data_2JLL # _entry.id 2JLL # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 2JLL PDBE EBI-37511 WWPDB D_1290037511 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.content_type _pdbx_database_related.details PDB 2V5T unspecified 'CRYSTAL STRUCTURE OF NCAM2 IG2-3' PDB 2XY2 unspecified 'CRYSTAL STRUCTURE OF NCAM2 IG1-2' PDB 2VAJ unspecified 'CRYSTAL STRUCTURE OF NCAM2 IG1 (I4122 CELL UNIT)' PDB 2DOC unspecified 'SOLUTION STRUCTURE OF THE FIBRONECTIN TYPE-III DOMAIN OFHUMAN NEURAL CELL ADHESION MOLECULE 2' PDB 2XYC unspecified 'CRYSTAL STRUCTURE OF NCAM2 IGIV-FN3I' PDB 2WIM unspecified 'CRYSTAL STRUCTURE OF NCAM2 IG1-3' PDB 2XY1 unspecified 'CRYSTAL STRUCTURE OF NCAM2 IG3-4' # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 2JLL _pdbx_database_status.deposit_site PDBE _pdbx_database_status.process_site PDBE _pdbx_database_status.SG_entry . _pdbx_database_status.recvd_initial_deposition_date 2008-09-10 _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_sf ? _pdbx_database_status.status_code_mr ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Kulahin, N.' 1 'Rasmussen, K.' 2 'Kristensen, O.' 3 'Kastrup, J.' 4 'Berezin, V.' 5 'Bock, E.' 6 'Walmod, P.' 7 'Gajhede, M.' 8 # _citation.id primary _citation.title 'Structural Model and Trans-Interaction of the Entire Ectodomain of the Olfactory Cell Adhesion Molecule.' _citation.journal_abbrev Structure _citation.journal_volume 19 _citation.page_first 203 _citation.page_last ? _citation.year 2011 _citation.journal_id_ASTM STRUE6 _citation.country UK _citation.journal_id_ISSN 0969-2126 _citation.journal_id_CSD 2005 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 21300289 _citation.pdbx_database_id_DOI 10.1016/J.STR.2010.12.014 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Kulahin, N.' 1 primary 'Kristensen, O.' 2 primary 'Rasmussen, K.K.' 3 primary 'Olsen, L.' 4 primary 'Rydberg, P.' 5 primary 'Vestergaard, B.' 6 primary 'Kastrup, J.S.' 7 primary 'Berezin, V.' 8 primary 'Bock, E.' 9 primary 'Walmod, P.S.' 10 primary 'Gajhede, M.' 11 # _cell.entry_id 2JLL _cell.length_a 151.740 _cell.length_b 33.800 _cell.length_c 97.670 _cell.angle_alpha 90.00 _cell.angle_beta 98.36 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? # _symmetry.entry_id 2JLL _symmetry.space_group_name_H-M 'C 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 # 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 'NEURAL CELL ADHESION MOLECULE 2' 43696.059 1 ? ? 'IGIV-FN3II, RESIDUES 301-689' ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 4 ? ? ? ? 3 non-polymer syn GLYCEROL 92.094 1 ? ? ? ? 4 non-polymer syn 'CALCIUM ION' 40.078 1 ? ? ? ? 5 water nat water 18.015 147 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name NCAM2 # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;QPHIIQLKNETTYENGQVTLVCDAEGEPIPEITWKRAVDGFTFTEGDKSLDGRIEVKGQHGSSSLHIKDVKLSDSGRYDC EAASRIGGHQKSMYLDIEYAPKFISNQTIYYSWEGNPINISCDVKSNPPASIHWRRDKLVLPAKNTTNLKTYSTGRKMIL EIAPTSDNDFGRYNCTATNHIGTRFQEYILALADVPSSPYGVKIIELSQTTAKVSFNKPDSHGGVPIHHYQVDVKEVASE IWKIVRSHGVQTMVVLNNLEPNTTYEIRVAAVNGKGQGDYSKIEIFQTLPVREPSPPSIHGQPSSGKSFKLSITKQDDGG APILEYIVKYRSKDKEDQWLEKKVQGNKDHIILEHLQWTMGYEVQITAANRLGYSEPTVYEFSMPPKPN ; _entity_poly.pdbx_seq_one_letter_code_can ;QPHIIQLKNETTYENGQVTLVCDAEGEPIPEITWKRAVDGFTFTEGDKSLDGRIEVKGQHGSSSLHIKDVKLSDSGRYDC EAASRIGGHQKSMYLDIEYAPKFISNQTIYYSWEGNPINISCDVKSNPPASIHWRRDKLVLPAKNTTNLKTYSTGRKMIL EIAPTSDNDFGRYNCTATNHIGTRFQEYILALADVPSSPYGVKIIELSQTTAKVSFNKPDSHGGVPIHHYQVDVKEVASE IWKIVRSHGVQTMVVLNNLEPNTTYEIRVAAVNGKGQGDYSKIEIFQTLPVREPSPPSIHGQPSSGKSFKLSITKQDDGG APILEYIVKYRSKDKEDQWLEKKVQGNKDHIILEHLQWTMGYEVQITAANRLGYSEPTVYEFSMPPKPN ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLN n 1 2 PRO n 1 3 HIS n 1 4 ILE n 1 5 ILE n 1 6 GLN n 1 7 LEU n 1 8 LYS n 1 9 ASN n 1 10 GLU n 1 11 THR n 1 12 THR n 1 13 TYR n 1 14 GLU n 1 15 ASN n 1 16 GLY n 1 17 GLN n 1 18 VAL n 1 19 THR n 1 20 LEU n 1 21 VAL n 1 22 CYS n 1 23 ASP n 1 24 ALA n 1 25 GLU n 1 26 GLY n 1 27 GLU n 1 28 PRO n 1 29 ILE n 1 30 PRO n 1 31 GLU n 1 32 ILE n 1 33 THR n 1 34 TRP n 1 35 LYS n 1 36 ARG n 1 37 ALA n 1 38 VAL n 1 39 ASP n 1 40 GLY n 1 41 PHE n 1 42 THR n 1 43 PHE n 1 44 THR n 1 45 GLU n 1 46 GLY n 1 47 ASP n 1 48 LYS n 1 49 SER n 1 50 LEU n 1 51 ASP n 1 52 GLY n 1 53 ARG n 1 54 ILE n 1 55 GLU n 1 56 VAL n 1 57 LYS n 1 58 GLY n 1 59 GLN n 1 60 HIS n 1 61 GLY n 1 62 SER n 1 63 SER n 1 64 SER n 1 65 LEU n 1 66 HIS n 1 67 ILE n 1 68 LYS n 1 69 ASP n 1 70 VAL n 1 71 LYS n 1 72 LEU n 1 73 SER n 1 74 ASP n 1 75 SER n 1 76 GLY n 1 77 ARG n 1 78 TYR n 1 79 ASP n 1 80 CYS n 1 81 GLU n 1 82 ALA n 1 83 ALA n 1 84 SER n 1 85 ARG n 1 86 ILE n 1 87 GLY n 1 88 GLY n 1 89 HIS n 1 90 GLN n 1 91 LYS n 1 92 SER n 1 93 MET n 1 94 TYR n 1 95 LEU n 1 96 ASP n 1 97 ILE n 1 98 GLU n 1 99 TYR n 1 100 ALA n 1 101 PRO n 1 102 LYS n 1 103 PHE n 1 104 ILE n 1 105 SER n 1 106 ASN n 1 107 GLN n 1 108 THR n 1 109 ILE n 1 110 TYR n 1 111 TYR n 1 112 SER n 1 113 TRP n 1 114 GLU n 1 115 GLY n 1 116 ASN n 1 117 PRO n 1 118 ILE n 1 119 ASN n 1 120 ILE n 1 121 SER n 1 122 CYS n 1 123 ASP n 1 124 VAL n 1 125 LYS n 1 126 SER n 1 127 ASN n 1 128 PRO n 1 129 PRO n 1 130 ALA n 1 131 SER n 1 132 ILE n 1 133 HIS n 1 134 TRP n 1 135 ARG n 1 136 ARG n 1 137 ASP n 1 138 LYS n 1 139 LEU n 1 140 VAL n 1 141 LEU n 1 142 PRO n 1 143 ALA n 1 144 LYS n 1 145 ASN n 1 146 THR n 1 147 THR n 1 148 ASN n 1 149 LEU n 1 150 LYS n 1 151 THR n 1 152 TYR n 1 153 SER n 1 154 THR n 1 155 GLY n 1 156 ARG n 1 157 LYS n 1 158 MET n 1 159 ILE n 1 160 LEU n 1 161 GLU n 1 162 ILE n 1 163 ALA n 1 164 PRO n 1 165 THR n 1 166 SER n 1 167 ASP n 1 168 ASN n 1 169 ASP n 1 170 PHE n 1 171 GLY n 1 172 ARG n 1 173 TYR n 1 174 ASN n 1 175 CYS n 1 176 THR n 1 177 ALA n 1 178 THR n 1 179 ASN n 1 180 HIS n 1 181 ILE n 1 182 GLY n 1 183 THR n 1 184 ARG n 1 185 PHE n 1 186 GLN n 1 187 GLU n 1 188 TYR n 1 189 ILE n 1 190 LEU n 1 191 ALA n 1 192 LEU n 1 193 ALA n 1 194 ASP n 1 195 VAL n 1 196 PRO n 1 197 SER n 1 198 SER n 1 199 PRO n 1 200 TYR n 1 201 GLY n 1 202 VAL n 1 203 LYS n 1 204 ILE n 1 205 ILE n 1 206 GLU n 1 207 LEU n 1 208 SER n 1 209 GLN n 1 210 THR n 1 211 THR n 1 212 ALA n 1 213 LYS n 1 214 VAL n 1 215 SER n 1 216 PHE n 1 217 ASN n 1 218 LYS n 1 219 PRO n 1 220 ASP n 1 221 SER n 1 222 HIS n 1 223 GLY n 1 224 GLY n 1 225 VAL n 1 226 PRO n 1 227 ILE n 1 228 HIS n 1 229 HIS n 1 230 TYR n 1 231 GLN n 1 232 VAL n 1 233 ASP n 1 234 VAL n 1 235 LYS n 1 236 GLU n 1 237 VAL n 1 238 ALA n 1 239 SER n 1 240 GLU n 1 241 ILE n 1 242 TRP n 1 243 LYS n 1 244 ILE n 1 245 VAL n 1 246 ARG n 1 247 SER n 1 248 HIS n 1 249 GLY n 1 250 VAL n 1 251 GLN n 1 252 THR n 1 253 MET n 1 254 VAL n 1 255 VAL n 1 256 LEU n 1 257 ASN n 1 258 ASN n 1 259 LEU n 1 260 GLU n 1 261 PRO n 1 262 ASN n 1 263 THR n 1 264 THR n 1 265 TYR n 1 266 GLU n 1 267 ILE n 1 268 ARG n 1 269 VAL n 1 270 ALA n 1 271 ALA n 1 272 VAL n 1 273 ASN n 1 274 GLY n 1 275 LYS n 1 276 GLY n 1 277 GLN n 1 278 GLY n 1 279 ASP n 1 280 TYR n 1 281 SER n 1 282 LYS n 1 283 ILE n 1 284 GLU n 1 285 ILE n 1 286 PHE n 1 287 GLN n 1 288 THR n 1 289 LEU n 1 290 PRO n 1 291 VAL n 1 292 ARG n 1 293 GLU n 1 294 PRO n 1 295 SER n 1 296 PRO n 1 297 PRO n 1 298 SER n 1 299 ILE n 1 300 HIS n 1 301 GLY n 1 302 GLN n 1 303 PRO n 1 304 SER n 1 305 SER n 1 306 GLY n 1 307 LYS n 1 308 SER n 1 309 PHE n 1 310 LYS n 1 311 LEU n 1 312 SER n 1 313 ILE n 1 314 THR n 1 315 LYS n 1 316 GLN n 1 317 ASP n 1 318 ASP n 1 319 GLY n 1 320 GLY n 1 321 ALA n 1 322 PRO n 1 323 ILE n 1 324 LEU n 1 325 GLU n 1 326 TYR n 1 327 ILE n 1 328 VAL n 1 329 LYS n 1 330 TYR n 1 331 ARG n 1 332 SER n 1 333 LYS n 1 334 ASP n 1 335 LYS n 1 336 GLU n 1 337 ASP n 1 338 GLN n 1 339 TRP n 1 340 LEU n 1 341 GLU n 1 342 LYS n 1 343 LYS n 1 344 VAL n 1 345 GLN n 1 346 GLY n 1 347 ASN n 1 348 LYS n 1 349 ASP n 1 350 HIS n 1 351 ILE n 1 352 ILE n 1 353 LEU n 1 354 GLU n 1 