 GLY D CA 6265 C C . GLY D 216 ? 0.8012 0.8711 0.8587 0.1684 0.0292 -0.3008 219 GLY D C 6266 O O . GLY D 216 ? 0.8310 0.8937 0.8578 0.1568 0.0310 -0.3246 219 GLY D O 6267 N N . LEU D 217 ? 0.8170 0.8822 0.8964 0.1910 0.0413 -0.2978 220 LEU D N 6268 C CA . LEU D 217 ? 0.8728 0.9171 0.9390 0.2073 0.0609 -0.3201 220 LEU D CA 6269 C C . LEU D 217 ? 0.9309 0.9073 0.9749 0.2049 0.0653 -0.3389 220 LEU D C 6270 O O . LEU D 217 ? 0.9295 0.8732 0.9775 0.1987 0.0553 -0.3288 220 LEU D O 6271 C CB . LEU D 217 ? 0.8697 0.9397 0.9701 0.2364 0.0732 -0.3103 220 LEU D CB 6272 C CG . LEU D 217 ? 0.8493 0.9756 0.9598 0.2383 0.0859 -0.3067 220 LEU D CG 6273 C CD1 . LEU D 217 ? 0.7948 0.9582 0.9216 0.2209 0.0756 -0.2836 220 LEU D CD1 6274 C CD2 . LEU D 217 ? 0.8702 1.0206 1.0117 0.2676 0.1033 -0.3092 220 LEU D CD2 6275 N N . SER D 218 ? 0.9914 0.9413 1.0068 0.2079 0.0837 -0.3672 221 SER D N 6276 C CA . SER D 218 ? 1.0673 0.9396 1.0523 0.2028 0.0969 -0.3905 221 SER D CA 6277 C C . SER D 218 ? 1.1250 0.9559 1.1102 0.2420 0.1200 -0.3927 221 SER D C 6278 O O . SER D 218 ? 1.1031 0.9802 1.1163 0.2706 0.1242 -0.3803 221 SER D O 6279 C CB . SER D 218 ? 1.1034 0.9720 1.0487 0.1720 0.1024 -0.4277 221 SER D CB 6280 O OG . SER D 218 ? 1.0612 0.9734 1.0061 0.1416 0.0803 -0.4260 221 SER D OG 6281 N N . GLU D 219 ? 1.2072 0.9500 1.1589 0.2434 0.1377 -0.4095 222 GLU D N 6282 C CA . GLU D 219 ? 1.2798 0.9681 1.2227 0.2879 0.1623 -0.4095 222 GLU D CA 6283 C C . GLU D 219 ? 1.3016 1.0198 1.2441 0.3101 0.1809 -0.4262 222 GLU D C 6284 O O . GLU D 219 ? 1.3155 1.0440 1.2782 0.3562 0.1921 -0.4141 222 GLU D O 6285 C CB . GLU D 219 ? 1.3805 0.9507 1.2716 0.2795 0.1853 -0.4287 222 GLU D CB 6286 N N . ASN D 220 ? 1.3075 1.0463 1.2267 0.2790 0.1838 -0.4542 223 ASN D N 6287 C CA . ASN D 220 ? 1.3366 1.0985 1.2459 0.2954 0.2036 -0.4734 223 ASN D CA 6288 C C . ASN D 220 ? 1.2627 1.1246 1.2099 0.3037 0.1934 -0.4545 223 ASN D C 6289 O O . ASN D 220 ? 1.2821 1.1693 1.2240 0.3188 0.2116 -0.4669 223 ASN D O 6290 C CB . ASN D 220 ? 1.3919 1.1237 1.2487 0.2599 0.2150 -0.5166 223 ASN D CB 6291 N N . ASP D 221 ? 1.1865 1.0990 1.1678 0.2923 0.1682 -0.4257 224 ASP D N 6292 C CA . ASP D 221 ? 1.1253 1.1206 1.1390 0.2955 0.1629 -0.4064 224 ASP D CA 6293 C C . ASP D 221 ? 1.1179 1.1463 1.1770 0.3336 0.1736 -0.3908 224 ASP D C 6294 O O . ASP D 221 ? 1.1180 1.1300 1.2001 0.3542 0.1668 -0.3762 224 ASP D O 6295 C CB . ASP D 221 ? 1.0564 1.0853 1.0855 0.2692 0.1360 -0.3832 224 ASP D CB 6296 C CG . ASP D 221 ? 1.0560 1.0852 1.0455 0.2365 0.1252 -0.3974 224 ASP D CG 6297 O OD1 . ASP D 221 ? 1.0997 1.1250 1.0527 0.2324 0.1376 -0.4238 224 ASP D OD1 6298 O OD2 . ASP D 221 ? 1.0122 1.0517 1.0068 0.2168 0.1038 -0.3831 224 ASP D OD2 6299 N N . GLU D 222 ? 1.1161 1.1964 1.1866 0.3435 0.1909 -0.3946 225 GLU D N 6300 C CA . GLU D 222 ? 1.1130 1.2429 1.2306 0.3781 0.2042 -0.3862 225 GLU D CA 6301 C C . GLU D 222 ? 1.0430 1.2438 1.2124 0.3684 0.1887 -0.3601 225 GLU D C 6302 O O . GLU D 222 ? 1.0026 1.2315 1.1686 0.3366 0.1832 -0.3515 225 GLU D O 6303 C CB . GLU D 222 ? 1.1434 1.3020 1.2525 0.3892 0.2337 -0.4042 225 GLU D CB 6304 N N . TRP D 223 ? 1.0378 1.2658 1.2505 0.3978 0.1832 -0.3487 226 TRP D N 6305 C CA . TRP D 223 ? 0.9790 1.2803 1.2437 0.3887 0.1685 -0.3290 226 TRP D CA 6306 C C . TRP D 223 ? 0.9839 1.3633 1.3031 0.4259 0.1800 -0.3306 226 TRP D C 6307 O O . TRP D 223 ? 1.0303 1.3905 1.3502 0.4722 0.1853 -0.3347 226 TRP D O 6308 C CB . TRP D 223 ? 0.9576 1.2249 1.2209 0.3819 0.1394 -0.3113 226 TRP D CB 6309 C CG . TRP D 223 ? 0.8990 1.2348 1.2067 0.3643 0.1231 -0.2940 226 TRP D CG 6310 C CD1 . TRP D 223 ? 0.8850 1.2738 1.2374 0.3880 0.1108 -0.2840 226 TRP D CD1 6311 C CD2 . TRP D 223 ? 0.8539 1.2116 1.1611 0.3198 0.1190 -0.2864 226 TRP D CD2 6312 N NE1 . TRP D 223 ? 0.8339 1.2785 1.2159 0.3551 0.0991 -0.2741 226 TRP D NE1 6313 C CE2 . TRP D 223 ? 0.8158 1.2355 1.1690 0.3132 0.1060 -0.2746 226 TRP D CE2 6314 C CE3 . TRP D 223 ? 0.8475 1.1777 1.1154 0.2881 0.1260 -0.2883 226 TRP D CE3 6315 C CZ2 . TRP D 223 ? 0.7770 1.2207 1.1361 0.2722 0.1035 -0.2660 226 TRP D CZ2 6316 C CZ3 . TRP D 223 ? 0.8113 1.1642 1.0828 0.2544 0.1232 -0.2757 226 TRP D CZ3 6317 C CH2 . TRP D 223 ? 0.7791 1.1828 1.0950 0.2448 0.1139 -0.2653 226 TRP D CH2 6318 N N . THR D 224 ? 0.9430 1.4108 1.3059 0.4059 0.1858 -0.3283 227 THR D N 6319 C CA . THR D 224 ? 0.9457 1.5110 1.3672 0.4340 0.1998 -0.3357 227 THR D CA 6320 C C . THR D 224 ? 0.8949 1.5526 1.3755 0.4191 0.1839 -0.3264 227 THR D C 6321 O O . THR D 224 ? 0.8959 1.6415 1.4298 0.4511 0.1844 -0.3313 227 THR D O 6322 C CB . THR D 224 ? 0.9608 1.5641 1.3841 0.4225 0.2351 -0.3528 227 THR D CB 6323 O OG1 . THR D 224 ? 0.9351 1.5257 1.3340 0.3694 0.2406 -0.3480 227 THR D OG1 6324 C CG2 . THR D 224 ? 1.0236 1.5595 1.4002 0.4515 0.2540 -0.3681 227 THR D CG2 6325 N N . GLN D 225 ? 0.8563 1.4978 1.3262 0.3720 0.1703 -0.3150 228 GLN D N 6326 C CA . GLN D 225 ? 0.8129 1.5367 1.3320 0.3450 0.1599 -0.3107 228 GLN D CA 6327 C C . GLN D 225 ? 0.8041 1.5704 1.3586 0.3797 0.1311 -0.3028 228 GLN D C 6328 O O . GLN D 225 ? 0.8303 1.5304 1.3557 0.4168 0.1152 -0.2926 228 GLN D O 6329 C CB . GLN D 225 ? 0.7849 1.4619 1.2724 0.2911 0.1541 -0.2990 228 GLN D CB 6330 C CG . GLN D 225 ? 0.8049 1.4395 1.2486 0.2610 0.1820 -0.3026 228 GLN D CG 6331 C CD . GLN D 225 ? 0.8164 1.5264 1.2916 0.2385 0.2172 -0.3164 228 GLN D CD 6332 O OE1 . GLN D 225 ? 0.8311 1.6032 1.3421 0.2639 0.2333 -0.3319 228 GLN D OE1 6333 N NE2 . GLN D 225 ? 0.8142 1.5142 1.2722 0.1910 0.2327 -0.3112 228 GLN D NE2 6334 N N . ASP D 226 ? 0.7746 1.6511 1.3878 0.3661 0.1268 -0.3087 229 ASP D N 6335 C CA . ASP D 226 ? 0.7694 1.7143 1.4217 0.4024 0.0994 -0.3038 229 ASP D CA 6336 C C . ASP D 226 ? 0.7603 1.6324 1.3780 0.4028 0.0669 -0.2820 229 ASP D C 6337 O O . ASP D 226 ? 0.7837 1.6540 1.4003 0.4533 0.0468 -0.2711 229 ASP D O 6338 C CB . ASP D 226 ? 0.7387 1.8291 1.4621 0.3758 0.1022 -0.3209 229 ASP D CB 6339 C CG . ASP D 226 ? 0.7577 1.9486 1.5296 0.3933 0.1309 -0.3439 229 ASP D CG 6340 O OD1 . ASP D 226 ? 0.7957 1.9721 1.5603 0.4521 0.1373 -0.3439 229 ASP D OD1 6341 O OD2 . ASP D 226 ? 0.7398 2.0229 1.5559 0.3468 0.1502 -0.3636 229 ASP D OD2 6342 N N . ARG D 227 ? 0.7331 1.5436 1.3190 0.3500 0.0642 -0.2746 230 ARG D N 6343 C CA . ARG D 227 ? 0.7230 1.4664 1.2765 0.3444 0.0363 -0.2553 230 ARG D CA 6344 C C . ARG D 227 ? 0.7588 1.3821 1.2539 0.3721 0.0330 -0.2438 230 ARG D C 6345 O O . ARG D 227 ? 0.7914 1.3770 1.2666 0.3894 0.0529 -0.2525 230 ARG D O 6346 C CB . ARG D 227 ? 0.6883 1.4116 1.2285 0.2814 0.0368 -0.2522 230 ARG D CB 6347 C CG . ARG D 227 ? 0.6954 1.3270 1.1832 0.2551 0.0538 -0.2494 230 ARG D CG 6348 C CD . ARG D 227 ? 0.6716 1.2834 1.1426 0.2024 0.0557 -0.2435 230 ARG D CD 6349 N NE . ARG D 227 ? 0.6848 1.2031 1.0976 0.1898 0.0604 -0.2346 230 ARG D NE 6350 C CZ . ARG D 227 ? 0.7016 1.1971 1.0877 0.1780 0.0858 -0.2399 230 ARG D CZ 6351 N NH1 . ARG D 227 ? 0.7161 1.2672 1.1274 0.1737 0.1125 -0.2535 230 ARG D NH1 6352 N NH2 . ARG D 227 ? 0.7054 1.1279 1.0386 0.1713 0.0849 -0.2322 230 ARG D NH2 6353 N N . ALA D 228 ? 0.7561 1.3205 1.2228 0.3727 0.0103 -0.2270 231 ALA D N 6354 C CA . ALA D 228 ? 0.7945 1.2452 1.2060 0.3922 0.0086 -0.2183 231 ALA D CA 6355 C C . ALA D 228 ? 