355 HIS n 1 356 LEU n 1 357 GLN n 1 358 TRP n 1 359 THR n 1 360 MET n 1 361 GLY n 1 362 TYR n 1 363 GLU n 1 364 VAL n 1 365 GLN n 1 366 ILE n 1 367 THR n 1 368 ALA n 1 369 ALA n 1 370 ASN n 1 371 ARG n 1 372 LEU n 1 373 GLY n 1 374 TYR n 1 375 SER n 1 376 GLU n 1 377 PRO n 1 378 THR n 1 379 VAL n 1 380 TYR n 1 381 GLU n 1 382 PHE n 1 383 SER n 1 384 MET n 1 385 PRO n 1 386 PRO n 1 387 LYS n 1 388 PRO n 1 389 ASN n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _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 HUMAN _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 'HOMO SAPIENS' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 _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 'PICHIA PASTORIS' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 4922 _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 KM71H _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 PPICZALFAC _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 ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code NCAM2_HUMAN _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ? _struct_ref.pdbx_align_begin ? _struct_ref.pdbx_db_accession O15394 _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 2JLL _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 389 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession O15394 _struct_ref_seq.db_align_beg 301 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 689 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 301 _struct_ref_seq.pdbx_auth_seq_align_end 689 # 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 CA non-polymer . 'CALCIUM ION' ? 'Ca 2' 40.078 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 2JLL _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.48 _exptl_crystal.density_percent_sol 50.39 _exptl_crystal.description NONE # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method ? _exptl_crystal_grow.temp ? _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 6.5 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details '0.1M HEPES PH6.5, 14% PEG10000, 0.2M CALCIUM ACETATE' # _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 CCD' _diffrn_detector.pdbx_collection_date 2008-04-05 _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 ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.976 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ESRF BEAMLINE ID29' _diffrn_source.pdbx_synchrotron_site ESRF _diffrn_source.pdbx_synchrotron_beamline ID29 _diffrn_source.pdbx_wavelength 0.976 _diffrn_source.pdbx_wavelength_list ? # _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 2JLL _reflns.observed_criterion_sigma_I 2.0 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 19.79 _reflns.d_resolution_high 2.30 _reflns.number_obs 38513 _reflns.number_all ? _reflns.percent_possible_obs 90.4 _reflns.pdbx_Rmerge_I_obs 0.042 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 8.60 _reflns.B_iso_Wilson_estimate 43.77 _reflns.pdbx_redundancy 3.7 # _reflns_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_ordinal 1 _reflns_shell.d_res_high 2.30 _reflns_shell.d_res_low 2.42 _reflns_shell.percent_possible_all 99.9 _reflns_shell.Rmerge_I_obs 0.272 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs 2.30 _reflns_shell.pdbx_redundancy 3.8 # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 2JLL _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.ls_number_reflns_obs 38513 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.94 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 19.791 _refine.ls_d_res_high 2.30 _refine.ls_percent_reflns_obs 90.39 _refine.ls_R_factor_obs 0.2183 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.2156 _refine.ls_R_factor_R_free 0.2685 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.2 _refine.ls_number_reflns_R_free 1987 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean 51.28 _refine.aniso_B[1][1] 2.9794 _refine.aniso_B[2][2] -3.0432 _refine.aniso_B[3][3] 0.0638 _refine.aniso_B[1][2] 0.0000 _refine.aniso_B[1][3] -6.5728 _refine.aniso_B[2][3] 0.0000 _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol 0.384 _refine.solvent_model_param_bsol 62.610 _refine.pdbx_solvent_vdw_probe_radii 1.11 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.90 _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.39 _refine.pdbx_overall_phase_error 29.13 _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _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 3022 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 63 _refine_hist.number_atoms_solvent 147 _refine_hist.number_atoms_total 3232 _refine_hist.d_res_high 2.30 _refine_hist.d_res_low 19.791 # 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 f_bond_d 0.00 ? ? 3177 'X-RAY DIFFRACTION' ? f_angle_d 0.92 ? ? 4302 'X-RAY DIFFRACTION' ? f_dihedral_angle_d 15.32 ? ? 1178 'X-RAY DIFFRACTION' ? f_chiral_restr 0.05 ? ? 476 'X-RAY DIFFRACTION' ? f_plane_restr 0.00 ? ? 549 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all 'X-RAY DIFFRACTION' . 2.3000 2.3575 2633 0.3159 92.00 0.3431 . . 154 . . 'X-RAY DIFFRACTION' . 2.3575 2.4211 2698 0.3127 91.00 0.3660 . . 147 . . 'X-RAY DIFFRACTION' . 2.4211 2.4922 2635 0.2972 94.00 0.3247 . . 126 . . 'X-RAY DIFFRACTION' . 2.4922 2.5725 2694 0.2804 91.00 0.3583 . . 135 . . 'X-RAY DIFFRACTION' . 2.5725 2.6642 2617 0.2743 92.00 0.3378 . . 157 . . 'X-RAY DIFFRACTION' . 2.6642 2.7706 2631 0.2713 91.00 0.2788 . . 152 . . 'X-RAY DIFFRACTION' . 2.7706 2.8963 2625 0.2485 91.00 0.3197 . . 132 . . 'X-RAY DIFFRACTION' . 2.8963 3.0485 2654 0.2469 90.00 0.3292 . . 144 . . 'X-RAY DIFFRACTION' . 3.0485 3.2387 2549 0.2360 91.00 0.3018 . . 168 . . 'X-RAY DIFFRACTION' . 3.2387 3.4876 2617 0.2061 90.00 0.2708 . . 130 . . 'X-RAY DIFFRACTION' . 3.4876 3.8362 2583 0.1959 90.00 0.2605 . . 150 . . 'X-RAY DIFFRACTION' . 3.8362 4.3861 2557 0.1710 90.00 0.2119 . . 155 . . 'X-RAY DIFFRACTION' . 4.3861 5.5062 2604 0.1483 89.00 0.1858 . . 113 . . 'X-RAY DIFFRACTION' . 5.5062 19.7921 2429 0.1796 84.00 0.2159 . . 124 . . # _struct.entry_id 2JLL _struct.title 'Crystal structure of NCAM2 IgIV-FN3II' _struct.pdbx_descriptor 'NEURAL CELL ADHESION MOLECULE 2' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 2JLL _struct_keywords.pdbx_keywords 'CELL ADHESION' _struct_keywords.text ;IMMUNOGLOBULIN DOMAIN, IMMUNOGLOBULIN SUPERFAMILY, CELL ADHESION, TRANSMEMBRANE, PHOSPHOPROTEIN, NEURAL, MEMBRANE, GLYCOPROTEIN, CELL MEMBRANE ; # 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 2 ? D N N 2 ? E N N 2 ? F N N 3 ? G N N 4 ? H N N 5 ? # _struct_biol.id 1 # _struct_conf.conf_type_id HELX_P _struct_conf.id HELX_P1 _struct_conf.pdbx_PDB_helix_id 1 _struct_conf.beg_label_comp_id LYS _struct_conf.beg_label_asym_id A _struct_conf.beg_label_seq_id 71 _struct_conf.pdbx_beg_PDB_ins_code ? _struct_conf.end_label_comp_id SER _struct_conf.end_label_asym_id A _struct_conf.end_label_seq_id 75 _struct_conf.pdbx_end_PDB_ins_code ? _struct_conf.beg_auth_comp_id LYS _struct_conf.beg_auth_asym_id A _struct_conf.beg_auth_seq_id 371 _struct_conf.end_auth_comp_id SER _struct_conf.end_auth_asym_id A _struct_conf.end_auth_seq_id 375 _struct_conf.pdbx_PDB_helix_class 5 _struct_conf.details ? _struct_conf.pdbx_PDB_helix_length 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 22 SG ? ? ? 1_555 A CYS 80 SG ? ? A CYS 322 A CYS 380 1_555 ? ? ? ? ? ? ? 2.039 ? disulf2 disulf ? ? A CYS 122 SG ? ? ? 1_555 A CYS 175 SG ? ? A CYS 422 A CYS 475 1_555 ? ? ? ? ? ? ? 2.054 ? covale1 covale ? ? A ASN 9 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 309 A NAG 1693 1_555 ? ? ? ? ? ? ? 1.449 ? covale2 covale ? ? A ASN 119 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 419 A NAG 1690 1_555 ? ? ? ? ? ? ? 1.437 ? covale3 covale ? ? A ASN 145 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 445 A NAG 1691 1_555 ? ? ? ? ? ? ? 