0.7951 1.1758 1.1672 0.3598 0.0248 -0.2269 231 ALA D C 6356 O O . ALA D 228 ? 0.7599 1.1566 1.1335 0.3171 0.0288 -0.2293 231 ALA D O 6357 C CB . ALA D 228 ? 0.7904 1.1992 1.1810 0.3888 -0.0160 -0.1995 231 ALA D CB 6358 N N . LYS D 229 ? 0.8433 1.1458 1.1760 0.3821 0.0357 -0.2323 232 LYS D N 6359 C CA . LYS D 229 ? 0.8506 1.0924 1.1427 0.3554 0.0492 -0.2446 232 LYS D CA 6360 C C . LYS D 229 ? 0.8231 1.0183 1.0870 0.3166 0.0335 -0.2360 232 LYS D C 6361 O O . LYS D 229 ? 0.8392 0.9862 1.0860 0.3222 0.0205 -0.2257 232 LYS D O 6362 C CB . LYS D 229 ? 0.9224 1.0916 1.1783 0.3867 0.0658 -0.2567 232 LYS D CB 6363 C CG . LYS D 229 ? 0.9411 1.0690 1.1599 0.3633 0.0827 -0.2771 232 LYS D CG 6364 N N . PRO D 230 ? 0.7872 0.9966 1.0434 0.2801 0.0366 -0.2393 233 PRO D N 6365 C CA . PRO D 230 ? 0.7571 0.9382 0.9910 0.2469 0.0221 -0.2305 233 PRO D CA 6366 C C . PRO D 230 ? 0.7851 0.8983 0.9737 0.2371 0.0229 -0.2419 233 PRO D C 6367 O O . PRO D 230 ? 0.7752 0.8873 0.9407 0.2146 0.0250 -0.2484 233 PRO D O 6368 C CB . PRO D 230 ? 0.7259 0.9500 0.9649 0.2214 0.0307 -0.2292 233 PRO D CB 6369 C CG . PRO D 230 ? 0.7504 0.9997 0.9943 0.2352 0.0539 -0.2438 233 PRO D CG 6370 C CD . PRO D 230 ? 0.7824 1.0334 1.0456 0.2727 0.0569 -0.2505 233 PRO D CD 6371 N N . VAL D 231 ? 0.8248 0.8829 0.9984 0.2542 0.0228 -0.2450 234 VAL D N 6372 C CA . VAL D 231 ? 0.8638 0.8547 0.9950 0.2402 0.0283 -0.2618 234 VAL D CA 6373 C C . VAL D 231 ? 0.8375 0.8118 0.9548 0.2077 0.0123 -0.2560 234 VAL D C 6374 O O . VAL D 231 ? 0.7918 0.7953 0.9289 0.2003 -0.0030 -0.2362 234 VAL D O 6375 C CB . VAL D 231 ? 0.9364 0.8576 1.0477 0.2683 0.0412 -0.2675 234 VAL D CB 6376 C CG1 . VAL D 231 ? 0.9759 0.9025 1.0887 0.2992 0.0624 -0.2817 234 VAL D CG1 6377 C CG2 . VAL D 231 ? 0.9366 0.8501 1.0624 0.2918 0.0294 -0.2427 234 VAL D CG2 6378 N N . THR D 232 ? 0.8687 0.8002 0.9524 0.1867 0.0176 -0.2763 235 THR D N 6379 C CA . THR D 232 ? 0.8538 0.7688 0.9242 0.1562 0.0058 -0.2759 235 THR D CA 6380 C C . THR D 232 ? 0.8731 0.7377 0.9425 0.1647 0.0030 -0.2595 235 THR D C 6381 O O . THR D 232 ? 0.9373 0.7383 0.9867 0.1812 0.0184 -0.2652 235 THR D O 6382 C CB . THR D 232 ? 0.8945 0.7847 0.9317 0.1293 0.0149 -0.3085 235 THR D CB 6383 O OG1 . THR D 232 ? 0.8781 0.8212 0.9112 0.1263 0.0152 -0.3213 235 THR D OG1 6384 C CG2 . THR D 232 ? 0.8838 0.7683 0.9127 0.0961 0.0043 -0.3112 235 THR D CG2 6385 N N . GLN D 233 ? 0.8247 0.7129 0.9100 0.1560 -0.0144 -0.2383 236 GLN D N 6386 C CA . GLN D 233 ? 0.8369 0.6896 0.9218 0.1690 -0.0197 -0.2178 236 GLN D CA 6387 C C . GLN D 233 ? 0.7996 0.6621 0.8863 0.1432 -0.0351 -0.2053 236 GLN D C 6388 O O . GLN D 233 ? 0.7517 0.6606 0.8475 0.1225 -0.0440 -0.2073 236 GLN D O 6389 C CB . GLN D 233 ? 0.8186 0.7101 0.9331 0.2053 -0.0255 -0.1993 236 GLN D CB 6390 C CG . GLN D 233 ? 0.7428 0.7148 0.8913 0.1963 -0.0376 -0.1913 236 GLN D CG 6391 C CD . GLN D 233 ? 0.7244 0.7473 0.9068 0.2251 -0.0411 -0.1803 236 GLN D CD 6392 O OE1 . GLN D 233 ? 0.7228 0.7854 0.9234 0.2359 -0.0313 -0.1892 236 GLN D OE1 6393 N NE2 . GLN D 233 ? 0.7159 0.7448 0.9071 0.2371 -0.0548 -0.1627 236 GLN D NE2 6394 N N . ILE D 234 ? 0.8290 0.6441 0.9021 0.1484 -0.0363 -0.1912 237 ILE D N 6395 C CA . ILE D 234 ? 0.7975 0.6209 0.8727 0.1295 -0.0501 -0.1762 237 ILE D CA 6396 C C . ILE D 234 ? 0.7722 0.6273 0.8683 0.1544 -0.0650 -0.1509 237 ILE D C 6397 O O . ILE D 234 ? 0.8083 0.6409 0.8992 0.1876 -0.0628 -0.1404 237 ILE D O 6398 C CB . ILE D 234 ? 0.8540 0.6017 0.8940 0.1118 -0.0386 -0.1796 237 ILE D CB 6399 C CG1 . ILE D 234 ? 0.8708 0.6071 0.8960 0.0759 -0.0256 -0.2109 237 ILE D CG1 6400 C CG2 . ILE D 234 ? 0.8276 0.5817 0.8687 0.0992 -0.0517 -0.1604 237 ILE D CG2 6401 C CD1 . ILE D 234 ? 0.9516 0.6003 0.9377 0.0559 -0.0030 -0.2234 237 ILE D CD1 6402 N N . VAL D 235 ? 0.7151 0.6247 0.8322 0.1395 -0.0792 -0.1427 238 VAL D N 6403 C CA . VAL D 235 ? 0.6909 0.6379 0.8275 0.1522 -0.0937 -0.1241 238 VAL D CA 6404 C C . VAL D 235 ? 0.6806 0.6145 0.8049 0.1312 -0.1030 -0.1126 238 VAL D C 6405 O O . VAL D 235 ? 0.6559 0.5950 0.7759 0.1046 -0.1022 -0.1185 238 VAL D O 6406 C CB . VAL D 235 ? 0.6418 0.6596 0.8107 0.1493 -0.0966 -0.1267 238 VAL D CB 6407 C CG1 . VAL D 235 ? 0.6264 0.6894 0.8183 0.1620 -0.1090 -0.1148 238 VAL D CG1 6408 C CG2 . VAL D 235 ? 0.6504 0.6815 0.8282 0.1627 -0.0834 -0.1414 238 VAL D CG2 6409 N N . SER D 236 ? 0.7058 0.6266 0.8224 0.1469 -0.1117 -0.0962 239 SER D N 6410 C CA . SER D 236 ? 0.7080 0.6085 0.8072 0.1296 -0.1183 -0.0848 239 SER D CA 6411 C C . SER D 236 ? 0.6941 0.6341 0.8039 0.1387 -0.1352 -0.0699 239 SER D C 6412 O O . SER D 236 ? 0.7111 0.6772 0.8312 0.1685 -0.1426 -0.0641 239 SER D O 6413 C CB . SER D 236 ? 0.7710 0.5918 0.8311 0.1331 -0.1069 -0.0804 239 SER D CB 6414 O OG . SER D 236 ? 0.7958 0.5825 0.8446 0.1129 -0.0900 -0.0998 239 SER D OG 6415 N N . ALA D 237 ? 0.6700 0.6190 0.7766 0.1136 -0.1408 -0.0659 240 ALA D N 6416 C CA . ALA D 237 ? 0.6683 0.6430 0.7747 0.1158 -0.1553 -0.0542 240 ALA D CA 6417 C C . ALA D 237 ? 0.6968 0.6214 0.7692 0.1046 -0.1545 -0.0433 240 ALA D C 6418 O O . ALA D 237 ? 0.6938 0.5872 0.7550 0.0828 -0.1435 -0.0488 240 ALA D O 6419 C CB . ALA D 237 ? 0.6203 0.6491 0.7504 0.0942 -0.1585 -0.0611 240 ALA D CB 6420 N N . GLU D 238 ? 0.7301 0.6537 0.7859 0.1201 -0.1659 -0.0290 241 GLU D N 6421 C CA . GLU D 238 ? 0.7704 0.6405 0.7874 0.1134 -0.1626 -0.0164 241 GLU D CA 6422 C C . GLU D 238 ? 0.7694 0.6683 0.7776 0.1118 -0.1781 -0.0068 241 GLU D C 6423 O O . GLU D 238 ? 0.7547 0.7141 0.7829 0.1235 -0.1936 -0.0088 241 GLU D O 6424 C CB . GLU D 238 ? 0.8434 0.6441 0.8236 0.1402 -0.1521 -0.0051 241 GLU D CB 6425 C CG . GLU D 238 ? 0.8834 0.7032 0.8624 0.1877 -0.1627 0.0051 241 GLU D CG 6426 C CD . GLU D 238 ? 0.9800 0.7137 0.9124 0.2193 -0.1460 0.0180 241 GLU D CD 6427 O OE1 . GLU D 238 ? 1.0076 0.6714 0.9201 0.1988 -0.1225 0.0105 241 GLU D OE1 6428 O OE2 . GLU D 238 ? 1.0291 0.7656 0.9420 0.2659 -0.1548 0.0347 241 GLU D OE2 6429 N N . ALA D 239 ? 0.7901 0.6494 0.7685 0.0945 -0.1725 0.0004 242 ALA D N 6430 C CA . ALA D 239 ? 0.7992 0.6748 0.7602 0.0907 -0.1844 0.0089 242 ALA D CA 6431 C C . ALA D 239 ? 0.8569 0.6651 0.7692 0.0902 -0.1744 0.0243 242 ALA D C 6432 O O . ALA D 239 ? 0.8691 0.6276 0.7703 0.0728 -0.1550 0.0216 242 ALA D O 6433 C CB . ALA D 239 ? 0.7467 0.6586 0.7281 0.0585 -0.1844 -0.0035 242 ALA D CB 6434 N N . TRP D 240 ? 0.8983 0.7093 0.7805 0.1080 -0.1869 0.0386 243 TRP D N 6435 C CA . TRP D 240 ? 0.9633 0.7089 0.7916 0.1092 -0.1762 0.0557 243 TRP D CA 6436 C C . TRP D 240 ? 0.9465 0.7078 0.7656 0.0819 -0.1788 0.0535 243 TRP D C 6437 O O . TRP D 240 ? 0.9035 0.7267 0.7472 0.0722 -0.1939 0.0426 243 TRP D O 6438 C CB . TRP D 240 ? 1.0357 0.7632 0.8226 0.1561 -0.1859 0.0773 243 TRP D CB 6439 C CG . TRP D 240 ? 1.0854 0.7675 0.8630 0.1869 -0.1744 0.0838 243 TRP D CG 6440 C CD1 . TRP D 240 ? 1.0670 0.7943 0.8807 0.2109 -0.1843 0.0761 243 TRP D CD1 6441 C CD2 . TRP D 240 ? 1.1696 0.7463 0.8948 0.1954 -0.1465 0.0978 243 TRP D CD2 6442 N NE1 . TRP D 240 ? 1.1330 0.7882 0.9189 0.2373 -0.1654 0.0850 243 TRP D NE1 6443 C CE2 . TRP D 240 ? 1.2003 0.7581 0.9298 0.2270 -0.1408 0.0979 243 TRP D CE2 6444 C CE3 . TRP D 240 ? 1.2303 0.7234 0.9032 0.1771 -0.1221 0.1087 243 TRP D CE3 6445 C CZ2 . TRP D 240 ? 1.2945 0.7444 0.9735 0.2405 -0.1102 0.1082 243 TRP D CZ2 6446 C CZ3 . TRP D 240 ? 