1.440 ? covale4 covale ? ? A ASN 174 ND2 ? ? ? 1_555 D NAG . C1 ? ? A ASN 474 A NAG 1692 1_555 ? ? ? ? ? ? ? 1.432 ? metalc1 metalc ? ? G CA . CA ? ? ? 1_555 F GOL . O1 ? ? A CA 1695 A GOL 1694 1_555 ? ? ? ? ? ? ? 2.404 ? metalc2 metalc ? ? G CA . CA ? ? ? 1_555 H HOH . O ? ? A CA 1695 A HOH 2084 1_555 ? ? ? ? ? ? ? 2.398 ? metalc3 metalc ? ? G CA . CA ? ? ? 1_555 H HOH . O ? ? A CA 1695 A HOH 2147 1_555 ? ? ? ? ? ? ? 2.402 ? metalc4 metalc ? ? G CA . CA ? ? ? 1_555 A GLU 381 OE2 ? ? A CA 1695 A GLU 681 2_546 ? ? ? ? ? ? ? 2.813 ? metalc5 metalc ? ? G CA . CA ? ? ? 1_555 A GLU 381 OE1 ? ? A CA 1695 A GLU 681 2_546 ? ? ? ? ? ? ? 2.398 ? metalc6 metalc ? ? G CA . CA ? ? ? 1_555 A ASP 194 OD2 ? ? A CA 1695 A ASP 494 1_555 ? ? ? ? ? ? ? 2.400 ? metalc7 metalc ? ? G CA . CA ? ? ? 1_555 F GOL . O3 ? ? A CA 1695 A GOL 1694 1_555 ? ? ? ? ? ? ? 2.399 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # 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 GLU 27 A . ? GLU 327 A PRO 28 A ? PRO 328 A 1 1.05 2 LYS 48 A . ? LYS 348 A SER 49 A ? SER 349 A 1 7.94 3 ASN 127 A . ? ASN 427 A PRO 128 A ? PRO 428 A 1 0.76 4 LEU 141 A . ? LEU 441 A PRO 142 A ? PRO 442 A 1 -0.44 5 SER 305 A . ? SER 605 A GLY 306 A ? GLY 606 A 1 -0.50 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA ? 4 ? AB ? 5 ? AC ? 3 ? AD ? 5 ? AE ? 3 ? AF ? 3 ? AG ? 4 ? AH ? 3 ? AI ? 4 ? AJ ? 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 AA 1 2 ? anti-parallel AA 2 3 ? anti-parallel AA 3 4 ? anti-parallel AB 1 2 ? parallel AB 2 3 ? anti-parallel AB 3 4 ? anti-parallel AB 4 5 ? anti-parallel AC 1 2 ? parallel AC 2 3 ? anti-parallel AD 1 2 ? parallel AD 2 3 ? anti-parallel AD 3 4 ? anti-parallel AD 4 5 ? anti-parallel AE 1 2 ? anti-parallel AE 2 3 ? anti-parallel AF 1 2 ? anti-parallel AF 2 3 ? anti-parallel AG 1 2 ? anti-parallel AG 2 3 ? anti-parallel AG 3 4 ? anti-parallel AH 1 2 ? anti-parallel AH 2 3 ? anti-parallel AI 1 2 ? anti-parallel AI 2 3 ? anti-parallel AI 3 4 ? anti-parallel AJ 1 2 ? anti-parallel AJ 2 3 ? anti-parallel AJ 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 AA 1 HIS A 3 ? GLN A 6 ? HIS A 303 GLN A 306 AA 2 GLN A 17 ? GLU A 25 ? GLN A 317 GLU A 325 AA 3 SER A 62 ? LYS A 68 ? SER A 362 LYS A 368 AA 4 ILE A 54 ? GLY A 58 ? ILE A 354 GLY A 358 AB 1 GLU A 10 ? TYR A 13 ? GLU A 310 TYR A 313 AB 2 GLY A 88 ? PHE A 103 ? GLY A 388 PHE A 403 AB 3 GLY A 76 ? ALA A 83 ? GLY A 376 ALA A 383 AB 4 GLU A 31 ? ARG A 36 ? GLU A 331 ARG A 336 AB 5 PHE A 41 ? PHE A 43 ? PHE A 341 PHE A 343 AC 1 GLU A 10 ? TYR A 13 ? GLU A 310 TYR A 313 AC 2 GLY A 88 ? PHE A 103 ? GLY A 388 PHE A 403 AC 3 VAL A 124 ? ASN A 127 ? VAL A 424 ASN A 427 AD 1 ILE A 109 ? SER A 112 ? ILE A 409 SER A 412 AD 2 GLY A 182 ? LEU A 192 ? GLY A 482 LEU A 492 AD 3 GLY A 171 ? ASN A 179 ? GLY A 471 ASN A 479 AD 4 SER A 131 ? ARG A 136 ? SER A 431 ARG A 436 AD 5 LEU A 139 ? VAL A 140 ? LEU A 439 VAL A 440 AE 1 ILE A 118 ? CYS A 122 ? ILE A 418 CYS A 422 AE 2 MET A 158 ? ILE A 162 ? MET A 458 ILE A 462 AE 3 LEU A 149 ? SER A 153 ? LEU A 449 SER A 453 AF 1 TYR A 200 ? LEU A 207 ? TYR A 500 LEU A 507 AF 2 ALA A 212 ? ASN A 217 ? ALA A 512 ASN A 517 AF 3 MET A 253 ? LEU A 256 ? MET A 553 LEU A 556 AG 1 LYS A 243 ? ARG A 246 ? LYS A 543 ARG A 546 AG 2 ILE A 227 ? GLU A 236 ? ILE A 527 GLU A 536 AG 3 THR A 264 ? ASN A 273 ? THR A 564 ASN A 573 AG 4 GLU A 284 ? GLN A 287 ? GLU A 584 GLN A 587 AH 1 ILE A 299 ? SER A 304 ? ILE A 599 SER A 604 AH 2 SER A 308 ? ILE A 313 ? SER A 608 ILE A 613 AH 3 HIS A 350 ? LEU A 353 ? HIS A 650 LEU A 653 AI 1 LYS A 343 ? VAL A 344 ? LYS A 643 VAL A 644 AI 2 GLU A 325 ? ARG A 331 ? GLU A 625 ARG A 631 AI 3 GLY A 361 ? ASN A 370 ? GLY A 661 ASN A 670 AI 4 THR A 378 ? SER A 383 ? THR A 678 SER A 683 AJ 1 LYS A 343 ? VAL A 344 ? LYS A 643 VAL A 644 AJ 2 GLU A 325 ? ARG A 331 ? GLU A 625 ARG A 631 AJ 3 GLY A 361 ? ASN A 370 ? GLY A 661 ASN A 670 AJ 4 GLY A 373 ? TYR A 374 ? GLY A 673 TYR A 674 # 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 AA 1 2 N ILE A 5 ? N ILE A 305 O ASP A 23 ? O ASP A 323 AA 2 3 N CYS A 22 ? N CYS A 322 O SER A 63 ? O SER A 363 AA 3 4 N HIS A 66 ? N HIS A 366 O GLU A 55 ? O GLU A 355 AB 1 2 N GLU A 10 ? N GLU A 310 O TYR A 94 ? O TYR A 394 AB 2 3 N LEU A 95 ? N LEU A 395 O GLY A 76 ? O GLY A 376 AB 3 4 N ALA A 83 ? N ALA A 383 O GLU A 31 ? O GLU A 331 AB 4 5 N ARG A 36 ? N ARG A 336 O PHE A 41 ? O PHE A 341 AC 1 2 N GLU A 10 ? N GLU A 310 O TYR A 94 ? O TYR A 394 AC 2 3 N LYS A 102 ? N LYS A 402 O LYS A 125 ? O LYS A 425 AD 1 2 N TYR A 110 ? N TYR A 410 O ILE A 189 ? O ILE A 489 AD 2 3 N LEU A 190 ? N LEU A 490 O GLY A 171 ? O GLY A 471 AD 3 4 N THR A 178 ? N THR A 478 O SER A 131 ? O SER A 431 AD 4 5 N ARG A 136 ? N ARG A 436 O LEU A 139 ? O LEU A 439 AE 1 2 N CYS A 122 ? N CYS A 422 O MET A 158 ? O MET A 458 AE 2 3 N GLU A 161 ? N GLU A 461 O LYS A 150 ? O LYS A 450 AF 1 2 N ILE A 205 ? N ILE A 505 O LYS A 213 ? O LYS A 513 AF 2 3 N VAL A 214 ? N VAL A 514 O VAL A 254 ? O VAL A 554 AG 1 2 N VAL A 245 ? N VAL A 545 O VAL A 232 ? O VAL A 532 AG 2 3 N LYS A 235 ? N LYS A 535 O GLU A 266 ? O GLU A 566 AG 3 4 N ILE A 267 ? N ILE A 567 O GLU A 284 ? O GLU A 584 AH 1 2 N SER A 304 ? N SER A 604 O SER A 308 ? O SER A 608 AH 2 3 N LEU A 311 ? N LEU A 611 O ILE A 351 ? O ILE A 651 AI 1 2 N VAL A 344 ? N VAL A 644 O TYR A 326 ? O TYR A 626 AI 2 3 N ARG A 331 ? N ARG A 631 O GLU A 363 ? O GLU A 663 AI 3 4 N ILE A 366 ? N ILE A 666 O THR A 378 ? O THR A 678 AJ 1 2 N VAL A 344 ? N VAL A 644 O TYR A 326 ? O TYR A 626 AJ 2 3 N ARG A 331 ? N ARG A 631 O GLU A 363 ? O GLU A 663 AJ 3 4 N ASN A 370 ? N ASN A 670 O GLY A 373 ? O GLY A 673 # 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 ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG A 1690' AC2 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 1691' AC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG A 1692' AC4 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 1693' AC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE GOL A 1694' AC6 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE CA A 1695' # 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 7 ASN A 119 ? ASN A 419 . ? 1_555 ? 2 AC1 7 GLU A 161 ? GLU A 461 . ? 1_555 ? 3 AC1 7 GLN A 231 ? GLN A 531 . ? 4_456 ? 4 AC1 7 GLN A 277 ? GLN A 577 . ? 4_456 ? 5 AC1 7 HOH H . ? HOH A 2144 . ? 1_555 ? 6 AC1 7 HOH H . ? HOH A 2145 . ? 1_555 ? 7 AC1 7 HOH H . ? HOH A 2146 . ? 1_555 ? 8 AC2 3 LEU A 139 ? LEU A 439 . ? 1_555 ? 9 AC2 3 ASN A 145 ? ASN A 445 . ? 1_555 ? 10 AC2 3 ASN A 258 ? ASN A 558 . ? 4_446 ? 11 AC3 5 ASP A 137 ? ASP A 437 . ? 1_555 ? 12 AC3 5 ARG A 172 ? ARG A 472 . ? 1_555 ? 13 AC3 5 ASN A 174 ? ASN A 474 . ? 1_555 ? 14 AC3 5 PHE A 185 ? PHE A 485 . ? 1_555 ? 15 AC3 5 GLU A 187 ? GLU A 487 . ? 1_555 ? 16 AC4 2 ASN A 9 ? ASN A 309 . ? 1_555 ? 17 AC4 2 TYR A 94 ? TYR A 394 . ? 1_555 ? 18 AC5 5 ASP A 279 ? ASP A 579 . ? 1_555 ? 19 AC5 5 GLU A 381 ? GLU A 681 . ? 2_546 ? 20 AC5 5 CA G . ? CA A 1695 . ? 1_555 ? 21 AC5 5 HOH H . ? HOH A 2084 . ? 1_555 ? 22 AC5 5 HOH H . ? HOH A 2147 . ? 1_555 ? 23 AC6 5 ASP A 194 ? ASP A 494 . ? 1_555 ? 24 AC6 5 GLU A 381 ? GLU A 681 . ? 2_546 ? 25 AC6 5 GOL F . ? GOL A 1694 . ? 1_555 ? 26 AC6 5 HOH H . ? HOH A 2084 . ? 1_555 ? 27 AC6 5 HOH H . ? HOH A 2147 . ? 1_555 ? # _database_PDB_matrix.entry_id 2JLL _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 2JLL _atom_sites.fract_transf_matrix[1][1] 0.006590 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000968 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.029586 _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] 0.010349 _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 CA 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 . GLN A 1 1 ? -70.753 34.421 -6.427 1.00 64.03 ? 301 GLN A N 1 ATOM 2 C CA . GLN A 1 1 ? -70.137 34.402 -5.098 1.00 79.01 ? 301 GLN A CA 1 ATOM 3 C C . GLN A 1 1 ? -70.140 33.000 -4.496 1.00 65.27 ? 301 GLN A C 1 ATOM 4 O O . GLN A 1 1 ? -71.143 32.569 -3.927 1.00 61.15 ? 301 GLN A O 1 ATOM 5 C CB . GLN A 1 1 ? -70.860 35.362 -4.155 1.00 70.84 ? 301 GLN A CB 1 ATOM 6 C CG . GLN A 1 1 ? -70.215 35.498 -2.780 1.00 77.32 ? 301 GLN A CG 1 ATOM 7 C CD . GLN A 1 1 ? -69.002 36.410 -2.792 1.00 78.71 ? 301 GLN A CD 1 ATOM 8 O OE1 . GLN A 1 1 ? -69.005 37.473 -2.169 1.00 74.26 ? 301 GLN A OE1 1 ATOM 9 N NE2 . GLN A 1 1 ? -67.963 36.006 -3.512 1.00 75.57 ? 301 GLN A NE2 1 ATOM 10 N N . PRO A 1 2 ? -69.006 32.294 -4.613 1.00 58.79 ? 302 PRO A N 1 ATOM 11 C CA . PRO A 1 2 ? -68.871 30.884 -4.221 1.00 61.58 ? 302 PRO A CA 1 ATOM 12 C C . PRO A 1 2 ? -69.472 30.564 -2.847 1.00 58.71 ? 302 PRO A C 1 ATOM 13 O O . PRO A 1 2 ? -69.294 31.329 -1.894 1.00 61.84 ? 302 PRO A O 1 ATOM 14 C CB . PRO A 1 2 ? -67.354 30.674 -4.207 1.00 58.17 ? 302 PRO A CB 1 ATOM 15 C CG . PRO A 1 2 ? -66.834 31.661 -5.203 1.00 61.25 ? 302 PRO A CG 1 ATOM 16 C CD . PRO A 1 2 ? -67.726 32.867 -5.070 1.00 62.40 ? 302 PRO A CD 1 ATOM 17 N N . HIS A 1 3 ? -70.183 29.442 -2.762 1.00 56.86 ? 303 HIS A N 1 ATOM 18 C CA . HIS A 1 3 ? -70.770 28.975 -1.508 1.00 57.27 ? 303 HIS A CA 1 ATOM 19 C C . HIS A 1 3 ? -70.861 27.447 -1.495 1.00 56.57 ? 303 HIS A C 1 ATOM 20 O O . HIS A 1 3 ? -71.548 26.847 -2.326 1.00 56.56 ? 303 HIS A O 1 ATOM 21 C CB . HIS A 1 3 ? -72.150 29.599 -1.303 1.00 54.97 ? 303 HIS A CB 1 ATOM 22 C CG . HIS A 1 3 ? -72.796 29.232 -0.005 1.00 60.28 ? 303 HIS A CG 1 ATOM 23 N ND1 . HIS A 1 3 ? -72.451 29.824 1.193 1.00 63.23 ? 303 HIS A ND1 1 ATOM 24 C CD2 . HIS A 1 3 ? -73.779 28.347 0.286 1.00 60.82 ? 303 HIS A CD2 1 ATOM 25 C CE1 . HIS A 1 3 ? -73.188 29.314 2.163 1.00 61.53 ? 303 HIS A CE1 1 ATOM 26 N NE2 . HIS A 1 3 ? -74.002 28.414 1.640 1.00 61.59 ? 303 HIS A NE2 1 ATOM 27 N N . ILE A 1 4 ? -70.159 26.819 -0.556 1.00 53.58 ? 304 ILE A N 1 ATOM 28 C CA . ILE A 1 4 ? -70.137 25.363 -0.471 1.00 49.58 ? 304 ILE A CA 1 ATOM 29 C C . ILE A 1 4 ? -71.448 24.806 0.080 1.00 46.77 ? 304 ILE A C 1 ATOM 30 O O . ILE A 1 4 ? -71.887 25.164 1.177 1.00 46.87 ? 304 ILE A O 1 ATOM 31 C CB . ILE A 1 4 ? -68.946 24.856 0.370 1.00 49.31 ? 304 ILE A CB 1 ATOM 32 C CG1 . ILE A 1 4 ? -67.627 25.170 -0.339 1.00 44.17 ? 304 ILE A CG1 1 ATOM 33 C CG2 . ILE A 1 4 ? -69.060 23.354 0.611 1.00 48.67 ? 304 ILE A CG2 1 ATOM 34 C CD1 . ILE A 1 4 ? -66.418 25.205 0.589 1.00 43.68 ? 304 ILE A CD1 1 ATOM 35 N N . ILE A 1 5 ? -72.058 23.913 -0.693 1.00 47.76 ? 305 ILE A N 1 ATOM 36 C CA . ILE A 1 5 ? -73.360 23.344 -0.354 1.00 49.70 ? 305 ILE A CA 1 ATOM 37 C C . ILE A 1 5 ? -73.266 21.950 0.270 1.00 48.94 ? 305 ILE A C 1 ATOM 38 O O . ILE A 1 5 ? -74.154 21.534 1.017 1.00 48.97 ? 305 ILE A O 1 ATOM 39 C CB . ILE A 1 5 ? -74.273 23.277 -1.596 1.00 49.13 ? 305 ILE A CB 1 ATOM 40 C CG1 . ILE A 1 5 ? -73.462 22.840 -2.819 1.00 50.70 ? 305 ILE A CG1 1 ATOM 41 C CG2 . ILE A 1 5 ? -74.925 24.632 -1.844 1.00 50.70 ? 305 ILE A CG2 1 ATOM 42 C CD1 . ILE A 1 5 ? -74.298 22.435 -4.023 1.00 49.65 ? 305 ILE A CD1 1 ATOM 43 N N . GLN A 1 6 ? -72.200 21.224 -0.047 1.00 46.61 ? 306 GLN A N 1 ATOM 44 C CA . GLN A 1 6 ? -72.009 19.894 0.523 1.00 53.24 ? 306 GLN A CA 1 ATOM 45 C C . GLN A 1 6 ? -70.539 19.591 0.788 1.00 46.13 ? 306 GLN A C 1 ATOM 46 O O . GLN A 1 6 ? -69.691 19.744 -0.095 1.00 47.65 ? 306 GLN A O 1 ATOM 47 C CB . GLN A 1 6 ? -72.610 18.814 -0.386 1.00 58.65 ? 306 GLN A CB 1 ATOM 48 C CG . GLN A 1 6 ? -72.304 17.391 0.068 1.00 69.21 ? 306 GLN A CG 1 ATOM 49 C CD . GLN A 1 6 ? -72.662 16.338 -0.970 1.00 70.50 ? 306 GLN A CD 1 ATOM 50 O OE1 . GLN A 1 6 ? -71.820 15.529 -1.369 1.00 64.20 ? 306 GLN A OE1 1 ATOM 51 N NE2 . GLN A 1 6 ? -73.915 16.341 -1.409 1.00 76.33 ? 306 GLN A NE2 1 ATOM 52 N N . LEU A 1 7 ? -70.252 19.163 2.013 1.00 43.24 ? 307 LEU A N 1 ATOM 53 C CA . LEU A 1 7 ? -68.924 18.687 2.389 1.00 48.23 ? 307 LEU A CA 1 ATOM 54 C C . LEU A 1 7 ? -69.054 17.839 3.649 1.00 43.41 ? 307 LEU A C 1 ATOM 55 O O . LEU A 1 7 ? -68.895 18.339 4.758 1.00 40.79 ? 307 LEU A O 1 ATOM 56 C CB . LEU A 1 7 ? -67.975 19.858 2.640 1.00 41.37 ? 307 LEU A CB 1 ATOM 57 C CG . LEU A 1 7 ? -66.534 19.483 2.980 1.00 40.29 ? 307 LEU A CG 1 ATOM 58 C CD1 . LEU A 1 7 ? -65.792 19.128 1.709 1.00 31.46 ? 307 LEU A CD1 1 ATOM 59 C CD2 . LEU A 1 7 ? -65.831 20.613 3.734 1.00 38.83 ? 307 LEU A CD2 1 ATOM 60 N N . LYS A 1 8 ? -69.350 16.556 3.469 1.00 40.80 ? 308 LYS A N 1 ATOM 61 C CA . LYS A 1 8 ? -69.733 15.685 4.575 1.00 47.29 ? 308 LYS A CA 1 ATOM 62 C C . LYS A 1 8 ? -68.544 14.997 5.248 1.00 41.67 ? 308 LYS A C 1 ATOM 63 O O . LYS A 1 8 ? -67.494 14.789 4.629 1.00 36.21 ? 308 LYS A O 1 ATOM 64 C CB . LYS A 1 8 ? -70.737 14.632 4.089 1.00 51.48 ? 308 LYS A CB 1 ATOM 65 C CG . LYS A 1 8 ? -72.080 15.200 3.640 1.00 62.29 ? 308 LYS A CG 1 ATOM 66 C CD . LYS A 1 8 ? -73.104 14.094 3.404 1.00 90.35 ? 308 LYS A CD 1 ATOM 67 C CE . LYS A 1 8 ? -74.380 14.624 2.759 1.00 91.52 ? 308 LYS A CE 1 ATOM 68 N NZ . LYS A 1 8 ? -74.191 14.957 1.318 1.00 81.59 ? 308 LYS A NZ 1 ATOM 69 N N . ASN A 1 9 ? -68.712 14.663 6.525 1.00 42.63 ? 309 ASN A N 1 ATOM 70 C CA . ASN A 1 9 ? -67.745 13.825 7.224 1.00 43.75 ? 309 ASN A CA 1 ATOM 71 C C . ASN A 1 9 ? -67.725 12.450 6.563 1.00 45.80 ? 309 ASN A C 1 ATOM 72 O O . ASN A 1 9 ? -68.765 11.935 6.151 1.00 41.02 ? 309 ASN A O 1 ATOM 73 C CB . ASN A 1 9 ? -68.109 13.690 8.707 1.00 36.88 ? 309 ASN A CB 1 ATOM 74 C CG . ASN A 1 9 ? -67.808 14.951 9.513 1.00 46.86 ? 309 ASN A CG 1 ATOM 75 O OD1 . ASN A 1 9 ? -66.984 15.777 9.112 1.00 39.74 ? 309 ASN A OD1 1 ATOM 76 N ND2 . ASN A 1 9 ? -68.472 15.092 10.665 1.00 57.13 ? 309 ASN A ND2 1 ATOM 77 N N . GLU A 1 10 ? -66.547 11.859 6.436 1.00 42.60 ? 310 GLU A N 1 ATOM 78 C CA . GLU A 1 10 ? -66.454 10.510 5.889 1.00 41.21 ? 310 GLU A CA 1 ATOM 79 C C . GLU A 1 10 ? -65.826 9.516 6.868 1.00 43.50 ? 310 GLU A C 1 ATOM 80 O O . GLU A 1 10 ? -65.002 9.876 7.718 1.00 36.25 ? 310 GLU A O 1 ATOM 81 C CB . GLU A 1 10 ? -65.695 10.507 4.558 1.00 46.43 ? 310 GLU A CB 1 ATOM 82 C CG . GLU A 1 10 ? -66.434 11.200 3.410 1.00 53.90 ? 310 GLU A CG 1 ATOM 83 C CD . GLU A 1 10 ? -67.766 10.543 3.076 1.00 64.98 ? 310 GLU A CD 1 ATOM 84 O OE1 . GLU A 1 10 ? -67.865 9.301 3.172 1.00 58.93 ? 310 GLU A OE1 1 ATOM 85 O OE2 . GLU A 1 10 ? -68.716 11.269 2.710 1.00 71.34 ? 310 GLU A OE2 1 ATOM 86 N N . THR A 1 11 ? -66.235 8.259 6.742 1.00 44.51 ? 311 THR A N 1 ATOM 87 C CA . THR A 1 11 ? -65.644 7.175 7.511 1.00 41.97 ? 311 THR A CA 1 ATOM 88 C C . THR A 1 11 ? -65.193 6.081 6.559 1.00 39.50 ? 311 THR A C 1 ATOM 89 O O . THR A 1 11 ? -65.893 5.764 5.601 1.00 46.76 ? 311 THR A O 1 ATOM 90 C CB . THR A 1 11 ? -66.641 6.580 8.520 1.00 46.52 ? 311 THR A CB 1 ATOM 91 O OG1 . THR A 1 11 ? -67.643 5.830 7.823 1.00 58.76 ? 311 THR A OG1 1 ATOM 92 C CG2 . THR A 1 11 ? -67.305 7.686 9.332 1.00 44.46 ? 311 THR A CG2 1 ATOM 93 N N . THR A 1 12 ? -64.017 5.517 6.815 1.00 40.42 ? 312 THR A N 1 ATOM 94 C CA . THR A 1 12 ? -63.511 4.401 6.023 1.00 41.05 ? 312 THR A CA 1 ATOM 95 C C . THR A 1 12 ? -62.674 3.467 6.908 1.00 43.09 ? 312 THR A C 1 ATOM 96 O O . THR A 1 12 ? -62.541 3.707 8.104 1.00 40.98 ? 312 THR A O 1 ATOM 97 C CB . THR A 1 12 ? -62.718 4.894 4.787 1.00 39.61 ? 312 THR A CB 1 ATOM 98 O OG1 . THR A 1 12 ? -62.361 3.781 3.956 1.00 41.80 ? 312 THR A OG1 1 ATOM 99 C CG2 . THR A 1 12 ? -61.459 5.643 5.202 1.00 42.10 ? 312 THR A CG2 1 ATOM 100 N N . TYR A 1 13 ? -62.131 2.397 6.334 1.00 38.13 ? 313 TYR A N 1 ATOM 101 C CA . TYR A 1 13 ? -61.367 1.430 7.116 1.00 40.13 ? 313 TYR A CA 1 ATOM 102 C C . TYR A 1 13 ? -59.913 1.394 6.680 1.00 39.74 ? 313 TYR A C 1 ATOM 103 O O . TYR A 1 13 ? -59.587 1.696 5.534 1.00 36.48 ? 313 TYR A O 1 ATOM 104 C CB . TYR A 1 13 ? -61.997 0.028 7.048 1.00 43.97 ? 