1.3246 0.7128 0.9487 0.1868 -0.0907 0.1184 243 TRP D CZ3 6447 C CH2 . TRP D 240 ? 1.3581 0.7216 0.9836 0.2182 -0.0844 0.1179 243 TRP D CH2 6448 N N . GLY D 241 ? 0.9889 0.6905 0.7705 0.0677 -0.1605 0.0622 244 GLY D N 6449 C CA . GLY D 241 ? 0.9884 0.6954 0.7536 0.0450 -0.1590 0.0618 244 GLY D CA 6450 C C . GLY D 241 ? 1.0202 0.7550 0.7573 0.0640 -0.1801 0.0715 244 GLY D C 6451 O O . GLY D 241 ? 1.0675 0.7987 0.7799 0.1003 -0.1919 0.0861 244 GLY D O 6452 N N . ARG D 242 ? 1.0013 0.7657 0.7394 0.0414 -0.1842 0.0623 245 ARG D N 6453 C CA . ARG D 242 ? 1.0264 0.8316 0.7428 0.0512 -0.2054 0.0633 245 ARG D CA 6454 C C . ARG D 242 ? 1.0529 0.8345 0.7301 0.0317 -0.1965 0.0657 245 ARG D C 6455 O O . ARG D 242 ? 1.0196 0.7992 0.7126 0.0018 -0.1824 0.0530 245 ARG D O 6456 C CB . ARG D 242 ? 0.9718 0.8538 0.7350 0.0393 -0.2214 0.0406 245 ARG D CB 6457 C CG . ARG D 242 ? 0.9844 0.9267 0.7638 0.0689 -0.2458 0.0393 245 ARG D CG 6458 C CD . ARG D 242 ? 0.9365 0.9453 0.7716 0.0489 -0.2513 0.0138 245 ARG D CD 6459 N NE . ARG D 242 ? 0.9077 0.9048 0.7529 0.0085 -0.2348 -0.0017 245 ARG D NE 6460 C CZ . ARG D 242 ? 0.8730 0.9055 0.7544 -0.0148 -0.2304 -0.0227 245 ARG D CZ 6461 N NH1 . ARG D 242 ? 0.8595 0.9505 0.7769 -0.0073 -0.2418 -0.0336 245 ARG D NH1 6462 N NH2 . ARG D 242 ? 0.8561 0.8630 0.7343 -0.0442 -0.2115 -0.0324 245 ARG D NH2 6463 N N . ALA D 243 ? 1.1217 0.8861 0.7442 0.0530 -0.2040 0.0828 246 ALA D N 6464 C CA . ALA D 243 ? 1.1558 0.9033 0.7348 0.0379 -0.1978 0.0849 246 ALA D CA 6465 C C . ALA D 243 ? 1.1358 0.9526 0.7255 0.0240 -0.2177 0.0638 246 ALA D C 6466 O O . ALA D 243 ? 1.1081 0.9270 0.7080 -0.0077 -0.2061 0.0474 246 ALA D O 6467 C CB . ALA D 243 ? 1.2437 0.9422 0.7519 0.0679 -0.1964 0.1124 246 ALA D CB 6468 N N . ASP D 244 ? 1.1583 1.0329 0.7446 0.0487 -0.2460 0.0627 247 ASP D N 6469 C CA . ASP D 244 ? 1.1494 1.1022 0.7462 0.0332 -0.2667 0.0376 247 ASP D CA 6470 C C . ASP D 244 ? 1.1856 1.1280 0.7340 0.0136 -0.2631 0.0318 247 ASP D C 6471 O O . ASP D 244 ? 1.2230 1.2173 0.7430 0.0222 -0.2856 0.0251 247 ASP D O 6472 C CB . ASP D 244 ? 1.0820 1.0719 0.7419 0.0017 -0.2619 0.0101 247 ASP D CB 6473 C CG . ASP D 244 ? 1.0571 1.0871 0.7642 0.0223 -0.2735 0.0093 247 ASP D CG 6474 O OD1 . ASP D 244 ? 1.0855 1.1651 0.7864 0.0558 -0.2975 0.0153 247 ASP D OD1 6475 O OD2 . ASP D 244 ? 1.0174 1.0327 0.7660 0.0081 -0.2585 0.0028 247 ASP D OD2 6476 C C1 . NAG E . ? 0.6794 1.4561 1.1171 0.0401 0.0889 -0.0049 400 NAG A C1 6477 C C2 . NAG E . ? 0.6998 1.5767 1.2055 0.0379 0.1049 0.0152 400 NAG A C2 6478 C C3 . NAG E . ? 0.7108 1.6044 1.2345 -0.0047 0.1183 0.0314 400 NAG A C3 6479 C C4 . NAG E . ? 0.7284 1.5520 1.1907 -0.0053 0.1377 0.0277 400 NAG A C4 6480 C C5 . NAG E . ? 0.7150 1.4458 1.1121 0.0089 0.1205 0.0048 400 NAG A C5 6481 C C6 . NAG E . ? 0.7284 1.3981 1.0661 0.0201 0.1392 -0.0002 400 NAG A C6 6482 C C7 . NAG E . ? 0.7015 1.6679 1.2748 0.0737 0.0767 0.0151 400 NAG A C7 6483 C C8 . NAG E . ? 0.6966 1.7188 1.3228 0.0643 0.0473 0.0192 400 NAG A C8 6484 N N2 . NAG E . ? 0.6959 1.6282 1.2533 0.0336 0.0803 0.0181 400 NAG A N2 6485 O O3 . NAG E . ? 0.7157 1.7056 1.3013 -0.0029 0.1401 0.0518 400 NAG A O3 6486 O O4 . NAG E . ? 0.7485 1.5668 1.2193 -0.0523 0.1382 0.0402 400 NAG A O4 6487 O O5 . NAG E . ? 0.7017 1.4325 1.0937 0.0462 0.1111 -0.0070 400 NAG A O5 6488 O O6 . NAG E . ? 0.7357 1.4085 1.0533 0.0651 0.1568 -0.0053 400 NAG A O6 6489 O O7 . NAG E . ? 0.7128 1.6632 1.2566 0.1174 0.0939 0.0089 400 NAG A O7 6490 C C1 . NAG F . ? 0.7767 1.6131 1.2446 -0.0564 0.1726 0.0571 401 NAG A C1 6491 C C2 . NAG F . ? 0.7828 1.7273 1.3193 -0.0508 0.1960 0.0785 401 NAG A C2 6492 C C3 . NAG F . ? 0.8165 1.7785 1.3438 -0.0520 0.2364 0.0973 401 NAG A C3 6493 C C4 . NAG F . ? 0.8337 1.7162 1.2792 -0.0190 0.2516 0.0840 401 NAG A C4 6494 C C5 . NAG F . ? 0.8244 1.6072 1.2143 -0.0321 0.2217 0.0638 401 NAG A C5 6495 C C6 . NAG F . ? 0.8429 1.5505 1.1565 -0.0008 0.2318 0.0498 401 NAG A C6 6496 N N2 . NAG F . ? 0.7747 1.7762 1.3770 -0.0921 0.1756 0.0904 401 NAG A N2 6497 O O3 . NAG F . ? 0.8188 1.8817 1.4034 -0.0319 0.2624 0.1139 401 NAG A O3 6498 O O4 . NAG F . ? 0.8703 1.7583 1.3000 -0.0273 0.2852 0.1024 401 NAG A O4 6499 O O5 . NAG F . ? 0.7935 1.5732 1.1982 -0.0247 0.1908 0.0477 401 NAG A O5 6500 O O6 . NAG F . ? 0.8262 1.4578 1.1010 -0.0061 0.2020 0.0296 401 NAG A O6 6501 C C1 . NAG G . ? 0.7265 0.9068 0.8019 -0.1329 0.0007 -0.0709 314 NAG A C1 6502 C C2 . NAG G . ? 0.7382 0.9720 0.8550 -0.1529 0.0098 -0.0527 314 NAG A C2 6503 C C3 . NAG G . ? 0.7490 1.0102 0.8981 -0.1779 -0.0099 -0.0500 314 NAG A C3 6504 C C4 . NAG G . ? 0.7891 0.9860 0.9011 -0.1982 -0.0297 -0.0578 314 NAG A C4 6505 C C5 . NAG G . ? 0.7740 0.9282 0.8486 -0.1719 -0.0369 -0.0768 314 NAG A C5 6506 C C6 . NAG G . ? 0.8150 0.9053 0.8485 -0.1840 -0.0555 -0.0869 314 NAG A C6 6507 C C7 . NAG G . ? 0.7175 1.0241 0.8653 -0.1281 0.0512 -0.0340 314 NAG A C7 6508 C C8 . NAG G . ? 0.7537 1.0352 0.8863 -0.1552 0.0583 -0.0207 314 NAG A C8 6509 N N2 . NAG G . ? 0.7104 0.9933 0.8507 -0.1294 0.0285 -0.0478 314 NAG A N2 6510 O O3 . NAG G . ? 0.7585 1.0728 0.9503 -0.2001 -0.0014 -0.0314 314 NAG A O3 6511 O O4 . NAG G . ? 0.8228 1.0276 0.9535 -0.2317 -0.0500 -0.0532 314 NAG A O4 6512 O O5 . NAG G . ? 0.7564 0.8937 0.8095 -0.1483 -0.0191 -0.0789 314 NAG A O5 6513 O O6 . NAG G . ? 0.8596 0.9047 0.8632 -0.1936 -0.0494 -0.0821 314 NAG A O6 6514 O O7 . NAG G . ? 0.7016 1.0461 0.8640 -0.1043 0.0668 -0.0316 314 NAG A O7 6515 C C1 . NAG H . ? 0.8088 1.0589 0.9742 -0.2329 -0.0664 -0.0559 315 NAG A C1 6516 C C2 . NAG H . ? 0.8417 1.1206 1.0426 -0.2745 -0.0797 -0.0420 315 NAG A C2 6517 C C3 . NAG H . ? 0.8448 1.1529 1.0711 -0.2845 -0.1080 -0.0468 315 NAG A C3 6518 C C4 . NAG H . ? 0.8504 1.0997 1.0266 -0.2685 -0.1270 -0.0676 315 NAG A C4 6519 C C5 . NAG H . ? 0.8132 1.0469 0.9640 -0.2272 -0.1075 -0.0772 315 NAG A C5 6520 C C6 . NAG H . ? 0.8179 0.9966 0.9200 -0.2120 -0.1220 -0.0955 315 NAG A C6 6521 N N2 . NAG H . ? 0.8297 1.1733 1.0776 -0.2809 -0.0569 -0.0222 315 NAG A N2 6522 O O4 . NAG H . ? 0.8500 1.1319 1.0491 -0.2722 -0.1511 -0.0709 315 NAG A O4 6523 O O5 . NAG H . ? 0.8188 1.0252 0.9492 -0.2226 -0.0855 -0.0734 315 NAG A O5 6524 O O6 . NAG H . ? 0.8128 0.9344 0.8696 -0.1992 -0.1101 -0.1032 315 NAG A O6 6525 C C1 . NAG I . ? 0.7012 1.1255 0.8880 -0.0104 0.1462 -0.0785 501 NAG A C1 6526 C C2 . NAG I . ? 0.7399 1.1762 0.9044 -0.0036 0.1771 -0.0668 501 NAG A C2 6527 C C3 . NAG I . ? 0.7674 1.1895 0.9264 -0.0345 0.1829 -0.0490 501 NAG A C3 6528 C C4 . NAG I . ? 0.7664 1.2330 0.9890 -0.0634 0.1767 -0.0382 501 NAG A C4 6529 C C5 . NAG I . ? 0.7281 1.1726 0.9642 -0.0685 0.1430 -0.0527 501 NAG A C5 6530 C C6 . NAG I . ? 0.7247 1.2023 1.0169 -0.0983 0.1297 -0.0450 501 NAG A C6 6531 C C7 . NAG I . ? 0.7606 1.1731 0.8564 0.0547 0.1950 -0.0859 501 NAG A C7 6532 C C8 . NAG I . ? 0.7849 1.1432 0.8131 0.0778 0.1952 -0.0980 501 NAG A C8 6533 N N2 . NAG I . ? 0.7536 1.1491 0.8593 0.0234 0.1819 -0.0778 501 NAG A N2 6534 O O3 . NAG I . ? 0.8040 1.2364 0.9388 -0.0279 0.2127 -0.0366 501 NAG A O3 6535 O O4 . NAG I . ? 0.8161 1.2873 1.0467 -0.0944 0.1889 -0.0169 501 NAG A O4 6536 O O5 . NAG I . ? 0.6981 1.1558 0.9366 -0.0383 0.1383 -0.0687 501 NAG A O5 6537 O O6 . NAG I . ? 0.7080 1.1507 0.9961 -0.1006 0.0987 -0.0591 501 NAG A O6 6538 O O7 . NAG I . ? 0.7538 1.2220 0.8919 0.0658 0.2050 -0.0843 501 NAG A O7 6539 C C1 . NAG J . ? 0.8487 1.2545 1.0372 -0.1120 0.1776 -0.0124 502 NAG A C1 6540 C C2 . NAG J . ? 0.8973 1.3073 1.0678 -0.1248 0.2062 0.0101 502 NAG A C2 6541 C C3 . NAG J . ? 0.9318 1.2861 1.0747 -0.1534 0.1964 0.0228 502 NAG A C3 6542 C C4 . NAG J . ? 0.9201 1.2633 1.0971 -0.1806 0.1679 0.0206 502 NAG A C4 6543 C C5 . NAG J . ? 0.8761 1.2101 1.0583 -0.1600 0.1420 -0.0044 502 NAG A C5 6544 C C6 . NAG J . ? 0.8680 1.1870 1.0766 -0.1833 0.1131 -0.0085 502 NAG A C6 6545 N N2 . NAG J . ? 0.9131 1.3106 1.0338 -0.0942 0.2255 0.0061 502 NAG A N2 6546 O O3 . NAG J . ? 0.9758 1.3472 1.1170 -0.1717 0.2242 0.0476 502 NAG A O3 6547 O O4 . NAG J . ? 0.9588 1.2379 1.0982 -0.1996 0.1570 0.0292 502 NAG A O4 6548 O O5 . NAG J . ? 0.8474 1.2391 1.0618 -0.1388 0.1520 -0.0125 502 NAG A O5 6549 O O6 . NAG J . ? 0.8857 1.1331 1.0483 -0.1853 0.0953 -0.0126 502 NAG A O6 6557 C C1 . NAG L . ? 0.7586 1.7117 1.3274 0.2929 0.0944 -0.1332 551 NAG A C1 6558 C C2 . NAG L . ? 0.7911 1.8095 1.3888 0.3456 0.1065 -0.1341 551 NAG A C2 6559 C C3 . NAG L . ? 0.8303 1.8101 1.3654 0.3871 0.1378 -0.1403 551 NAG A C3 6560 C C4 . NAG L . ? 0.8302 1.7895 1.3387 0.3608 0.1675 -0.1326 551 NAG A C4 6561 C C5 . NAG L . ? 0.8013 1.6962 1.2854 0.3086 0.1487 -0.1324 551 NAG A C5 6562 C C6 . NAG L . ? 0.8041 1.6822 1.2640 0.2836 0.1763 -0.1233 551 NAG A C6 6563 C C7 . NAG L . ? 0.8108 1.8963 1.4652 0.4000 0.0648 -0.1425 551 NAG A C7 6564 C C8 . NAG L . ? 0.8240 1.8743 1.4590 0.4235 0.0272 -0.1539 551 NAG A C8 6565 N N2 . NAG L . ? 0.8006 1.8059 1.3966 0.3703 0.0730 -0.1445 551 NAG A N2 6566 O O3 . NAG L . ? 0.8536 1.9136 1.4289 0.4323 0.1560 -0.1372 551 NAG A O3 6567 O O4 . NAG L . ? 0.8726 1.7732 1.3063 0.3986 0.1878 -0.1425 551 NAG A O4 6568 O O5 . NAG L . ? 0.7652 1.7077 1.3151 0.2735 0.1247 -0.1250 551 NAG A O5 6569 O O6 . NAG L . ? 0.7687 1.6405 1.2500 0.2306 0.1634 -0.1146 551 NAG A O6 6570 O O7 . NAG L . ? 0.8079 1.9932 1.5290 0.4095 0.0863 -0.1310 551 NAG A O7 6571 N N2 . FEE M . ? 0.6525 0.6521 0.4956 0.0091 -0.0264 -0.1674 601 FEE A N2 6572 C C3 . FEE M . ? 0.6301 0.6478 0.4931 -0.0030 -0.0456 -0.1577 601 FEE A C3 6573 C C4 . FEE M . ? 0.6080 0.6441 0.4978 0.0001 -0.0343 -0.1521 601 FEE A C4 6574 C C5 . FEE M . ? 0.5930 0.6414 0.5097 -0.0020 -0.0329 -0.1534 601 FEE A C5 6575 C C6 . FEE M . ? 0.5808 0.6425 0.5190 0.0007 -0.0279 -0.1486 601 FEE A C6 6576 C C7 . FEE M . ? 0.5881 0.6501 0.5295 0.0036 -0.0166 -0.1489 601 FEE A C7 6577 C C8 . FEE M . ? 0.5776 0.6474 0.5392 0.0047 -0.0151 -0.1502 601 FEE A C8 6578 C C9 . FEE M . ? 0.5779 0.6490 0.5483 0.0056 -0.0185 -0.1460 601 FEE A C9 6579 C C1 . FEE M . ? 0.6731 0.6441 0.4841 -0.0041 -0.0557 -0.1725 601 FEE A C1 6580 C CAX . FEE M . ? 0.5602 0.6947 0.5816 0.0668 -0.0042 -0.1772 601 FEE A CAX 6581 C CAW . FEE M . ? 0.5835 0.7277 0.6088 0.0867 -0.0069 -0.1813 601 FEE A CAW 6582 C CAV . FEE M . ? 0.6096 0.7250 0.6014 0.1028 -0.0022 -0.1858 601 FEE A CAV 6583 C CAU . FEE M . ? 0.6286 0.7407 0.6154 0.1253 -0.0085 -0.1900 601 FEE A CAU 6584 C CAT . FEE M . ? 0.6650 0.7238 0.6070 0.1330 -0.0126 -0.1937 601 FEE A CAT 6585 C CAS . FEE M . ? 0.6740 0.7103 0.6056 0.1288 -0.0247 -0.1922 601 FEE A CAS 6586 C CAR . FEE M . ? 0.7004 0.6857 0.5928 0.1204 -0.0262 -0.1912 601 FEE A CAR 6587 C CAQ . FEE M . ? 0.6863 0.6663 0.5808 0.1012 -0.0297 -0.1858 601 FEE A CAQ 6588 C CAP . FEE M . ? 0.6973 0.6544 0.5758 0.0825 -0.0264 -0.1827 601 FEE A CAP 6589 C CAO . FEE M . ? 0.6852 0.6490 0.5729 0.0659 -0.0264 -0.1766 601 FEE A CAO 6590 C CAN . FEE M . ? 0.6711 0.6540 0.5757 0.0505 -0.0220 -0.1747 601 FEE A CAN 6591 C CAM . FEE M . ? 0.6542 0.6637 0.5821 0.0465 -0.0216 -0.1726 601 FEE A CAM 6592 C CAL . FEE M . ? 0.6366 0.6619 0.5785 0.0347 -0.0184 -0.1702 601 FEE A CAL 6593 C CAK . FEE M . ? 0.6145 0.6635 0.5777 0.0360 -0.0183 -0.1714 601 FEE A CAK 6594 C CAJ . FEE M . ? 0.5977 0.6561 0.5675 0.0280 -0.0149 -0.1692 601 FEE A CAJ 6595 C CAI . FEE M . ? 0.5906 0.6615 0.5674 0.0318 -0.0106 -0.1707 601 FEE A CAI 6596 C CAH . FEE M . ? 0.5848 0.6585 0.5591 0.0249 -0.0068 -0.1676 601 FEE A CAH 6597 C CAG . FEE M . ? 0.5967 0.6617 0.5527 0.0306 -0.0022 -0.1704 601 FEE A CAG 6598 C CAF . FEE M . ? 0.5926 0.6583 0.5404 0.0255 0.0012 -0.1671 601 FEE A CAF 6599 C CAE . FEE M . ? 0.6128 0.6578 0.5307 0.0306 0.0017 -0.1716 601 FEE A CAE 6600 C CAD . FEE M . ? 0.6149 0.6550 0.5176 0.0255 0.0016 -0.1685 601 FEE A CAD 6601 C CAC . FEE M . ? 0.6479 0.6639 0.5143 0.0332 0.0021 -0.1745 601 FEE A CAC 6602 C CAB . FEE M . ? 0.6618 0.6669 0.5062 0.0278 -0.0027 -0.1723 601 FEE A CAB 6603 C CAA . FEE M . ? 0.6587 0.6533 0.5026 0.0151 -0.0200 -0.1726 601 FEE A CAA 6604 O OAA . FEE M . ? 0.6643 0.6478 0.5090 0.0108 -0.0272 -0.1763 601 FEE A OAA 6605 C C2 . FEE M . ? 0.6433 0.6434 0.4926 -0.0021 -0.0433 -0.1661 601 FEE A C2 6606 O O3 . FEE M . ? 0.6230 0.6508 0.4994 -0.0114 -0.0615 -0.1557 601 FEE A O3 6607 O O4 . FEE M . ? 0.6030 0.6456 0.4973 0.0007 -0.0396 -0.1450 601 FEE A O4 6608 O O1A . FEE M . ? 0.6807 0.6408 0.4617 0.0060 -0.0487 -0.1725 601 FEE A O1A 6609 C C1A . FEE M . ? 0.7263 0.6559 0.4645 0.0060 -0.0620 -0.1787 601 FEE A C1A 6610 O O6A . FEE M . ? 0.7586 0.6570 0.4670 0.0117 -0.0613 -0.1892 601 FEE A O6A 6611 C C5M . FEE M . ? 0.7666 0.6628 0.4621 0.0297 -0.0395 -0.1914 601 FEE A C5M 6612 C C6A . FEE M . ? 0.8131 0.6697 0.4713 0.0387 -0.0424 -0.2036 601 FEE A C6A 6613 O O5A . FEE M . ? 0.7932 0.6517 0.4774 0.0321 -0.0456 -0.2047 601 FEE A O5A 6614 C C4A . FEE M . ? 0.7857 0.6837 0.4567 0.0403 -0.0274 -0.1868 601 FEE A C4A 6615 O O4A . FEE M . ? 0.8453 0.7037 0.4597 0.0453 -0.0389 -0.1945 601 FEE A O4A 6616 C C3A . FEE M . ? 0.7486 0.6741 0.4483 0.0307 -0.0288 -0.1746 601 FEE A C3A 6617 O O3A . FEE M . ? 0.7749 0.6949 0.4450 0.0385 -0.0193 -0.1687 601 FEE A O3A 6618 C C2A . FEE M . ? 0.7476 0.6718 0.4569 0.0162 -0.0541 -0.1745 601 FEE A C2A 6619 O O2A . FEE M . ? 0.7230 0.6713 0.4579 0.0123 -0.0547 -0.1636 601 FEE A O2A 6620 C C1 . D12 N . ? 0.6346 0.6736 0.5961 0.0314 -0.0357 -0.1332 611 D12 A C1 6621 C C2 . D12 N . ? 0.6554 0.6775 0.6070 0.0457 -0.0410 -0.1313 611 D12 A C2 6622 C C3 . D12 N . ? 0.6460 0.6917 0.6094 0.0608 -0.0415 -0.1323 611 D12 A C3 6623 C C4 . D12 N . ? 0.6571 0.7101 0.6187 0.0716 -0.0487 -0.1262 611 D12 A C4 6624 C C5 . D12 N . ? 0.6462 0.7364 0.6296 0.0842 -0.0482 -0.1255 611 D12 A C5 6625 C C6 . D12 N . ? 0.6749 0.7698 0.6562 0.1038 -0.0566 -0.1202 611 D12 A C6 6626 C C7 . D12 N . ? 0.6803 0.8022 0.6778 0.1257 -0.0518 -0.1203 611 D12 A C7 6627 C C8 . D12 N . ? 0.7102 0.8377 0.7058 0.1501 -0.0609 -0.1151 611 D12 A C8 6628 C C9 . D12 N . ? 0.7368 0.8563 0.7237 0.1797 -0.0549 -0.1176 611 D12 A C9 6629 C C10 . D12 N . ? 0.7782 0.8740 0.7442 0.2057 -0.0659 -0.1141 611 D12 A C10 6630 C C11 . D12 N . ? 0.8237 0.8768 0.7581 0.2319 -0.0622 -0.1195 611 D12 A C11 6631 C C12 . D12 N . ? 0.8726 0.8889 0.7779 0.2575 -0.0748 -0.1159 611 D12 A C12 6639 O O . HOH P . ? 0.6400 0.6451 0.5482 0.1098 -0.0162 -0.1680 304 HOH A O 6640 O O . HOH P . ? 0.7490 0.8613 0.6864 0.3364 -0.0302 -0.2157 305 HOH A O 6641 O O . HOH P . ? 0.3912 0.3612 0.5036 0.0539 -0.0629 -0.1953 306 HOH A O 6642 O O . HOH P . ? 