313 TYR A CB 1 ATOM 105 C CG . TYR A 1 13 ? -62.156 -0.530 5.645 1.00 43.71 ? 313 TYR A CG 1 ATOM 106 C CD1 . TYR A 1 13 ? -61.080 -1.099 4.974 1.00 43.36 ? 313 TYR A CD1 1 ATOM 107 C CD2 . TYR A 1 13 ? -63.385 -0.492 4.995 1.00 43.75 ? 313 TYR A CD2 1 ATOM 108 C CE1 . TYR A 1 13 ? -61.223 -1.609 3.691 1.00 43.37 ? 313 TYR A CE1 1 ATOM 109 C CE2 . TYR A 1 13 ? -63.536 -1.002 3.711 1.00 41.51 ? 313 TYR A CE2 1 ATOM 110 C CZ . TYR A 1 13 ? -62.452 -1.557 3.064 1.00 43.13 ? 313 TYR A CZ 1 ATOM 111 O OH . TYR A 1 13 ? -62.600 -2.059 1.786 1.00 42.99 ? 313 TYR A OH 1 ATOM 112 N N . GLU A 1 14 ? -59.036 1.028 7.604 1.00 39.73 ? 314 GLU A N 1 ATOM 113 C CA . GLU A 1 14 ? -57.611 0.988 7.314 1.00 45.68 ? 314 GLU A CA 1 ATOM 114 C C . GLU A 1 14 ? -57.332 0.077 6.123 1.00 45.32 ? 314 GLU A C 1 ATOM 115 O O . GLU A 1 14 ? -57.854 -1.034 6.047 1.00 43.25 ? 314 GLU A O 1 ATOM 116 C CB . GLU A 1 14 ? -56.849 0.503 8.541 1.00 37.55 ? 314 GLU A CB 1 ATOM 117 C CG . GLU A 1 14 ? -55.348 0.403 8.364 1.00 44.67 ? 314 GLU A CG 1 ATOM 118 C CD . GLU A 1 14 ? -54.645 0.016 9.660 1.00 44.59 ? 314 GLU A CD 1 ATOM 119 O OE1 . GLU A 1 14 ? -55.298 -0.578 10.542 1.00 42.18 ? 314 GLU A OE1 1 ATOM 120 O OE2 . GLU A 1 14 ? -53.442 0.308 9.801 1.00 46.15 ? 314 GLU A OE2 1 ATOM 121 N N . ASN A 1 15 ? -56.512 0.558 5.194 1.00 38.89 ? 315 ASN A N 1 ATOM 122 C CA . ASN A 1 15 ? -56.172 -0.210 3.999 1.00 47.93 ? 315 ASN A CA 1 ATOM 123 C C . ASN A 1 15 ? -57.262 -0.186 2.924 1.00 44.89 ? 315 ASN A C 1 ATOM 124 O O . ASN A 1 15 ? -57.046 -0.640 1.803 1.00 44.61 ? 315 ASN A O 1 ATOM 125 C CB . ASN A 1 15 ? -55.821 -1.653 4.368 1.00 46.64 ? 315 ASN A CB 1 ATOM 126 C CG . ASN A 1 15 ? -54.613 -1.742 5.282 1.00 54.00 ? 315 ASN A CG 1 ATOM 127 O OD1 . ASN A 1 15 ? -53.810 -0.810 5.364 1.00 60.93 ? 315 ASN A OD1 1 ATOM 128 N ND2 . ASN A 1 15 ? -54.478 -2.867 5.973 1.00 57.66 ? 315 ASN A ND2 1 ATOM 129 N N . GLY A 1 16 ? -58.434 0.337 3.270 1.00 41.12 ? 316 GLY A N 1 ATOM 130 C CA . GLY A 1 16 ? -59.489 0.524 2.289 1.00 43.85 ? 316 GLY A CA 1 ATOM 131 C C . GLY A 1 16 ? -59.224 1.746 1.424 1.00 43.14 ? 316 GLY A C 1 ATOM 132 O O . GLY A 1 16 ? -58.068 2.120 1.179 1.00 42.36 ? 316 GLY A O 1 ATOM 133 N N . GLN A 1 17 ? -60.296 2.374 0.956 1.00 43.68 ? 317 GLN A N 1 ATOM 134 C CA . GLN A 1 17 ? -60.170 3.585 0.148 1.00 44.06 ? 317 GLN A CA 1 ATOM 135 C C . GLN A 1 17 ? -61.379 4.490 0.355 1.00 41.80 ? 317 GLN A C 1 ATOM 136 O O . GLN A 1 17 ? -62.448 4.029 0.763 1.00 42.16 ? 317 GLN A O 1 ATOM 137 C CB . GLN A 1 17 ? -59.972 3.240 -1.333 1.00 48.02 ? 317 GLN A CB 1 ATOM 138 C CG . GLN A 1 17 ? -61.165 2.584 -2.001 1.00 43.43 ? 317 GLN A CG 1 ATOM 139 C CD . GLN A 1 17 ? -60.818 2.010 -3.366 1.00 55.30 ? 317 GLN A CD 1 ATOM 140 O OE1 . GLN A 1 17 ? -61.419 2.373 -4.380 1.00 62.56 ? 317 GLN A OE1 1 ATOM 141 N NE2 . GLN A 1 17 ? -59.837 1.117 -3.398 1.00 57.62 ? 317 GLN A NE2 1 ATOM 142 N N . VAL A 1 18 ? -61.213 5.781 0.086 1.00 38.01 ? 318 VAL A N 1 ATOM 143 C CA . VAL A 1 18 ? -62.277 6.726 0.396 1.00 40.25 ? 318 VAL A CA 1 ATOM 144 C C . VAL A 1 18 ? -62.319 7.857 -0.625 1.00 38.09 ? 318 VAL A C 1 ATOM 145 O O . VAL A 1 18 ? -61.318 8.159 -1.281 1.00 39.91 ? 318 VAL A O 1 ATOM 146 C CB . VAL A 1 18 ? -62.111 7.289 1.844 1.00 40.06 ? 318 VAL A CB 1 ATOM 147 C CG1 . VAL A 1 18 ? -60.894 8.161 1.926 1.00 29.49 ? 318 VAL A CG1 1 ATOM 148 C CG2 . VAL A 1 18 ? -63.349 8.054 2.301 1.00 38.57 ? 318 VAL A CG2 1 ATOM 149 N N . THR A 1 19 ? -63.486 8.478 -0.752 1.00 39.54 ? 319 THR A N 1 ATOM 150 C CA . THR A 1 19 ? -63.657 9.626 -1.631 1.00 43.05 ? 319 THR A CA 1 ATOM 151 C C . THR A 1 19 ? -64.242 10.806 -0.869 1.00 39.63 ? 319 THR A C 1 ATOM 152 O O . THR A 1 19 ? -65.348 10.724 -0.326 1.00 40.89 ? 319 THR A O 1 ATOM 153 C CB . THR A 1 19 ? -64.578 9.298 -2.830 1.00 42.00 ? 319 THR A CB 1 ATOM 154 O OG1 . THR A 1 19 ? -63.906 8.393 -3.714 1.00 47.33 ? 319 THR A OG1 1 ATOM 155 C CG2 . THR A 1 19 ? -64.939 10.570 -3.592 1.00 42.73 ? 319 THR A CG2 1 ATOM 156 N N . LEU A 1 20 ? -63.502 11.908 -0.838 1.00 35.82 ? 320 LEU A N 1 ATOM 157 C CA . LEU A 1 20 ? -64.004 13.127 -0.220 1.00 40.31 ? 320 LEU A CA 1 ATOM 158 C C . LEU A 1 20 ? -64.573 14.026 -1.317 1.00 38.28 ? 320 LEU A C 1 ATOM 159 O O . LEU A 1 20 ? -63.955 14.196 -2.371 1.00 33.82 ? 320 LEU A O 1 ATOM 160 C CB . LEU A 1 20 ? -62.886 13.831 0.554 1.00 40.19 ? 320 LEU A CB 1 ATOM 161 C CG . LEU A 1 20 ? -61.987 12.894 1.373 1.00 38.50 ? 320 LEU A CG 1 ATOM 162 C CD1 . LEU A 1 20 ? -60.931 13.648 2.180 1.00 38.23 ? 320 LEU A CD1 1 ATOM 163 C CD2 . LEU A 1 20 ? -62.831 12.027 2.289 1.00 32.98 ? 320 LEU A CD2 1 ATOM 164 N N . VAL A 1 21 ? -65.757 14.583 -1.081 1.00 37.46 ? 321 VAL A N 1 ATOM 165 C CA . VAL A 1 21 ? -66.436 15.377 -2.104 1.00 42.59 ? 321 VAL A CA 1 ATOM 166 C C . VAL A 1 21 ? -66.901 16.757 -1.611 1.00 41.68 ? 321 VAL A C 1 ATOM 167 O O . VAL A 1 21 ? -67.664 16.863 -0.651 1.00 42.56 ? 321 VAL A O 1 ATOM 168 C CB . VAL A 1 21 ? -67.643 14.612 -2.709 1.00 46.01 ? 321 VAL A CB 1 ATOM 169 C CG1 . VAL A 1 21 ? -67.188 13.313 -3.366 1.00 41.56 ? 321 VAL A CG1 1 ATOM 170 C CG2 . VAL A 1 21 ? -68.678 14.319 -1.644 1.00 50.26 ? 321 VAL A CG2 1 ATOM 171 N N . CYS A 1 22 ? -66.436 17.807 -2.283 1.00 42.28 ? 322 CYS A N 1 ATOM 172 C CA . CYS A 1 22 ? -66.880 19.178 -2.003 1.00 48.80 ? 322 CYS A CA 1 ATOM 173 C C . CYS A 1 22 ? -67.770 19.715 -3.134 1.00 52.82 ? 322 CYS A C 1 ATOM 174 O O . CYS A 1 22 ? -67.336 19.797 -4.283 1.00 50.87 ? 322 CYS A O 1 ATOM 175 C CB . CYS A 1 22 ? -65.664 20.100 -1.814 1.00 44.99 ? 322 CYS A CB 1 ATOM 176 S SG . CYS A 1 22 ? -66.025 21.747 -1.130 1.00 49.19 ? 322 CYS A SG 1 ATOM 177 N N . ASP A 1 23 ? -69.011 20.080 -2.809 1.00 55.35 ? 323 ASP A N 1 ATOM 178 C CA . ASP A 1 23 ? -69.924 20.677 -3.789 1.00 56.83 ? 323 ASP A CA 1 ATOM 179 C C . ASP A 1 23 ? -70.099 22.181 -3.530 1.00 56.57 ? 323 ASP A C 1 ATOM 180 O O . ASP A 1 23 ? -70.450 22.589 -2.422 1.00 52.45 ? 323 ASP A O 1 ATOM 181 C CB . ASP A 1 23 ? -71.300 19.991 -3.752 1.00 59.48 ? 323 ASP A CB 1 ATOM 182 C CG . ASP A 1 23 ? -71.250 18.519 -4.156 1.00 60.50 ? 323 ASP A CG 1 ATOM 183 O OD1 . ASP A 1 23 ? -70.390 18.137 -4.978 1.00 58.12 ? 323 ASP A OD1 1 ATOM 184 O OD2 . ASP A 1 23 ? -72.094 17.741 -3.656 1.00 61.24 ? 323 ASP A OD2 1 ATOM 185 N N . ALA A 1 24 ? -69.877 23.004 -4.551 1.00 60.18 ? 324 ALA A N 1 ATOM 186 C CA . ALA A 1 24 ? -69.955 24.457 -4.382 1.00 60.76 ? 324 ALA A CA 1 ATOM 187 C C . ALA A 1 24 ? -70.691 25.170 -5.519 1.00 64.38 ? 324 ALA A C 1 ATOM 188 O O . ALA A 1 24 ? -70.462 24.881 -6.694 1.00 65.26 ? 324 ALA A O 1 ATOM 189 C CB . ALA A 1 24 ? -68.559 25.042 -4.215 1.00 58.90 ? 324 ALA A CB 1 ATOM 190 N N . GLU A 1 25 ? -71.562 26.110 -5.160 1.00 62.61 ? 325 GLU A N 1 ATOM 191 C CA . GLU A 1 25 ? -72.274 26.936 -6.138 1.00 61.14 ? 325 GLU A CA 1 ATOM 192 C C . GLU A 1 25 ? -71.525 28.234 -6.411 1.00 67.76 ? 325 GLU A C 1 ATOM 193 O O . GLU A 1 25 ? -70.565 28.558 -5.713 1.00 65.44 ? 325 GLU A O 1 ATOM 194 C CB . GLU A 1 25 ? -73.669 27.285 -5.623 1.00 53.13 ? 325 GLU A CB 1 ATOM 195 C CG . GLU A 1 25 ? -74.692 26.178 -5.743 1.00 54.03 ? 325 GLU A CG 1 ATOM 196 C CD . GLU A 1 25 ? -75.934 26.468 -4.930 1.00 51.72 ? 325 GLU A CD 1 ATOM 197 O OE1 . GLU A 1 25 ? -76.961 25.786 -5.144 1.00 51.53 ? 325 GLU A OE1 1 ATOM 198 O OE2 . GLU A 1 25 ? -75.876 27.379 -4.074 1.00 45.41 ? 325 GLU A OE2 1 ATOM 199 N N . GLY A 1 26 ? -71.975 28.981 -7.417 1.00 78.46 ? 326 GLY A N 1 ATOM 200 C CA . GLY A 1 26 ? -71.435 30.304 -7.682 1.00 72.48 ? 326 GLY A CA 1 ATOM 201 C C . GLY A 1 26 ? -71.186 30.642 -9.143 1.00 74.60 ? 326 GLY A C 1 ATOM 202 O O . GLY A 1 26 ? -70.808 29.786 -9.946 1.00 74.52 ? 326 GLY A O 1 ATOM 203 N N . GLU A 1 27 ? -71.392 31.911 -9.482 1.00 74.86 ? 327 GLU A N 1 ATOM 204 C CA . GLU A 1 27 ? -71.122 32.407 -10.827 1.00 75.57 ? 