0.9054 0.7001 0.5395 0.2015 -0.1367 -0.1722 307 HOH A O 6643 O O . HOH P . ? 0.8320 0.7754 0.5516 0.0344 -0.0787 -0.0953 308 HOH A O 6644 O O . HOH P . ? 0.5738 0.6721 0.5263 0.0916 0.0213 -0.1452 309 HOH A O 6645 O O . HOH P . ? 0.7339 0.6683 0.5315 0.0309 -0.0231 -0.1912 310 HOH A O 6646 O O . HOH P . ? 0.6226 0.6112 0.5367 -0.0283 -0.0074 -0.1316 311 HOH A O 6647 O O . HOH P . ? 0.9270 0.6533 0.5515 0.4347 -0.0685 -0.2337 312 HOH A O 6648 O O . HOH P . ? 0.6506 0.5343 0.5001 -0.0890 -0.0701 -0.1540 313 HOH A O 6649 O O . HOH P . ? 0.6441 0.9795 0.7376 0.1288 0.0745 -0.0960 316 HOH A O 6650 O O . HOH P . ? 0.6295 0.3798 0.4226 0.0565 -0.1251 -0.2089 317 HOH A O 6651 O O . HOH P . ? 0.5556 0.4437 0.3672 0.0228 -0.0147 0.0538 318 HOH A O 6652 O O . HOH P . ? 0.6604 0.6162 0.4990 0.1209 -0.1565 -0.2114 319 HOH A O 6653 O O . HOH P . ? 0.4666 0.8708 0.7588 -0.0975 0.0476 -0.0845 320 HOH A O 6654 O O . HOH P . ? 0.4907 0.4337 0.8037 0.2575 -0.0961 -0.0787 321 HOH A O 6655 O O . HOH P . ? 0.6086 0.6308 0.8645 0.2163 -0.1222 0.0057 322 HOH A O 6656 O O . HOH P . ? 0.5899 0.7603 0.4835 0.0995 0.0173 0.0232 323 HOH A O 6657 O O . HOH P . ? 0.7259 0.5185 0.5816 -0.0412 -0.0132 0.0877 324 HOH A O 6658 O O . HOH P . ? 0.7005 0.7777 0.6101 0.0430 -0.0115 0.0736 325 HOH A O 6659 O O . HOH Q . ? 0.5463 0.5211 0.5596 -0.0651 0.0613 -0.0387 101 HOH B O 6660 O O . HOH Q . ? 0.4958 0.5012 0.4503 0.0234 0.0087 -0.0672 102 HOH B O 6661 O O . HOH Q . ? 0.9338 0.6769 0.7363 0.1932 0.0475 -0.0159 103 HOH B O 6662 O O . HOH Q . ? 0.5055 0.4081 0.4418 0.0133 0.0267 -0.0999 104 HOH B O 6663 O O . HOH Q . ? 0.5472 0.7191 0.5260 -0.0989 0.0871 -0.0545 105 HOH B O 6664 O O . HOH Q . ? 0.7065 0.6313 0.4742 -0.1207 0.0828 0.0779 106 HOH B O 6665 O O . HOH Q . ? 0.7277 0.7011 0.6087 0.1247 0.0076 0.0444 107 HOH B O 6666 O O . HOH Q . ? 0.9231 0.5931 0.7057 -0.1801 0.0453 -0.0091 108 HOH B O 6667 O O . HOH Q . ? 1.2767 0.8614 1.0045 -0.3072 0.0112 -0.0675 109 HOH B O 6668 O O . HOH Q . ? 0.7214 0.7143 0.6259 0.0682 0.0030 0.0132 110 HOH B O 6669 O O . HOH R . ? 0.7612 0.9504 0.3096 0.0488 -0.0455 -0.0730 211 HOH C O 6670 O O . HOH R . ? 0.6266 0.5179 0.7275 0.2888 -0.0806 -0.1164 212 HOH C O 6671 O O . HOH R . ? 0.7377 0.5267 0.4370 -0.0102 0.1064 0.0813 213 HOH C O 6672 O O . HOH R . ? 0.5419 0.6537 0.4287 0.0886 -0.0565 -0.0501 214 HOH C O 6673 O O . HOH R . ? 0.4735 0.6487 0.5274 0.0188 0.0324 -0.1583 215 HOH C O 6674 O O . HOH R . ? 0.6569 0.6816 0.6249 -0.1294 0.0589 -0.1107 216 HOH C O 6675 O O . HOH R . ? 0.7137 0.4485 0.5839 -0.0294 0.0973 -0.0167 217 HOH C O 6676 O O . HOH R . ? 0.4934 0.8223 0.6960 -0.3722 0.1447 -0.2809 218 HOH C O 6677 O O . HOH R . ? 0.5201 0.7005 0.5992 -0.1233 0.0299 -0.2143 219 HOH C O 6678 O O . HOH R . ? 0.4122 0.9375 0.6871 -0.1770 0.0733 -0.2216 220 HOH C O 6679 O O . HOH R . ? 0.6697 0.6411 0.6884 -0.1309 0.1349 -0.1298 221 HOH C O 6680 O O . HOH R . ? 0.8621 0.3647 0.6144 -0.1288 0.2430 0.1176 222 HOH C O 6681 O O . HOH R . ? 0.4766 0.7870 0.5517 0.0804 -0.1215 -0.2067 223 HOH C O 6682 O O . HOH R . ? 0.5727 0.8424 0.5325 0.2284 -0.1316 -0.0380 224 HOH C O 6683 O O . HOH R . ? 0.8473 0.7383 0.8167 -0.1718 0.0092 -0.2443 225 HOH C O 6684 O O . HOH R . ? 0.6349 0.7285 0.2736 0.0211 0.0307 -0.0859 226 HOH C O 6685 O O . HOH R . ? 0.5800 0.8938 0.6110 0.1728 -0.1840 -0.2204 227 HOH C O 6686 O O . HOH R . ? 0.5023 1.0001 0.7315 0.0569 -0.1093 -0.2721 228 HOH C O 6687 O O . HOH R . ? 0.7211 0.4780 0.6177 -0.1747 0.0134 -0.1898 229 HOH C O 6688 O O . HOH R . ? 0.5209 0.7560 0.6264 0.1825 -0.0709 -0.2290 230 HOH C O 6689 O O . HOH R . ? 0.4074 0.6124 0.4196 -0.0768 0.0661 -0.1446 231 HOH C O 6690 O O . HOH R . ? 0.6397 1.0228 0.9289 0.4299 -0.2471 -0.1442 232 HOH C O 6691 O O . HOH R . ? 1.1458 1.1694 0.6366 0.2945 -0.1596 0.2266 233 HOH C O 6692 O O . HOH R . ? 0.7189 0.3657 0.6149 -0.0747 0.1440 -0.0227 234 HOH C O 6693 O O . HOH S . ? 0.8061 0.6917 0.7825 -0.2544 0.1111 -0.1345 248 HOH D O 6694 O O . HOH S . ? 0.5556 0.5257 0.4190 0.1402 0.0129 -0.0300 249 HOH D O 6695 O O . HOH S . ? 0.8564 0.3636 0.7158 -0.0130 -0.0317 -0.0498 250 HOH D O 6696 O O . HOH S . ? 0.4790 0.6879 0.5621 -0.0186 0.0201 -0.1588 251 HOH D O 6697 O O . HOH S . ? 0.7505 0.6878 1.1006 -0.2347 -0.2788 0.0024 252 HOH D O 6698 O O . HOH S . ? 0.6701 0.8291 0.4876 0.2087 0.0540 -0.1375 253 HOH D O 6699 O O . HOH S . ? 0.5041 0.7132 0.4923 0.1256 -0.0687 -0.1679 254 HOH D O 6700 O O . HOH S . ? 0.4889 0.5696 0.5863 0.0140 0.0344 -0.1603 255 HOH D O 6701 O O . HOH S . ? 0.5735 0.5193 0.6413 -0.0220 -0.0735 -0.2104 256 HOH D O 6702 O O . HOH S . ? 0.5052 0.6513 0.6027 -0.2476 -0.0114 -0.2485 257 HOH D O 6703 O O . HOH S . ? 0.8085 0.7475 0.6282 0.0665 -0.0516 -0.0139 258 HOH D O 6704 O O . HOH S . ? 0.6299 0.5131 0.4202 -0.2132 -0.0860 -0.1319 259 HOH D O 6705 O O . HOH S . ? 0.6363 0.8863 0.6093 0.1369 -0.0847 -0.1515 260 HOH D O 6706 O O . HOH S . ? 0.8255 0.4666 1.0901 -0.0226 -0.4581 -0.2494 261 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 6 LYS LYS A . n A 1 7 ASN 7 7 7 ASN ASN A . n A 1 8 TYR 8 8 8 TYR TYR A . n A 1 9 THR 9 9 9 THR THR A . n A 1 10 PHE 10 10 10 PHE PHE A . n A 1 11 ARG 11 11 11 ARG ARG A . n A 1 12 CYS 12 12 12 CYS CYS A . n A 1 13 LEU 13 13 13 LEU LEU A . n A 1 14 GLN 14 14 14 GLN GLN A . n A 1 15 MET 15 15 15 MET MET A . n A 1 16 SER 16 16 16 SER SER A . n A 1 17 SER 17 17 17 SER SER A . n A 1 18 PHE 18 18 18 PHE PHE A . n A 1 19 ALA 19 19 19 ALA ALA A . n A 1 20 ASN 20 20 20 ASN ASN A . n A 1 21 ARG 21 21 21 ARG ARG A . n A 1 22 SER 22 22 22 SER SER A . n A 1 23 TRP 23 23 23 TRP TRP A . n A 1 24 SER 24 24 24 SER SER A . n A 1 25 ARG 25 25 25 ARG ARG A . n A 1 26 THR 26 26 26 THR THR A . n A 1 27 ASP 27 27 27 ASP ASP A . n A 1 28 SER 28 28 28 SER SER A . n A 1 29 VAL 29 29 29 VAL VAL A . n A 1 30 VAL 30 30 30 VAL VAL A . n A 1 31 TRP 31 31 31 TRP TRP A . n A 1 32 LEU 32 32 32 LEU LEU A . n A 1 33 GLY 33 33 33 GLY GLY A . n A 1 34 ASP 34 34 34 ASP ASP A . n A 1 35 LEU 35 35 35 LEU LEU A . n A 1 36 GLN 36 36 36 GLN GLN A . n A 1 37 THR 37 37 37 THR THR A . n A 1 38 HIS 38 38 38 HIS HIS A . n A 1 39 ARG 39 39 39 ARG ARG A . n A 1 40 TRP 40 40 40 TRP TRP A . n A 1 41 SER 41 41 41 SER SER A . n A 1 42 ASN 42 42 42 ASN ASN A . n A 1 43 ASP 43 43 43 ASP ASP A . n A 1 44 SER 44 44 44 SER SER A . n A 1 45 ALA 45 45 45 ALA ALA A . n A 1 46 THR 46 46 46 THR THR A . n A 1 47 ILE 47 47 47 ILE ILE A . n A 1 48 SER 48 48 48 SER SER A . n A 1 49 PHE 49 49 49 PHE PHE A . n A 1 50 THR 50 50 50 THR THR A . n A 1 51 LYS 51 51 51 LYS LYS A . n A 1 52 PRO 52 52 52 PRO PRO A . n A 1 53 TRP 53 53 53 TRP TRP A . n A 1 54 SER 54 54 54 SER SER A . n A 1 55 GLN 55 55 55 GLN GLN A . n A 1 56 GLY 56 56 56 GLY GLY A . n A 1 57 LYS 57 57 57 LYS LYS A . n A 1 58 LEU 58 58 58 LEU LEU A . n A 1 59 SER 59 59 59 SER SER A . n A 1 60 ASN 60 60 60 ASN ASN A . n A 1 61 GLN 61 61 61 GLN GLN A . n A 1 62 GLN 62 62 62 GLN GLN A . n A 1 63 TRP 63 63 63 TRP TRP A . n A 1 64 GLU 64 64 64 GLU GLU A . n A 1 65 LYS 65 65 65 LYS LYS A . n A 1 66 LEU 66 66 66 LEU LEU A . n A 1 67 GLN 67 67 67 GLN GLN A . n A 1 68 HIS 68 68 68 HIS HIS A . n A 1 69 MET 69 69 69 MET MET A . n A 1 70 PHE 70 70 70 PHE PHE A . n A 1 71 GLN 71 71 71 GLN GLN A . n A 1 72 VAL 72 72 72 VAL VAL A . n A 1 73 TYR 73 73 73 TYR TYR A . n A 1 74 ARG 74 74 74 ARG ARG A . n A 1 75 VAL 75 75 75 VAL VAL A . n A 1 76 SER 76 76 76 SER SER A . n A 1 77 PHE 77 77 77 PHE PHE A . n A 1 78 THR 78 78 78 THR THR A . n A 1 79 ARG 79 79 79 ARG ARG A . n A 1 80 ASP 80 80 80 ASP ASP A . n A 1 81 ILE 81 81 81 ILE ILE A . n A 1 82 GLN 82 82 82 GLN GLN A . n A 1 83 GLU 83 83 83 GLU GLU A . n A 1 84 LEU 84 84 84 LEU LEU A . n A 1 85 VAL 85 85 85 VAL VAL A . n A 1 86 LYS 86 86 86 LYS LYS A . n A 1 87 MET 87 87 87 MET MET A . n A 1 88 MET 88 88 88 MET MET A . n A 1 89 SER 89 89 89 SER SER A . n A 1 90 PRO 90 90 90 PRO PRO A . n A 1 91 LYS 91 91 ? ? ? A . n A 1 92 GLU 92 92 ? ? ? A . n A 1 93 ASP 93 93 93 ASP ASP A . n A 1 94 TYR 94 94 94 TYR TYR A . n A 1 95 PRO 95 95 95 PRO PRO A . n A 1 96 ILE 96 96 96 ILE ILE A . n A 1 97 GLU 97 97 97 GLU GLU A . n A 1 98 ILE 98 98 98 ILE ILE A . n A 1 99 GLN 99 99 99 GLN GLN A . n A 1 100 LEU 100 100 100 LEU LEU A . n A 1 101 SER 101 101 101 SER SER A . n A 1 102 ALA 102 102 102 ALA ALA A . n A 1 103 GLY 103 103 103 GLY GLY A . n A 1 104 CYS 104 104 104 CYS CYS A . n A 1 105 GLU 105 105 105 GLU GLU A . n A 1 106 MET 106 106 106 MET MET A . n A 1 107 TYR 107 107 107 TYR TYR A . n A 1 108 PRO 108 108 108 PRO PRO A . n A 1 109 GLY 109 109 109 GLY GLY A . n A 1 110 ASN 110 110 110 ASN ASN A . n A 1 111 ALA 111 111 111 ALA ALA A . n A 1 112 SER 112 112 112 SER SER A . n A 1 113 GLU 113 113 113 GLU GLU A . n A 1 114 SER 114 114 114 SER SER A . n A 1 115 PHE 115 115 115 PHE PHE A . n A 1 116 LEU 116 116 116 LEU LEU A . n A 1 117 HIS 117 117 117 HIS HIS A . n A 1 118 VAL 118 118 118 VAL VAL A . n A 1 119 ALA 119 119 119 ALA ALA A . n A 1 120 PHE 120 120 120 PHE PHE A . n A 1 121 GLN 121 121 121 GLN GLN A . n A 1 122 GLY 122 122 122 GLY GLY A . n A 1 123 LYS 123 123 123 LYS LYS A . n A 1 124 TYR 124 124 124 TYR TYR A . n A 1 125 VAL 125 125 125 VAL VAL A . n A 1 126 VAL 126 126 126 VAL VAL A . n A 1 127 ARG 127 127 127 ARG ARG A . n A 1 128 PHE 128 128 128 PHE PHE A . n A 1 129 TRP 129 129 129 TRP TRP A . n A 1 130 GLY 130 130 130 GLY GLY A . n A 1 131 THR 131 131 131 THR THR A . n A 1 132 SER 132 132 132 SER SER A . n A 1 133 TRP 133 133 133 TRP TRP A . n A 1 134 GLN 134 134 134 GLN GLN A . n A 1 135 THR 135 135 135 THR THR A . n A 1 136 VAL 136 136 136 VAL VAL A . n A 1 137 PRO 137 137 137 PRO PRO A . n A 1 138 GLY 138 138 138 GLY GLY A . n A 1 139 ALA 139 139 139 ALA ALA A . n A 1 140 PRO 140 140 140 PRO PRO A . n A 1 141 SER 141 141 141 SER SER A . n A 1 142 TRP 142 142 142 TRP TRP A . n A 1 143 LEU 143 143 143 LEU LEU A . n A 1 144 ASP 144 144 144 ASP ASP A . n A 1 145 LEU 145 145 145 LEU LEU A . n A 1 146 PRO 146 146 146 PRO PRO A . n A 1 147 ILE 147 147 147 ILE ILE A . n A 1 148 LYS 148 148 148 LYS LYS A . n A 1 149 VAL 149 149 149 VAL VAL A . n A 1 150 LEU 150 150 150 LEU LEU A . n A 1 151 ASN 151 151 151 ASN ASN A . n A 1 152 ALA 152 152 152 ALA ALA A . n A 1 153 ASP 153 153 153 ASP ASP A . n A 1 154 GLN 154 154 154 GLN GLN A . n A 1 155 GLY 155 155 155 GLY GLY A . n A 1 156 THR 156 156 156 THR THR A . n A 1 157 SER 157 157 157 SER SER A . n A 1 158 ALA 158 158 158 ALA ALA A . n A 1 159 THR 159 159 159 THR THR A . n A 1 160 VAL 160 160 160 VAL VAL A . n A 1 161 GLN 161 161 161 GLN GLN A . n A 1 162 MET 162 162 162 MET MET A . n A 1 163 LEU 163 163 163 LEU LEU A . n A 1 164 LEU 164 164 164 LEU LEU A . n A 1 165 ASN 165 165 165 ASN ASN A . n A 1 166 ASP 166 166 166 ASP ASP A . n A 1 167 THR 167 167 167 THR THR A . n A 1 168 CYS 168 168 168 CYS CYS A . n A 1 169 PRO 169 169 169 PRO PRO A . n A 1 170 LEU 170 170 170 LEU LEU A . n A 1 171 PHE 171 171 171 PHE PHE A . n A 1 172 VAL 172 172 172 VAL VAL A . n A 1 173 ARG 173 173 173 ARG ARG A . n A 1 174 GLY 174 174 174 GLY GLY A . n A 1 175 LEU 175 175 175 LEU LEU A . n A 1 176 LEU 176 176 176 LEU LEU A . n A 1 177 GLU 177 177 177 GLU GLU A . n A 1 178 ALA 178 178 178 ALA ALA A . n A 1 179 GLY 179 179 179 GLY GLY A . n A 1 180 LYS 180 180 180 LYS LYS A . n A 1 181 SER 181 181 181 SER SER A . n A 1 182 ASP 182 182 182 ASP ASP A . n A 1 183 LEU 183 183 183 LEU LEU A . n A 1 184 GLU 184 184 184 GLU GLU A . n A 1 185 LYS 185 185 185 LYS LYS A . n A 1 186 GLN 186 186 186 GLN GLN A . n A 1 187 GLU 187 187 187 GLU GLU A . n A 1 188 LYS 188 188 188 LYS LYS A . n A 1 189 PRO 189 189 189 PRO PRO A . n A 1 190 VAL 190 190 190 VAL VAL A . n A 1 191 ALA 191 191 191 ALA ALA A . n A 1 192 TRP 192 192 192 TRP TRP A . n A 1 193 LEU 193 193 193 LEU LEU A . n A 1 194 SER 194 194 194 SER SER A . n A 1 195 SER 195 195 195 SER SER A . n A 1 196 VAL 196 196 196 VAL VAL A . n A 1 197 PRO 197 197 197 PRO PRO A . n A 1 198 SER 198 198 198 SER SER A . n A 1 199 SER 199 199 199 SER SER A . n A 1 200 ALA 200 200 200 ALA ALA A . n A 1 201 HIS 201 201 201 HIS HIS A . n A 1 202 GLY 202 202 202 GLY GLY A . n A 1 203 HIS 203 203 203 HIS HIS A . n A 1 204 ARG 204 204 204 ARG ARG A . n A 1 205 GLN 205 205 205 GLN GLN A . n A 1 206 LEU 206 206 206 LEU LEU A . n A 1 207 VAL 207 207 207 VAL VAL A . n A 1 208 CYS 208 208 208 CYS CYS A . n A 1 209 HIS 209 209 209 HIS HIS A . n A 1 210 VAL 210 210 210 VAL VAL A . n A 1 211 SER 211 211 211 SER SER A . n A 1 212 GLY 212 212 212 GLY GLY A . n A 1 213 PHE 213 213 213 PHE PHE A . n A 1 214 TYR 214 214 214 TYR TYR A . n A 1 215 PRO 215 215 215 PRO PRO A . n A 1 216 LYS 216 216 216 LYS LYS A . n A 1 217 PRO 217 217 217 PRO PRO A . n A 1 218 VAL 218 218 218 VAL VAL A . n A 1 219 TRP 219 219 219 TRP TRP A . n A 1 220 VAL 220 220 220 VAL VAL A . n A 1 221 MET 221 221 221 MET MET A . n A 1 222 TRP 222 222 222 TRP TRP A . n A 1 223 MET 223 223 223 MET MET A . n A 1 224 ARG 224 224 224 ARG ARG A . n A 1 225 GLY 225 225 225 GLY GLY A . n A 1 226 ASP 226 226 226 ASP ASP A . n A 1 227 GLN 227 227 227 GLN GLN A . n A 1 228 GLU 228 228 228 GLU GLU A . n A 1 229 GLN 229 229 229 GLN GLN A . n A 1 230 GLN 230 230 230 GLN GLN A . n A 1 231 GLY 231 231 231 GLY GLY A . n A 1 232 THR 232 232 232 THR THR A . n A 1 233 HIS 233 233 233 HIS HIS A . n A 1 234 ARG 234 234 234 ARG ARG A . n A 1 235 GLY 235 235 235 GLY GLY A . n A 1 236 ASP 236 236 236 ASP ASP A . n A 1 237 PHE 237 237 237 PHE PHE A . n A 1 238 LEU 238 238 238 LEU LEU A . n A 1 239 PRO 239 239 239 PRO PRO A . n A 1 240 ASN 240 240 240 ASN ASN A . n A 1 241 ALA 241 241 241 ALA ALA A . n A 1 242 ASP 242 242 242 ASP ASP A . n A 1 243 GLU 243 243 243 GLU GLU A . n A 1 244 THR 244 244 244 THR THR A . n A 1 245 TRP 245 245 245 TRP TRP A . n A 1 246 TYR 246 246 246 TYR TYR A . n A 1 247 LEU 247 247 247 LEU LEU A . n A 1 248 GLN 248 248 248 GLN GLN A . n A 1 249 ALA 249 249 249 ALA ALA A . n A 1 250 THR 250 250 250 THR THR A . n A 1 251 LEU 251 251 251 LEU LEU A . n A 1 252 ASP 252 252 252 ASP ASP A . n A 1 253 VAL 253 253 253 VAL VAL A . n A 1 254 GLU 254 254 254 GLU GLU A . n A 1 255 ALA 255 255 255 ALA ALA A . n A 1 256 GLY 256 256 256 GLY GLY A . n A 1 257 GLU 257 257 257 GLU GLU A . n A 1 258 GLU 258 258 258 GLU GLU A . n A 1 259 ALA 259 259 259 ALA ALA A . n A 1 260 GLY 260 260 260 GLY GLY A . n A 1 261 LEU 261 261 261 LEU LEU A . n A 1 262 ALA 262 262 262 ALA ALA A . n A 1 263 CYS 263 263 263 CYS CYS A . n A 1 264 ARG 264 264 264 ARG ARG A . n A 1 