327 GLU A CA 1 ATOM 205 C C . GLU A 1 27 ? -70.153 33.586 -10.744 1.00 68.25 ? 327 GLU A C 1 ATOM 206 O O . GLU A 1 27 ? -70.430 34.573 -10.056 1.00 69.66 ? 327 GLU A O 1 ATOM 207 C CB . GLU A 1 27 ? -72.424 32.834 -11.506 1.00 81.24 ? 327 GLU A CB 1 ATOM 208 C CG . GLU A 1 27 ? -73.611 31.907 -11.233 1.00 102.53 ? 327 GLU A CG 1 ATOM 209 C CD . GLU A 1 27 ? -73.524 30.588 -11.985 1.00 116.72 ? 327 GLU A CD 1 ATOM 210 O OE1 . GLU A 1 27 ? -74.173 29.608 -11.555 1.00 93.99 ? 327 GLU A OE1 1 ATOM 211 O OE2 . GLU A 1 27 ? -72.808 30.534 -13.008 1.00 118.40 ? 327 GLU A OE2 1 ATOM 212 N N . PRO A 1 28 ? -68.999 33.486 -11.428 1.00 64.90 ? 328 PRO A N 1 ATOM 213 C CA . PRO A 1 28 ? -68.563 32.369 -12.275 1.00 67.76 ? 328 PRO A CA 1 ATOM 214 C C . PRO A 1 28 ? -68.406 31.076 -11.488 1.00 68.87 ? 328 PRO A C 1 ATOM 215 O O . PRO A 1 28 ? -68.359 31.084 -10.256 1.00 68.57 ? 328 PRO A O 1 ATOM 216 C CB . PRO A 1 28 ? -67.178 32.812 -12.769 1.00 66.25 ? 328 PRO A CB 1 ATOM 217 C CG . PRO A 1 28 ? -67.084 34.266 -12.474 1.00 68.03 ? 328 PRO A CG 1 ATOM 218 C CD . PRO A 1 28 ? -67.939 34.496 -11.274 1.00 67.96 ? 328 PRO A CD 1 ATOM 219 N N . ILE A 1 29 ? -68.312 29.971 -12.214 1.00 70.22 ? 329 ILE A N 1 ATOM 220 C CA . ILE A 1 29 ? -68.167 28.664 -11.604 1.00 69.21 ? 329 ILE A CA 1 ATOM 221 C C . ILE A 1 29 ? -66.893 28.601 -10.771 1.00 65.65 ? 329 ILE A C 1 ATOM 222 O O . ILE A 1 29 ? -65.788 28.770 -11.296 1.00 66.02 ? 329 ILE A O 1 ATOM 223 C CB . ILE A 1 29 ? -68.154 27.559 -12.667 1.00 70.32 ? 329 ILE A CB 1 ATOM 224 C CG1 . ILE A 1 29 ? -69.486 27.540 -13.424 1.00 75.65 ? 329 ILE A CG1 1 ATOM 225 C CG2 . ILE A 1 29 ? -67.865 26.213 -12.029 1.00 69.62 ? 329 ILE A CG2 1 ATOM 226 C CD1 . ILE A 1 29 ? -70.704 27.389 -12.530 1.00 73.87 ? 329 ILE A CD1 1 ATOM 227 N N . PRO A 1 30 ? -67.055 28.360 -9.460 1.00 66.98 ? 330 PRO A N 1 ATOM 228 C CA . PRO A 1 30 ? -65.997 28.309 -8.445 1.00 61.11 ? 330 PRO A CA 1 ATOM 229 C C . PRO A 1 30 ? -64.904 27.293 -8.746 1.00 58.48 ? 330 PRO A C 1 ATOM 230 O O . PRO A 1 30 ? -65.187 26.220 -9.274 1.00 57.87 ? 330 PRO A O 1 ATOM 231 C CB . PRO A 1 30 ? -66.750 27.888 -7.176 1.00 59.13 ? 330 PRO A CB 1 ATOM 232 C CG . PRO A 1 30 ? -68.149 28.317 -7.403 1.00 65.22 ? 330 PRO A CG 1 ATOM 233 C CD . PRO A 1 30 ? -68.390 28.150 -8.872 1.00 66.37 ? 330 PRO A CD 1 ATOM 234 N N . GLU A 1 31 ? -63.667 27.643 -8.403 1.00 55.81 ? 331 GLU A N 1 ATOM 235 C CA . GLU A 1 31 ? -62.547 26.714 -8.455 1.00 59.74 ? 331 GLU A CA 1 ATOM 236 C C . GLU A 1 31 ? -62.307 26.149 -7.040 1.00 61.18 ? 331 GLU A C 1 ATOM 237 O O . GLU A 1 31 ? -62.525 26.842 -6.045 1.00 56.13 ? 331 GLU A O 1 ATOM 238 C CB . GLU A 1 31 ? -61.311 27.437 -8.988 1.00 62.23 ? 331 GLU A CB 1 ATOM 239 C CG . GLU A 1 31 ? -60.146 26.536 -9.333 1.00 69.06 ? 331 GLU A CG 1 ATOM 240 C CD . GLU A 1 31 ? -59.193 26.348 -8.170 1.00 89.24 ? 331 GLU A CD 1 ATOM 241 O OE1 . GLU A 1 31 ? -59.053 25.204 -7.688 1.00 91.15 ? 331 GLU A OE1 1 ATOM 242 O OE2 . GLU A 1 31 ? -58.585 27.349 -7.735 1.00 97.03 ? 331 GLU A OE2 1 ATOM 243 N N . ILE A 1 32 ? -61.878 24.893 -6.940 1.00 61.90 ? 332 ILE A N 1 ATOM 244 C CA . ILE A 1 32 ? -61.831 24.220 -5.638 1.00 58.38 ? 332 ILE A CA 1 ATOM 245 C C . ILE A 1 32 ? -60.482 23.603 -5.265 1.00 59.78 ? 332 ILE A C 1 ATOM 246 O O . ILE A 1 32 ? -59.860 22.901 -6.065 1.00 61.49 ? 332 ILE A O 1 ATOM 247 C CB . ILE A 1 32 ? -62.911 23.139 -5.528 1.00 53.94 ? 332 ILE A CB 1 ATOM 248 C CG1 . ILE A 1 32 ? -64.296 23.762 -5.716 1.00 56.70 ? 332 ILE A CG1 1 ATOM 249 C CG2 . ILE A 1 32 ? -62.813 22.436 -4.187 1.00 54.96 ? 332 ILE A CG2 1 ATOM 250 C CD1 . ILE A 1 32 ? -65.442 22.815 -5.431 1.00 56.74 ? 332 ILE A CD1 1 ATOM 251 N N . THR A 1 33 ? -60.054 23.858 -4.031 1.00 57.21 ? 333 THR A N 1 ATOM 252 C CA . THR A 1 33 ? -58.761 23.385 -3.545 1.00 56.30 ? 333 THR A CA 1 ATOM 253 C C . THR A 1 33 ? -58.874 22.643 -2.203 1.00 51.53 ? 333 THR A C 1 ATOM 254 O O . THR A 1 33 ? -59.620 23.062 -1.316 1.00 47.08 ? 333 THR A O 1 ATOM 255 C CB . THR A 1 33 ? -57.790 24.567 -3.385 1.00 60.76 ? 333 THR A CB 1 ATOM 256 O OG1 . THR A 1 33 ? -58.002 25.511 -4.444 1.00 72.81 ? 333 THR A OG1 1 ATOM 257 C CG2 . THR A 1 33 ? -56.355 24.087 -3.420 1.00 59.43 ? 333 THR A CG2 1 ATOM 258 N N . TRP A 1 34 ? -58.130 21.547 -2.056 1.00 49.64 ? 334 TRP A N 1 ATOM 259 C CA . TRP A 1 34 ? -58.135 20.778 -0.809 1.00 46.10 ? 334 TRP A CA 1 ATOM 260 C C . TRP A 1 34 ? -56.864 21.027 -0.012 1.00 44.91 ? 334 TRP A C 1 ATOM 261 O O . TRP A 1 34 ? -55.774 21.059 -0.584 1.00 48.29 ? 334 TRP A O 1 ATOM 262 C CB . TRP A 1 34 ? -58.209 19.276 -1.086 1.00 45.11 ? 334 TRP A CB 1 ATOM 263 C CG . TRP A 1 34 ? -59.474 18.779 -1.703 1.00 42.48 ? 334 TRP A CG 1 ATOM 264 C CD1 . TRP A 1 34 ? -59.729 18.628 -3.033 1.00 42.85 ? 334 TRP A CD1 1 ATOM 265 C CD2 . TRP A 1 34 ? -60.644 18.319 -1.016 1.00 41.82 ? 334 TRP A CD2 1 ATOM 266 N NE1 . TRP A 1 34 ? -60.992 18.123 -3.220 1.00 44.90 ? 334 TRP A NE1 1 ATOM 267 C CE2 . TRP A 1 34 ? -61.574 17.923 -1.997 1.00 42.10 ? 334 TRP A CE2 1 ATOM 268 C CE3 . TRP A 1 34 ? -60.997 18.211 0.329 1.00 42.07 ? 334 TRP A CE3 1 ATOM 269 C CZ2 . TRP A 1 34 ? -62.831 17.426 -1.675 1.00 38.07 ? 334 TRP A CZ2 1 ATOM 270 C CZ3 . TRP A 1 34 ? -62.247 17.721 0.647 1.00 38.91 ? 334 TRP A CZ3 1 ATOM 271 C CH2 . TRP A 1 34 ? -63.152 17.336 -0.352 1.00 39.35 ? 334 TRP A CH2 1 ATOM 272 N N . LYS A 1 35 ? -57.000 21.181 1.306 1.00 35.27 ? 335 LYS A N 1 ATOM 273 C CA . LYS A 1 35 ? -55.832 21.220 2.191 1.00 49.37 ? 335 LYS A CA 1 ATOM 274 C C . LYS A 1 35 ? -55.907 20.190 3.330 1.00 44.47 ? 335 LYS A C 1 ATOM 275 O O . LYS A 1 35 ? -56.896 20.120 4.060 1.00 38.73 ? 335 LYS A O 1 ATOM 276 C CB . LYS A 1 35 ? -55.628 22.618 2.783 1.00 48.20 ? 335 LYS A CB 1 ATOM 277 C CG . LYS A 1 35 ? -54.517 22.667 3.835 1.00 57.18 ? 335 LYS A CG 1 ATOM 278 C CD . LYS A 1 35 ? -54.448 24.014 4.539 1.00 67.66 ? 335 LYS A CD 1 ATOM 279 C CE . LYS A 1 35 ? -54.073 25.129 3.578 1.00 80.67 ? 335 LYS A CE 1 ATOM 280 N NZ . LYS A 1 35 ? -54.050 26.453 4.259 1.00 87.26 ? 335 LYS A NZ 1 ATOM 281 N N . ARG A 1 36 ? -54.851 19.403 3.491 1.00 46.75 ? 336 ARG A N 1 ATOM 282 C CA . ARG A 1 36 ? -54.807 18.429 4.574 1.00 47.02 ? 336 ARG A CA 1 ATOM 283 C C . ARG A 1 36 ? -54.293 19.075 5.851 1.00 49.27 ? 336 ARG A C 1 ATOM 284 O O . ARG A 1 36 ? -53.129 19.460 5.943 1.00 49.15 ? 336 ARG A O 1 ATOM 285 C CB . ARG A 1 36 ? -53.939 17.233 4.194 1.00 45.65 ? 336 ARG A CB 1 ATOM 286 C CG . ARG A 1 36 ? -53.992 16.088 5.187 1.00 46.73 ? 336 ARG A CG 1 ATOM 287 C CD . ARG A 1 36 ? -53.309 14.860 4.619 1.00 47.89 ? 336 ARG A CD 1 ATOM 288 N NE . ARG A 1 36 ? -51.938 15.152 4.216 1.00 51.00 ? 336 ARG A NE 1 ATOM 289 C CZ . ARG A 1 36 ? -51.266 14.464 3.300 1.00 52.57 ? 336 ARG A CZ 1 ATOM 290 N NH1 . ARG A 1 36 ? -51.841 13.446 2.676 1.00 51.49 ? 336 ARG A NH1 1 ATOM 291 N NH2 . ARG A 1 36 ? -50.018 14.799 3.004 1.00 50.84 ? 336 ARG A NH2 1 ATOM 292 N N . ALA A 1 37 ? -55.175 19.180 6.837 1.00 47.71 ? 337 ALA A N 1 ATOM 293 C CA . ALA A 1 37 ? -54.892 19.920 8.060 1.00 48.65 ? 337 ALA A CA 1 ATOM 294 C C . ALA A 1 37 ? -53.555 19.569 8.718 1.00 55.86 ? 337 ALA A C 1 ATOM 295 O O . ALA A 1 37 ? -52.811 20.457 9.136 1.00 57.90 ? 337 ALA A O 1 ATOM 296 C CB . ALA A 1 37 ? -56.033 19.740 9.051 1.00 40.17 ? 337 ALA A CB 1 ATOM 297 N N . VAL A 1 38 ? -53.252 18.278 8.810 1.00 55.21 ? 338 VAL A N 1 ATOM 298 C CA . VAL A 1 38 ? -52.094 17.827 9.579 1.00 57.14 ? 338 VAL A CA 1 ATOM 299 C C . VAL A 1 38 ? -50.756 18.449 9.158 1.00 62.47 ? 338 VAL A C 1 ATOM 300 O O . VAL A 1 38 ? -50.009 18.953 9.991 1.00 64.67 ? 338 VAL A O 1 ATOM 301 C CB . VAL A 1 38 ? -51.964 16.304 9.551 1.00 59.51 ? 338 VAL A CB 1 ATOM 302 C CG1 . VAL A 1 38 ? -51.998 15.798 8.118 1.00 61.40 ? 338 VAL A CG1 1 ATOM 303 C CG2 . VAL A 1 38 ? -50.681 15.885 10.235 1.00 62.81 ? 