265 VAL 265 265 265 VAL VAL A . n A 1 266 LYS 266 266 266 LYS LYS A . n A 1 267 HIS 267 267 267 HIS HIS A . n A 1 268 SER 268 268 268 SER SER A . n A 1 269 SER 269 269 269 SER SER A . n A 1 270 LEU 270 270 270 LEU LEU A . n A 1 271 GLY 271 271 271 GLY GLY A . n A 1 272 GLY 272 272 272 GLY GLY A . n A 1 273 GLN 273 273 273 GLN GLN A . n A 1 274 ASP 274 274 274 ASP ASP A . n A 1 275 ILE 275 275 275 ILE ILE A . n A 1 276 ILE 276 276 276 ILE ILE A . n A 1 277 LEU 277 277 277 LEU LEU A . n A 1 278 TYR 278 278 278 TYR TYR A . n A 1 279 TRP 279 279 279 TRP TRP A . n A 1 280 GLY 280 280 280 GLY GLY A . n A 1 281 SER 281 281 281 SER SER A . n A 1 282 LEU 282 282 282 LEU LEU A . n A 1 283 HIS 283 283 283 HIS HIS A . n A 1 284 HIS 284 284 284 HIS HIS A . n A 1 285 ILE 285 285 285 ILE ILE A . n A 1 286 LEU 286 286 286 LEU LEU A . n A 1 287 ASP 287 287 287 ASP ASP A . n A 1 288 ALA 288 288 288 ALA ALA A . n A 1 289 GLN 289 289 289 GLN GLN A . n A 1 290 LYS 290 290 290 LYS LYS A . n A 1 291 MET 291 291 291 MET MET A . n A 1 292 VAL 292 292 292 VAL VAL A . n A 1 293 TRP 293 293 293 TRP TRP A . n A 1 294 ASN 294 294 294 ASN ASN A . n A 1 295 HIS 295 295 295 HIS HIS A . n A 1 296 ARG 296 296 296 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 301 301 301 HIS HIS A . n A 1 302 HIS 302 302 302 HIS HIS 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 99 LEU LEU C . n C 3 99 GLY 99 100 100 GLY GLY C . n C 3 100 ARG 100 103 103 ARG ARG C . n C 3 101 LEU 101 104 104 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 ? ? ? 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 244 247 247 ASP ASP D . n # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 165 A ASN 165 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 20 A ASN 20 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 110 A ASN 110 ? ASN 'GLYCOSYLATION SITE' 4 A ASN 42 A ASN 42 ? ASN 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details tetrameric _pdbx_struct_assembly.oligomeric_count 4 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S # _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[2][2] _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] 'X-RAY DIFFRACTION' 1 ? refined -14.5596 -46.9353 -73.6817 0.1531 0.2243 0.1371 0.0253 -0.0153 -0.1678 1.6819 3.6422 4.7622 -0.8857 0.7875 -0.6031 0.0623 -0.0852 0.0229 -0.0959 -0.0550 0.1786 0.0138 -0.2106 -0.1930 'X-RAY DIFFRACTION' 2 ? refined -6.5319 -46.3973 -101.2829 0.1956 0.1319 0.1654 -0.0116 0.0379 -0.1156 2.7043 0.8642 7.1314 0.0446 0.0404 -1.1250 -0.0655 0.0215 0.0441 -0.0508 0.1596 -0.1872 -0.1099 -0.2684 0.5077 'X-RAY DIFFRACTION' 3 ? refined -3.4905 -36.8028 -42.3551 0.0659 0.1999 0.1136 -0.0139 0.0323 -0.1086 3.9722 3.5546 7.5196 -0.0891 1.2933 3.0299 -0.0473 -0.0735 0.1208 -0.3273 0.1094 0.2110 0.0815 -0.1345 -0.4302 'X-RAY DIFFRACTION' 4 ? refined 13.4786 -51.3655 -49.2875 0.1573 0.2352 0.2248 0.0764 -0.0582 -0.1438 7.7669 4.1833 6.2799 0.7122 3.5980 1.6325 0.5613 0.0948 -0.6561 -0.0511 -0.7763 -0.1080 0.0782 0.6776 0.3826 'X-RAY DIFFRACTION' 5 ? refined 18.7279 -28.1641 -16.0719 0.2062 0.1538 0.0330 0.0453 -0.0071 -0.0281 6.1283 3.8407 5.3455 0.1380 -1.0155 1.9589 0.0827 0.0874 -0.1701 0.2968 0.2755 -0.1806 -0.3114 -0.3172 0.0099 'X-RAY DIFFRACTION' 6 ? refined 24.1334 -43.6285 -21.2032 0.1134 0.1426 0.2305 0.0426 -0.1133 -0.0946 3.2761 2.7733 8.0375 -0.7703 -3.1619 1.6186 0.1331 -0.0944 -0.0387 0.2443 -0.4042 -0.3393 0.0376 0.3270 0.2444 'X-RAY DIFFRACTION' 7 ? refined -23.5351 -50.5864 -111.6502 0.1958 0.1395 0.0713 0.0242 -0.0500 0.0538 3.1934 2.8046 2.4771 -0.0025 -0.1335 0.6501 -0.1761 0.2259 -0.0498 -0.0574 0.3229 0.0923 -0.2872 -0.0827 -0.1257 # 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.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection_details _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection 'X-RAY DIFFRACTION' 1 1 A 6 A 90 ? . . . . ? 'X-RAY DIFFRACTION' 2 1 A 601 A 611 ? . . . . ? 'X-RAY DIFFRACTION' 3 1 A 314 A 315 ? . . . . ? 'X-RAY DIFFRACTION' 4 1 A 400 A 401 ? . . . . ? 'X-RAY DIFFRACTION' 5 1 A 501 A 502 ? . . . . ? 'X-RAY DIFFRACTION' 6 1 A 94 A 183 ? . . . . ? 'X-RAY DIFFRACTION' 7 1 A 551 A 551 ? . . . . ? 'X-RAY DIFFRACTION' 8 2 B 2 B 99 ? . . . . ? 'X-RAY DIFFRACTION' 9 3 C 1 C 112 ? . . . . ? 'X-RAY DIFFRACTION' 10 4 D 3 D 96 ? . . . . ? 'X-RAY DIFFRACTION' 11 4 D 103 D 116 ? . . . . ? 'X-RAY DIFFRACTION' 12 5 C 113 C 181 ? . . . . ? 'X-RAY DIFFRACTION' 13 5 C 183 C 204 ? . . . . ? 'X-RAY DIFFRACTION' 14 6 D 117 D 244 ? . . . . ? 'X-RAY DIFFRACTION' 15 7 A 184 A 302 ? . . . . ? # 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 3ARB _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 ? ? -158.72 -158.94 2 1 HIS A 298 ? ? -47.90 151.70 3 1 HIS B 31 ? ? -172.98 131.26 4 1 SER C 146 ? ? -64.63 2.83 5 1 ASP C 201 ? ? -97.79 32.85 6 1 HIS D 41 ? ? -131.16 -64.43 # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 1 A LYS 6 ? CE ? A LYS 6 CE 2 1 Y 1 A LYS 6 ? NZ ? A LYS 6 NZ 3 1 Y 1 A SER 24 ? OG ? A SER 24 OG 4 1 Y 1 A LYS 57 ? CE ? A LYS 57 CE 5 1 Y 1 A LYS 57 ? NZ ? A LYS 57 NZ 6 1 Y 1 A GLN 61 ? CG ? A GLN 61 CG 7 1 Y 1 A GLN 61 ? CD ? A GLN 61 CD 8 1 Y 1 A GLN 61 ? OE1 ? A GLN 61 OE1 9 1 Y 1 A GLN 61 ? NE2 ? A GLN 61 NE2 10 1 Y 1 A LYS 65 ? CG ? A LYS 65 CG 11 1 Y 1 A LYS 65 ? CD ? A LYS 65 CD 12 1 Y 1 A LYS 65 ? CE ? A LYS 65 CE 13 1 Y 1 A LYS 65 ? NZ ? A LYS 65 NZ 14 1 Y 1 A SER 89 ? OG ? A SER 89 OG 15 1 Y 1 A ASP 93 ? CG ? A ASP 93 CG 16 1 Y 1 A ASP 93 ? OD1 ? A ASP 93 OD1 17 1 Y 1 A ASP 93 ? OD2 ? A ASP 93 OD2 18 1 Y 1 A GLU 105 ? CG ? A GLU 105 CG 19 1 Y 1 A GLU 105 ? CD ? A GLU 105 CD 20 1 Y 1 A GLU 105 ? OE1 ? A GLU 105 OE1 21 1 Y 1 A GLU 105 ? OE2 ? A GLU 105 OE2 22 1 Y 1 A GLU 113 ? CD ? A GLU 113 CD 23 1 Y 1 A GLU 113 ? OE1 ? A GLU 113 OE1 24 1 Y 1 A GLU 113 ? OE2 ? A GLU 113 OE2 25 1 Y 1 A LYS 148 ? CE ? A LYS 148 CE 26 1 Y 1 A LYS 148 ? NZ ? A LYS 148 NZ 27 1 Y 1 A ARG 173 ? CZ ? A ARG 173 CZ 28 1 Y 1 A ARG 173 ? NH1 ? A ARG 173 NH1 29 1 Y 1 A ARG 173 ? NH2 ? A ARG 173 NH2 30 1 Y 1 A LYS 180 ? CE ? A LYS 180 CE 31 1 Y 1 A LYS 180 ? NZ ? A LYS 180 NZ 32 1 Y 1 A LYS 185 ? NZ ? A LYS 185 NZ 33 1 Y 1 A GLU 257 ? CG ? A GLU 257 CG 34 1 Y 1 A GLU 257 ? CD ? A GLU 257 CD 35 1 Y 1 A GLU 257 ? OE1 ? A GLU 257 OE1 36 1 Y 1 A GLU 257 ? OE2 ? A GLU 257 OE2 37 1 Y 1 A LEU 282 ? CG ? A LEU 282 CG 38 1 Y 1 A LEU 282 ? CD1 ? A LEU 282 CD1 39 1 Y 1 A LEU 282 ? CD2 ? A LEU 282 CD2 40 1 Y 1 A ASP 287 ? CG ? A ASP 287 CG 41 1 Y 1 A ASP 287 ? OD1 ? A ASP 287 OD1 42 1 Y 1 A ASP 287 ? OD2 ? A ASP 287 OD2 43 1 Y 1 A LYS 290 ? NZ ? A LYS 290 NZ 44 1 Y 1 A HIS 300 ? CG ? A HIS 300 CG 45 1 Y 1 A HIS 300 ? ND1 ? A HIS 300 ND1 46 1 Y 1 A HIS 300 ? CD2 ? A HIS 300 CD2 47 1 Y 1 A HIS 300 ? CE1 ? A HIS 300 CE1 48 1 Y 1 A HIS 300 ? NE2 ? A HIS 300 NE2 49 1 Y 1 A HIS 302 ? CG ? A HIS 302 CG 50 1 Y 1 A HIS 302 ? ND1 ? A HIS 302 ND1 51 1 Y 1 A HIS 302 ? CD2 ? A HIS 302 CD2 52 1 Y 1 A HIS 302 ? CE1 ? A HIS 302 CE1 53 1 Y 1 A HIS 302 ? NE2 ? A HIS 302 NE2 54 1 Y 1 B LYS 19 ? CG ? B LYS 19 CG 55 1 Y 1 B LYS 19 ? CD ? B LYS 19 CD 56 1 Y 1 B LYS 19 ? CE ? B LYS 19 CE 57 1 Y 1 B LYS 19 ? NZ ? B LYS 19 NZ 58 1 Y 1 B GLU 36 ? CG ? B GLU 36 CG 59 1 Y 1 B GLU 36 ? CD ? B GLU 36 CD 60 1 Y 1 B GLU 36 ? OE1 ? B GLU 36 OE1 61 1 