338 VAL A CG2 1 ATOM 304 N N . ASP A 1 39 ? -50.455 18.405 7.867 1.00 60.96 ? 339 ASP A N 1 ATOM 305 C CA . ASP A 1 39 ? -49.196 18.943 7.363 1.00 62.02 ? 339 ASP A CA 1 ATOM 306 C C . ASP A 1 39 ? -49.454 20.114 6.425 1.00 62.95 ? 339 ASP A C 1 ATOM 307 O O . ASP A 1 39 ? -48.521 20.726 5.901 1.00 66.37 ? 339 ASP A O 1 ATOM 308 C CB . ASP A 1 39 ? -48.415 17.854 6.631 1.00 65.48 ? 339 ASP A CB 1 ATOM 309 C CG . ASP A 1 39 ? -49.254 17.138 5.589 1.00 63.29 ? 339 ASP A CG 1 ATOM 310 O OD1 . ASP A 1 39 ? -50.366 17.618 5.277 1.00 61.94 ? 339 ASP A OD1 1 ATOM 311 O OD2 . ASP A 1 39 ? -48.801 16.094 5.079 1.00 64.98 ? 339 ASP A OD2 1 ATOM 312 N N . GLY A 1 40 ? -50.730 20.412 6.208 1.00 62.40 ? 340 GLY A N 1 ATOM 313 C CA . GLY A 1 40 ? -51.120 21.562 5.418 1.00 60.68 ? 340 GLY A CA 1 ATOM 314 C C . GLY A 1 40 ? -50.878 21.420 3.929 1.00 63.37 ? 340 GLY A C 1 ATOM 315 O O . GLY A 1 40 ? -50.831 22.420 3.208 1.00 65.81 ? 340 GLY A O 1 ATOM 316 N N . PHE A 1 41 ? -50.724 20.187 3.454 1.00 62.47 ? 341 PHE A N 1 ATOM 317 C CA . PHE A 1 41 ? -50.564 19.977 2.020 1.00 63.49 ? 341 PHE A CA 1 ATOM 318 C C . PHE A 1 41 ? -51.820 20.381 1.263 1.00 57.90 ? 341 PHE A C 1 ATOM 319 O O . PHE A 1 41 ? -52.932 20.286 1.779 1.00 55.70 ? 341 PHE A O 1 ATOM 320 C CB . PHE A 1 41 ? -50.167 18.534 1.689 1.00 65.82 ? 341 PHE A CB 1 ATOM 321 C CG . PHE A 1 41 ? -48.741 18.208 2.025 1.00 74.20 ? 341 PHE A CG 1 ATOM 322 C CD1 . PHE A 1 41 ? -47.847 19.214 2.357 1.00 77.98 ? 341 PHE A CD1 1 ATOM 323 C CD2 . PHE A 1 41 ? -48.286 16.901 1.988 1.00 79.42 ? 341 PHE A CD2 1 ATOM 324 C CE1 . PHE A 1 41 ? -46.531 18.921 2.669 1.00 81.24 ? 341 PHE A CE1 1 ATOM 325 C CE2 . PHE A 1 41 ? -46.967 16.599 2.296 1.00 82.46 ? 341 PHE A CE2 1 ATOM 326 C CZ . PHE A 1 41 ? -46.088 17.612 2.637 1.00 79.90 ? 341 PHE A CZ 1 ATOM 327 N N . THR A 1 42 ? -51.626 20.842 0.034 1.00 55.81 ? 342 THR A N 1 ATOM 328 C CA . THR A 1 42 ? -52.723 21.326 -0.780 1.00 57.35 ? 342 THR A CA 1 ATOM 329 C C . THR A 1 42 ? -52.869 20.473 -2.034 1.00 57.43 ? 342 THR A C 1 ATOM 330 O O . THR A 1 42 ? -51.878 19.983 -2.574 1.00 61.34 ? 342 THR A O 1 ATOM 331 C CB . THR A 1 42 ? -52.498 22.793 -1.161 1.00 60.32 ? 342 THR A CB 1 ATOM 332 O OG1 . THR A 1 42 ? -52.642 23.610 0.007 1.00 59.72 ? 342 THR A OG1 1 ATOM 333 C CG2 . THR A 1 42 ? -53.497 23.234 -2.211 1.00 66.16 ? 342 THR A CG2 1 ATOM 334 N N . PHE A 1 43 ? -54.105 20.287 -2.490 1.00 55.95 ? 343 PHE A N 1 ATOM 335 C CA . PHE A 1 43 ? -54.370 19.450 -3.657 1.00 58.97 ? 343 PHE A CA 1 ATOM 336 C C . PHE A 1 43 ? -55.380 20.094 -4.605 1.00 57.62 ? 343 PHE A C 1 ATOM 337 O O . PHE A 1 43 ? -56.362 20.698 -4.164 1.00 55.68 ? 343 PHE A O 1 ATOM 338 C CB . PHE A 1 43 ? -54.886 18.072 -3.223 1.00 56.55 ? 343 PHE A CB 1 ATOM 339 C CG . PHE A 1 43 ? -53.901 17.281 -2.411 1.00 59.64 ? 343 PHE A CG 1 ATOM 340 C CD1 . PHE A 1 43 ? -53.077 16.349 -3.017 1.00 61.45 ? 343 PHE A CD1 1 ATOM 341 C CD2 . PHE A 1 43 ? -53.800 17.466 -1.040 1.00 57.35 ? 343 PHE A CD2 1 ATOM 342 C CE1 . PHE A 1 43 ? -52.163 15.619 -2.275 1.00 61.89 ? 343 PHE A CE1 1 ATOM 343 C CE2 . PHE A 1 43 ? -52.891 16.739 -0.293 1.00 62.19 ? 343 PHE A CE2 1 ATOM 344 C CZ . PHE A 1 43 ? -52.072 15.814 -0.912 1.00 64.10 ? 343 PHE A CZ 1 ATOM 345 N N . THR A 1 44 ? -55.116 19.965 -5.904 1.00 62.68 ? 344 THR A N 1 ATOM 346 C CA . THR A 1 44 ? -56.069 20.308 -6.960 1.00 62.83 ? 344 THR A CA 1 ATOM 347 C C . THR A 1 44 ? -55.879 19.352 -8.132 1.00 62.95 ? 344 THR A C 1 ATOM 348 O O . THR A 1 44 ? -55.074 18.420 -8.055 1.00 62.80 ? 344 THR A O 1 ATOM 349 C CB . THR A 1 44 ? -55.915 21.761 -7.467 1.00 68.63 ? 344 THR A CB 1 ATOM 350 O OG1 . THR A 1 44 ? -54.553 22.182 -7.325 1.00 67.16 ? 344 THR A OG1 1 ATOM 351 C CG2 . THR A 1 44 ? -56.817 22.707 -6.689 1.00 64.02 ? 344 THR A CG2 1 ATOM 352 N N . GLU A 1 45 ? -56.611 19.599 -9.215 1.00 67.05 ? 345 GLU A N 1 ATOM 353 C CA . GLU A 1 45 ? -56.589 18.746 -10.404 1.00 66.21 ? 345 GLU A CA 1 ATOM 354 C C . GLU A 1 45 ? -55.215 18.157 -10.709 1.00 62.10 ? 345 GLU A C 1 ATOM 355 O O . GLU A 1 45 ? -54.908 17.030 -10.319 1.00 59.07 ? 345 GLU A O 1 ATOM 356 C CB . GLU A 1 45 ? -57.078 19.537 -11.612 1.00 73.05 ? 345 GLU A CB 1 ATOM 357 C CG . GLU A 1 45 ? -58.202 20.504 -11.299 1.00 84.65 ? 345 GLU A CG 1 ATOM 358 C CD . GLU A 1 45 ? -59.368 19.836 -10.603 1.00 81.76 ? 345 GLU A CD 1 ATOM 359 O OE1 . GLU A 1 45 ? -59.256 19.541 -9.392 1.00 72.08 ? 345 GLU A OE1 1 ATOM 360 O OE2 . GLU A 1 45 ? -60.402 19.619 -11.269 1.00 78.68 ? 345 GLU A OE2 1 ATOM 361 N N . LYS A 1 48 ? -51.294 14.878 -8.739 1.00 75.94 ? 348 LYS A N 1 ATOM 362 C CA . LYS A 1 48 ? -50.359 14.047 -7.983 1.00 81.02 ? 348 LYS A CA 1 ATOM 363 C C . LYS A 1 48 ? -51.140 12.968 -7.206 1.00 82.71 ? 348 LYS A C 1 ATOM 364 O O . LYS A 1 48 ? -52.279 12.692 -7.583 1.00 86.11 ? 348 LYS A O 1 ATOM 365 C CB . LYS A 1 48 ? -49.464 14.931 -7.110 1.00 84.25 ? 348 LYS A CB 1 ATOM 366 C CG . LYS A 1 48 ? -48.052 15.119 -7.664 1.00 83.21 ? 348 LYS A CG 1 ATOM 367 C CD . LYS A 1 48 ? -48.036 15.912 -8.963 1.00 85.62 ? 348 LYS A CD 1 ATOM 368 C CE . LYS A 1 48 ? -46.613 16.077 -9.481 1.00 75.11 ? 348 LYS A CE 1 ATOM 369 N NZ . LYS A 1 48 ? -46.525 17.071 -10.588 1.00 76.89 ? 348 LYS A NZ 1 ATOM 370 N N . SER A 1 49 ? -50.589 12.351 -6.150 1.00 81.33 ? 349 SER A N 1 ATOM 371 C CA . SER A 1 49 ? -49.319 12.709 -5.517 1.00 81.72 ? 349 SER A CA 1 ATOM 372 C C . SER A 1 49 ? -48.210 11.676 -5.677 1.00 82.85 ? 349 SER A C 1 ATOM 373 O O . SER A 1 49 ? -48.309 10.739 -6.474 1.00 81.33 ? 349 SER A O 1 ATOM 374 C CB . SER A 1 49 ? -49.527 12.957 -4.025 1.00 78.34 ? 349 SER A CB 1 ATOM 375 O OG . SER A 1 49 ? -49.634 11.725 -3.334 1.00 76.49 ? 349 SER A OG 1 ATOM 376 N N . LEU A 1 50 ? -47.157 11.863 -4.888 1.00 86.58 ? 350 LEU A N 1 ATOM 377 C CA . LEU A 1 50 ? -45.966 11.024 -4.952 1.00 92.05 ? 350 LEU A CA 1 ATOM 378 C C . LEU A 1 50 ? -46.288 9.536 -4.891 1.00 91.25 ? 350 LEU A C 1 ATOM 379 O O . LEU A 1 50 ? -46.270 8.847 -5.911 1.00 95.74 ? 350 LEU A O 1 ATOM 380 C CB . LEU A 1 50 ? -44.999 11.394 -3.827 1.00 86.67 ? 350 LEU A CB 1 ATOM 381 C CG . LEU A 1 50 ? -44.398 12.794 -3.918 1.00 92.52 ? 350 LEU A CG 1 ATOM 382 C CD1 . LEU A 1 50 ? -43.472 13.062 -2.738 1.00 79.04 ? 350 LEU A CD1 1 ATOM 383 C CD2 . LEU A 1 50 ? -43.664 12.955 -5.242 1.00 89.89 ? 350 LEU A CD2 1 ATOM 384 N N . ASP A 1 51 ? -46.577 9.046 -3.691 1.00 87.60 ? 351 ASP A N 1 ATOM 385 C CA . ASP A 1 51 ? -46.888 7.635 -3.498 1.00 85.30 ? 351 ASP A CA 1 ATOM 386 C C . ASP A 1 51 ? -48.037 7.193 -4.395 1.00 84.43 ? 351 ASP A C 1 ATOM 387 O O . ASP A 1 51 ? -48.248 5.999 -4.594 1.00 86.67 ? 351 ASP A O 1 ATOM 388 C CB . ASP A 1 51 ? -47.219 7.349 -2.033 1.00 81.16 ? 351 ASP A CB 1 ATOM 389 C CG . ASP A 1 51 ? -48.430 8.122 -1.543 1.00 78.68 ? 351 ASP A CG 1 ATOM 390 O OD1 . ASP A 1 51 ? -49.053 8.843 -2.353 1.00 81.98 ? 351 ASP A OD1 1 ATOM 391 O OD2 . ASP A 1 51 ? -48.757 8.007 -0.343 1.00 72.70 ? 351 ASP A OD2 1 ATOM 392 N N . GLY A 1 52 ? -48.780 8.161 -4.928 1.00 82.72 ? 352 GLY A N 1 ATOM 393 C CA . GLY A 1 52 ? -49.857 7.877 -5.860 1.00 82.53 ? 352 GLY A CA 1 ATOM 394 C C . GLY A 1 52 ? -51.116 7.349 -5.200 1.00 76.59 ? 352 GLY A C 1 ATOM 395 O O . GLY A 1 52 ? -52.054 6.921 -5.873 1.00 75.87 ? 352 GLY A O 1 ATOM 396 N N . ARG A 1 53 ? -51.142 7.379 -3.874 1.00 76.01 ? 353 ARG A N 1 ATOM 397 C CA . ARG A 1 53 ? -52.303 6.906 -3.136 1.00 71.31 ? 353 ARG A CA 1 ATOM 398 C C . ARG A 1 53 ? -53.441 7.914 -3.221 1.00 65.87 ? 353 ARG A C 1 ATOM 399 O O . ARG A 1 53 ? -54.614 7.547 -3.275 1.00 61.09 ? 353 ARG A O 1 ATOM 400 C CB . ARG A 1 53 ? -51.931 6.657 -1.677 1.00 68.25 ? 353 ARG A CB 1 ATOM 401 C CG . ARG A 1 53 ? -50.967 5.501 -1.470 1.00 67.39 ? 353 ARG A CG 1 ATOM 402 C CD . ARG A 1 53 ? -50.616 5.358 -0.005 1.00 70.48 ? 353 ARG A CD 1 ATOM 403 N NE . ARG A 1 53 ? -51.758 5.707 0.831 1.00 65.86 ? 