Y 1 B GLU 36 ? OE2 ? B GLU 36 OE2 62 1 Y 1 B LYS 44 ? CD ? B LYS 44 CD 63 1 Y 1 B LYS 44 ? CE ? B LYS 44 CE 64 1 Y 1 B LYS 44 ? NZ ? B LYS 44 NZ 65 1 Y 1 B LYS 45 ? CD ? B LYS 45 CD 66 1 Y 1 B LYS 45 ? CE ? B LYS 45 CE 67 1 Y 1 B LYS 45 ? NZ ? B LYS 45 NZ 68 1 Y 1 B LYS 48 ? CG ? B LYS 48 CG 69 1 Y 1 B LYS 48 ? CD ? B LYS 48 CD 70 1 Y 1 B LYS 48 ? CE ? B LYS 48 CE 71 1 Y 1 B LYS 48 ? NZ ? B LYS 48 NZ 72 1 Y 1 B GLU 50 ? CG ? B GLU 50 CG 73 1 Y 1 B GLU 50 ? CD ? B GLU 50 CD 74 1 Y 1 B GLU 50 ? OE1 ? B GLU 50 OE1 75 1 Y 1 B GLU 50 ? OE2 ? B GLU 50 OE2 76 1 Y 1 B LYS 58 ? CD ? B LYS 58 CD 77 1 Y 1 B LYS 58 ? CE ? B LYS 58 CE 78 1 Y 1 B LYS 58 ? NZ ? B LYS 58 NZ 79 1 Y 1 B LYS 83 ? CD ? B LYS 83 CD 80 1 Y 1 B LYS 83 ? CE ? B LYS 83 CE 81 1 Y 1 B LYS 83 ? NZ ? B LYS 83 NZ 82 1 Y 1 B GLU 89 ? CD ? B GLU 89 CD 83 1 Y 1 B GLU 89 ? OE1 ? B GLU 89 OE1 84 1 Y 1 B GLU 89 ? OE2 ? B GLU 89 OE2 85 1 Y 1 B MET 99 ? CE ? B MET 99 CE 86 1 Y 1 C ARG 13 ? NE ? C ARG 13 NE 87 1 Y 1 C ARG 13 ? CZ ? C ARG 13 CZ 88 1 Y 1 C ARG 13 ? NH1 ? C ARG 13 NH1 89 1 Y 1 C ARG 13 ? NH2 ? C ARG 13 NH2 90 1 Y 1 C LYS 41 ? CG ? C LYS 41 CG 91 1 Y 1 C LYS 41 ? CD ? C LYS 41 CD 92 1 Y 1 C LYS 41 ? CE ? C LYS 41 CE 93 1 Y 1 C LYS 41 ? NZ ? C LYS 41 NZ 94 1 Y 1 C LYS 53 ? NZ ? C LYS 53 NZ 95 1 Y 1 C LYS 55 ? CD ? C LYS 55 CD 96 1 Y 1 C LYS 55 ? CE ? C LYS 55 CE 97 1 Y 1 C LYS 55 ? NZ ? C LYS 55 NZ 98 1 Y 1 C LYS 132 ? CE ? C LYS 129 CE 99 1 Y 1 C LYS 132 ? NZ ? C LYS 129 NZ 100 1 Y 1 C LYS 136 ? NZ ? C LYS 133 NZ 101 1 Y 1 C LYS 154 ? CD ? C LYS 151 CD 102 1 Y 1 C LYS 154 ? CE ? C LYS 151 CE 103 1 Y 1 C LYS 154 ? NZ ? C LYS 151 NZ 104 1 Y 1 C LYS 184 ? CE ? C LYS 181 CE 105 1 Y 1 C LYS 184 ? NZ ? C LYS 181 NZ 106 1 Y 1 C ILE 198 ? CG2 ? C ILE 195 CG2 107 1 Y 1 C GLU 200 ? CG ? C GLU 197 CG 108 1 Y 1 C GLU 200 ? CD ? C GLU 197 CD 109 1 Y 1 C GLU 200 ? OE1 ? C GLU 197 OE1 110 1 Y 1 C GLU 200 ? OE2 ? C GLU 197 OE2 111 1 Y 1 D SER 22 ? OG ? D SER 22 OG 112 1 Y 1 D LYS 66 ? NZ ? D LYS 65 NZ 113 1 Y 1 D GLU 73 ? CD ? D GLU 72 CD 114 1 Y 1 D GLU 73 ? OE1 ? D GLU 72 OE1 115 1 Y 1 D GLU 73 ? OE2 ? D GLU 72 OE2 116 1 Y 1 D GLU 80 ? CD ? D GLU 79 CD 117 1 Y 1 D GLU 80 ? OE1 ? D GLU 79 OE1 118 1 Y 1 D GLU 80 ? OE2 ? D GLU 79 OE2 119 1 Y 1 D LEU 81 ? CD1 ? D LEU 80 CD1 120 1 Y 1 D LEU 81 ? CD2 ? D LEU 80 CD2 121 1 Y 1 D ASP 96 ? CG ? D ASP 95 CG 122 1 Y 1 D ASP 96 ? OD1 ? D ASP 95 OD1 123 1 Y 1 D ASP 96 ? OD2 ? D ASP 95 OD2 124 1 Y 1 D GLU 118 ? CG ? D GLU 115 CG 125 1 Y 1 D GLU 118 ? CD ? D GLU 115 CD 126 1 Y 1 D GLU 118 ? OE1 ? D GLU 115 OE1 127 1 Y 1 D GLU 118 ? OE2 ? D GLU 115 OE2 128 1 Y 1 D ASP 119 ? OD1 ? D ASP 116 OD1 129 1 Y 1 D ASP 119 ? OD2 ? D ASP 116 OD2 130 1 Y 1 D LYS 121 ? CE ? D LYS 118 CE 131 1 Y 1 D LYS 121 ? NZ ? D LYS 118 NZ 132 1 Y 1 D GLU 135 ? CG ? D GLU 132 CG 133 1 Y 1 D GLU 135 ? CD ? D GLU 132 CD 134 1 Y 1 D GLU 135 ? OE1 ? D GLU 132 OE1 135 1 Y 1 D GLU 135 ? OE2 ? D GLU 132 OE2 136 1 Y 1 D LYS 167 ? CD ? D LYS 164 CD 137 1 Y 1 D LYS 167 ? CE ? D LYS 164 CE 138 1 Y 1 D LYS 167 ? NZ ? D LYS 164 NZ 139 1 Y 1 D LYS 181 ? CE ? D LYS 178 CE 140 1 Y 1 D LYS 181 ? NZ ? D LYS 178 NZ 141 1 Y 1 D ARG 208 ? CD ? D ARG 205 CD 142 1 Y 1 D ARG 208 ? NE ? D ARG 205 NE 143 1 Y 1 D ARG 208 ? CZ ? D ARG 205 CZ 144 1 Y 1 D ARG 208 ? NH1 ? D ARG 205 NH1 145 1 Y 1 D ARG 208 ? NH2 ? D ARG 205 NH2 146 1 Y 1 D GLU 222 ? CG ? D GLU 219 CG 147 1 Y 1 D GLU 222 ? CD ? D GLU 219 CD 148 1 Y 1 D GLU 222 ? OE1 ? D GLU 219 OE1 149 1 Y 1 D GLU 222 ? OE2 ? D GLU 219 OE2 150 1 Y 1 D ASN 223 ? CG ? D ASN 220 CG 151 1 Y 1 D ASN 223 ? OD1 ? D ASN 220 OD1 152 1 Y 1 D ASN 223 ? ND2 ? D ASN 220 ND2 153 1 Y 1 D GLU 225 ? CG ? D GLU 222 CG 154 1 Y 1 D GLU 225 ? CD ? D GLU 222 CD 155 1 Y 1 D GLU 225 ? OE1 ? D GLU 222 OE1 156 1 Y 1 D GLU 225 ? OE2 ? D GLU 222 OE2 157 1 Y 1 D LYS 232 ? CD ? D LYS 229 CD 158 1 Y 1 D LYS 232 ? CE ? D LYS 229 CE 159 1 Y 1 D LYS 232 ? NZ ? D LYS 229 NZ 160 1 N 1 A NAG 401 ? C7 ? E NAG 2 C7 161 1 N 1 A NAG 401 ? C8 ? E NAG 2 C8 162 1 N 1 A NAG 401 ? O7 ? E NAG 2 O7 163 1 N 1 A NAG 315 ? C7 ? F NAG 2 C7 164 1 N 1 A NAG 315 ? C8 ? F NAG 2 C8 165 1 N 1 A NAG 315 ? O3 ? F NAG 2 O3 166 1 N 1 A NAG 315 ? O7 ? F NAG 2 O7 167 1 N 1 A NAG 502 ? C7 ? G NAG 2 C7 168 1 N 1 A NAG 502 ? C8 ? G NAG 2 C8 169 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 91 ? A LYS 91 7 1 Y 1 A GLU 92 ? A GLU 92 8 1 Y 1 B ILE 1 ? B ILE 1 9 1 Y 1 C SER 185 ? C SER 182 10 1 Y 1 C GLU 208 ? C GLU 205 11 1 Y 1 C SER 209 ? C SER 206 12 1 Y 1 C SER 210 ? C SER 207 13 1 Y 1 D GLU 1 ? D GLU 1 14 1 Y 1 D ALA 2 ? D ALA 2 15 1 Y 1 D ALA 97 ? D ALA 96 16 1 Y 1 D GLY 98 ? D GLY 97 17 1 Y 1 D GLY 99 ? D GLY 98 18 1 Y 1 D ASN 100 ? D ASN 99 19 1 Y 1 D TYR 101 ? D TYR 100 20 1 Y 1 D ALA 102 ? D ALA 101 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 5 N-ACETYL-D-GLUCOSAMINE NAG 6 'DI(HYDROXYETHYL)ETHER' PEG 7 'N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]-2,3-dihydroxyoctyl}tetracosanamide' FEE 8 DODECANE D12 9 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 2 315 315 NAG NAG A . I 5 NAG 1 501 501 NAG NAG A . J 5 NAG 2 502 502 NAG NAG A . K 6 PEG 1 303 2 PEG PEG A . L 5 NAG 1 551 551 NAG NAG A . M 7 FEE 1 601 601 FEE FEE A . N 8 D12 1 611 611 D12 D12 A . O 6 PEG 1 100 3 PEG PEG B . P 9 HOH 1 304 5 HOH HOH A . P 9 HOH 2 305 9 HOH HOH A . P 9 HOH 3 306 10 HOH HOH A . P 9 HOH 4 307 11 HOH HOH A . P 9 HOH 5 308 12 HOH HOH A . P 9 HOH 6 309 17 HOH HOH A . P 9 HOH 7 310 24 HOH HOH A . P 9 HOH 8 311 32 HOH HOH A . P 9 HOH 9 312 36 HOH HOH A . P 9 HOH 10 313 39 HOH HOH A . P 9 HOH 11 316 45 HOH HOH A . P 9 HOH 12 317 50 HOH HOH A . P 9 HOH 13 318 61 HOH HOH A . P 9 HOH 14 319 94 HOH HOH A . P 9 HOH 15 320 99 HOH HOH A . P 9 HOH 16 321 101 HOH HOH A . P 9 HOH 17 322 102 HOH HOH A . P 9 HOH 18 323 103 HOH HOH A . P 9 HOH 19 324 107 HOH HOH A . P 9 HOH 20 325 108 HOH HOH A . Q 9 HOH 1 101 23 HOH HOH B . Q 9 HOH 2 102 31 HOH HOH B . Q 9 HOH 3 103 40 HOH HOH B . Q 9 HOH 4 104 49 HOH HOH B . Q 9 HOH 5 105 56 HOH HOH B . Q 9 HOH 6 106 82 HOH HOH B . Q 9 HOH 7 107 88 HOH HOH B . Q 9 HOH 8 108 84 HOH HOH B . Q 9 HOH 9 109 109 HOH HOH B . Q 9 HOH 10 110 97 HOH HOH B . R 9 HOH 1 211 1 HOH HOH C . R 9 HOH 2 212 4 HOH HOH C . R 9 HOH 3 213 8 HOH HOH C . R 9 HOH 4 214 20 HOH HOH C . R 9 HOH 5 215 25 HOH HOH C . R 9 HOH 6 216 33 HOH HOH C . R 9 HOH 7 217 42 HOH HOH C . R 9 HOH 8 218 43 HOH HOH C . R 9 HOH 9 219 46 HOH HOH C . R 9 HOH 10 220 47 HOH HOH C . R 9 HOH 11 221 48 HOH HOH C . R 9 HOH 12 222 63 HOH HOH C . R 9 HOH 13 223 76 HOH HOH C . R 9 HOH 14 224 78 HOH HOH C . R 9 HOH 15 225 81 HOH HOH C . R 9 HOH 16 226 86 HOH HOH C . R 9 HOH 17 227 90 HOH HOH C . R 9 HOH 18 228 91 HOH HOH C . R 9 HOH 19 229 110 HOH HOH C . R 9 HOH 20 230 111 HOH HOH C . R 9 HOH 21 231 113 HOH HOH C . R 9 HOH 22 232 114 HOH HOH C . R 9 HOH 23 233 115 HOH HOH C . R 9 HOH 24 234 117 HOH HOH C . S 9 HOH 1 248 14 HOH HOH D . S 9 HOH 2 249 16 HOH HOH D . S 9 HOH 3 250 18 HOH HOH D . S 9 HOH 4 251 21 HOH HOH D . S 9 HOH 5 252 38 HOH HOH D . S 9 HOH 6 253 44 HOH HOH D . S 9 HOH 7 254 53 HOH HOH D . S 9 HOH 8 255 57 HOH HOH D . S 9 HOH 9 256 62 HOH HOH D . S 9 HOH 10 257 68 HOH HOH D . S 9 HOH 11 258 72 HOH HOH D . S 9 HOH 12 259 75 HOH HOH D . S 9 HOH 13 260 89 HOH HOH D . S 9 HOH 14 261 118 HOH HOH D . #