353 ARG A NE 1 ATOM 404 C CZ . ARG A 1 53 ? -51.840 6.813 1.563 1.00 60.90 ? 353 ARG A CZ 1 ATOM 405 N NH1 . ARG A 1 53 ? -50.835 7.682 1.587 1.00 62.62 ? 353 ARG A NH1 1 ATOM 406 N NH2 . ARG A 1 53 ? -52.925 7.041 2.284 1.00 53.64 ? 353 ARG A NH2 1 ATOM 407 N N . ILE A 1 54 ? -53.081 9.190 -3.231 1.00 69.99 ? 354 ILE A N 1 ATOM 408 C CA . ILE A 1 54 ? -54.063 10.262 -3.255 1.00 68.32 ? 354 ILE A CA 1 ATOM 409 C C . ILE A 1 54 ? -54.077 10.975 -4.607 1.00 76.97 ? 354 ILE A C 1 ATOM 410 O O . ILE A 1 54 ? -53.028 11.362 -5.127 1.00 74.91 ? 354 ILE A O 1 ATOM 411 C CB . ILE A 1 54 ? -53.801 11.271 -2.114 1.00 65.90 ? 354 ILE A CB 1 ATOM 412 C CG1 . ILE A 1 54 ? -54.414 12.631 -2.441 1.00 62.39 ? 354 ILE A CG1 1 ATOM 413 C CG2 . ILE A 1 54 ? -52.314 11.425 -1.881 1.00 70.62 ? 354 ILE A CG2 1 ATOM 414 C CD1 . ILE A 1 54 ? -55.901 12.592 -2.651 1.00 58.69 ? 354 ILE A CD1 1 ATOM 415 N N . GLU A 1 55 ? -55.272 11.125 -5.176 1.00 70.28 ? 355 GLU A N 1 ATOM 416 C CA . GLU A 1 55 ? -55.458 11.867 -6.420 1.00 69.73 ? 355 GLU A CA 1 ATOM 417 C C . GLU A 1 55 ? -56.764 12.659 -6.376 1.00 63.09 ? 355 GLU A C 1 ATOM 418 O O . GLU A 1 55 ? -57.739 12.228 -5.764 1.00 57.78 ? 355 GLU A O 1 ATOM 419 C CB . GLU A 1 55 ? -55.452 10.921 -7.624 1.00 75.70 ? 355 GLU A CB 1 ATOM 420 C CG . GLU A 1 55 ? -54.163 10.118 -7.785 1.00 82.15 ? 355 GLU A CG 1 ATOM 421 C CD . GLU A 1 55 ? -54.132 9.299 -9.066 1.00 99.36 ? 355 GLU A CD 1 ATOM 422 O OE1 . GLU A 1 55 ? -54.606 9.798 -10.108 1.00 100.18 ? 355 GLU A OE1 1 ATOM 423 O OE2 . GLU A 1 55 ? -53.626 8.156 -9.033 1.00 91.88 ? 355 GLU A OE2 1 ATOM 424 N N . VAL A 1 56 ? -56.780 13.820 -7.024 1.00 63.16 ? 356 VAL A N 1 ATOM 425 C CA . VAL A 1 56 ? -57.962 14.682 -7.018 1.00 58.74 ? 356 VAL A CA 1 ATOM 426 C C . VAL A 1 56 ? -58.510 14.890 -8.421 1.00 56.83 ? 356 VAL A C 1 ATOM 427 O O . VAL A 1 56 ? -57.753 15.142 -9.357 1.00 57.18 ? 356 VAL A O 1 ATOM 428 C CB . VAL A 1 56 ? -57.650 16.067 -6.398 1.00 56.78 ? 356 VAL A CB 1 ATOM 429 C CG1 . VAL A 1 56 ? -58.807 17.034 -6.609 1.00 51.41 ? 356 VAL A CG1 1 ATOM 430 C CG2 . VAL A 1 56 ? -57.328 15.926 -4.921 1.00 55.24 ? 356 VAL A CG2 1 ATOM 431 N N . LYS A 1 57 ? -59.827 14.783 -8.563 1.00 61.14 ? 357 LYS A N 1 ATOM 432 C CA . LYS A 1 57 ? -60.477 15.053 -9.842 1.00 66.79 ? 357 LYS A CA 1 ATOM 433 C C . LYS A 1 57 ? -61.650 16.014 -9.663 1.00 64.75 ? 357 LYS A C 1 ATOM 434 O O . LYS A 1 57 ? -62.416 15.902 -8.703 1.00 62.95 ? 357 LYS A O 1 ATOM 435 C CB . LYS A 1 57 ? -60.927 13.750 -10.520 1.00 69.76 ? 357 LYS A CB 1 ATOM 436 C CG . LYS A 1 57 ? -59.789 12.752 -10.744 1.00 78.58 ? 357 LYS A CG 1 ATOM 437 C CD . LYS A 1 57 ? -60.110 11.724 -11.825 1.00 90.22 ? 357 LYS A CD 1 ATOM 438 C CE . LYS A 1 57 ? -61.086 10.664 -11.340 1.00 95.30 ? 357 LYS A CE 1 ATOM 439 N NZ . LYS A 1 57 ? -61.311 9.612 -12.373 1.00 78.79 ? 357 LYS A NZ 1 ATOM 440 N N . GLY A 1 58 ? -61.776 16.963 -10.586 1.00 71.44 ? 358 GLY A N 1 ATOM 441 C CA . GLY A 1 58 ? -62.805 17.986 -10.504 1.00 76.18 ? 358 GLY A CA 1 ATOM 442 C C . GLY A 1 58 ? -63.878 17.836 -11.565 1.00 82.93 ? 358 GLY A C 1 ATOM 443 O O . GLY A 1 58 ? -63.626 17.311 -12.651 1.00 83.61 ? 358 GLY A O 1 ATOM 444 N N . GLN A 1 59 ? -65.079 18.310 -11.253 1.00 84.59 ? 359 GLN A N 1 ATOM 445 C CA . GLN A 1 59 ? -66.226 18.116 -12.129 1.00 93.98 ? 359 GLN A CA 1 ATOM 446 C C . GLN A 1 59 ? -67.076 19.379 -12.252 1.00 92.35 ? 359 GLN A C 1 ATOM 447 O O . GLN A 1 59 ? -68.299 19.318 -12.131 1.00 95.42 ? 359 GLN A O 1 ATOM 448 C CB . GLN A 1 59 ? -67.092 16.970 -11.601 1.00 103.51 ? 359 GLN A CB 1 ATOM 449 C CG . GLN A 1 59 ? -67.972 16.309 -12.648 1.00 106.49 ? 359 GLN A CG 1 ATOM 450 C CD . GLN A 1 59 ? -67.240 15.230 -13.417 1.00 114.00 ? 359 GLN A CD 1 ATOM 451 O OE1 . GLN A 1 59 ? -66.115 14.863 -13.074 1.00 106.06 ? 359 GLN A OE1 1 ATOM 452 N NE2 . GLN A 1 59 ? -67.877 14.711 -14.461 1.00 118.01 ? 359 GLN A NE2 1 ATOM 453 N N . HIS A 1 60 ? -66.431 20.518 -12.488 1.00 90.21 ? 360 HIS A N 1 ATOM 454 C CA . HIS A 1 60 ? -67.143 21.783 -12.686 1.00 92.09 ? 360 HIS A CA 1 ATOM 455 C C . HIS A 1 60 ? -68.112 22.090 -11.540 1.00 80.41 ? 360 HIS A C 1 ATOM 456 O O . HIS A 1 60 ? -69.265 21.661 -11.562 1.00 77.47 ? 360 HIS A O 1 ATOM 457 C CB . HIS A 1 60 ? -67.916 21.771 -14.016 1.00 115.01 ? 360 HIS A CB 1 ATOM 458 C CG . HIS A 1 60 ? -67.050 21.895 -15.235 1.00 126.96 ? 360 HIS A CG 1 ATOM 459 N ND1 . HIS A 1 60 ? -66.612 23.111 -15.718 1.00 117.33 ? 360 HIS A ND1 1 ATOM 460 C CD2 . HIS A 1 60 ? -66.564 20.958 -16.084 1.00 119.30 ? 360 HIS A CD2 1 ATOM 461 C CE1 . HIS A 1 60 ? -65.882 22.915 -16.802 1.00 108.93 ? 360 HIS A CE1 1 ATOM 462 N NE2 . HIS A 1 60 ? -65.837 21.618 -17.046 1.00 112.14 ? 360 HIS A NE2 1 ATOM 463 N N . GLY A 1 61 ? -67.648 22.841 -10.546 1.00 75.54 ? 361 GLY A N 1 ATOM 464 C CA . GLY A 1 61 ? -68.480 23.192 -9.405 1.00 73.30 ? 361 GLY A CA 1 ATOM 465 C C . GLY A 1 61 ? -68.482 22.127 -8.321 1.00 68.96 ? 361 GLY A C 1 ATOM 466 O O . GLY A 1 61 ? -69.202 22.229 -7.326 1.00 69.59 ? 361 GLY A O 1 ATOM 467 N N . SER A 1 62 ? -67.665 21.099 -8.515 1.00 71.24 ? 362 SER A N 1 ATOM 468 C CA . SER A 1 62 ? -67.588 19.991 -7.577 1.00 64.18 ? 362 SER A CA 1 ATOM 469 C C . SER A 1 62 ? -66.212 19.345 -7.657 1.00 63.75 ? 362 SER A C 1 ATOM 470 O O . SER A 1 62 ? -65.640 19.223 -8.740 1.00 65.46 ? 362 SER A O 1 ATOM 471 C CB . SER A 1 62 ? -68.679 18.963 -7.887 1.00 64.82 ? 362 SER A CB 1 ATOM 472 O OG . SER A 1 62 ? -68.724 17.942 -6.908 1.00 59.92 ? 362 SER A OG 1 ATOM 473 N N . SER A 1 63 ? -65.673 18.948 -6.508 1.00 58.27 ? 363 SER A N 1 ATOM 474 C CA . SER A 1 63 ? -64.381 18.272 -6.476 1.00 54.11 ? 363 SER A CA 1 ATOM 475 C C . SER A 1 63 ? -64.445 16.992 -5.661 1.00 49.04 ? 363 SER A C 1 ATOM 476 O O . SER A 1 63 ? -65.315 16.814 -4.801 1.00 46.03 ? 363 SER A O 1 ATOM 477 C CB . SER A 1 63 ? -63.287 19.186 -5.916 1.00 49.83 ? 363 SER A CB 1 ATOM 478 O OG . SER A 1 63 ? -61.998 18.613 -6.100 1.00 51.26 ? 363 SER A OG 1 ATOM 479 N N . SER A 1 64 ? -63.515 16.095 -5.942 1.00 42.74 ? 364 SER A N 1 ATOM 480 C CA . SER A 1 64 ? -63.454 14.850 -5.209 1.00 47.57 ? 364 SER A CA 1 ATOM 481 C C . SER A 1 64 ? -62.004 14.516 -4.976 1.00 49.04 ? 364 SER A C 1 ATOM 482 O O . SER A 1 64 ? -61.170 14.635 -5.879 1.00 49.12 ? 364 SER A O 1 ATOM 483 C CB . SER A 1 64 ? -64.137 13.722 -5.979 1.00 46.17 ? 364 SER A CB 1 ATOM 484 O OG . SER A 1 64 ? -63.257 13.170 -6.938 1.00 49.03 ? 364 SER A OG 1 ATOM 485 N N . LEU A 1 65 ? -61.711 14.121 -3.746 1.00 41.90 ? 365 LEU A N 1 ATOM 486 C CA . LEU A 1 65 ? -60.375 13.717 -3.368 1.00 45.69 ? 365 LEU A CA 1 ATOM 487 C C . LEU A 1 65 ? -60.468 12.246 -2.989 1.00 44.74 ? 365 LEU A C 1 ATOM 488 O O . LEU A 1 65 ? -61.302 11.858 -2.161 1.00 41.89 ? 365 LEU A O 1 ATOM 489 C CB . LEU A 1 65 ? -59.876 14.588 -2.208 1.00 44.86 ? 365 LEU A CB 1 ATOM 490 C CG . LEU A 1 65 ? -58.461 14.382 -1.670 1.00 47.99 ? 365 LEU A CG 1 ATOM 491 C CD1 . LEU A 1 65 ? -57.864 15.686 -1.149 1.00 47.25 ? 365 LEU A CD1 1 ATOM 492 C CD2 . LEU A 1 65 ? -58.478 13.325 -0.586 1.00 47.63 ? 365 LEU A CD2 1 ATOM 493 N N . HIS A 1 66 ? -59.637 11.428 -3.626 1.00 44.46 ? 366 HIS A N 1 ATOM 494 C CA . HIS A 1 66 ? -59.711 9.980 -3.469 1.00 47.44 ? 366 HIS A CA 1 ATOM 495 C C . HIS A 1 66 ? -58.397 9.425 -2.950 1.00 51.09 ? 366 HIS A C 1 ATOM 496 O O . HIS A 1 66 ? -57.334 9.697 -3.509 1.00 54.16 ? 366 HIS A O 1 ATOM 497 C CB . HIS A 1 66 ? -60.059 9.308 -4.802 1.00 46.08 ? 366 HIS A CB 1 ATOM 498 C CG . HIS A 1 66 ? -60.230 7.821 -4.706 1.00 47.71 ? 366 HIS A CG 1 ATOM 499 N ND1 . HIS A 1 66 ? -61.403 7.231 -4.281 1.00 49.39 ? 366 HIS A ND1 1 ATOM 500 C CD2 . HIS A 1 66 ? -59.379 6.804 -4.988 1.00 53.29 ? 366 HIS A CD2 1 ATOM 501 C CE1 . HIS A 1 66 ? -61.266 5.916 -4.302 1.00 50.93 ? 366 HIS A CE1 1 ATOM 502 N NE2 . HIS A 1 66 ? -60.048 5.631 -4.728 1.00 51.84 ? 366 HIS A NE2 1 ATOM 503 N N . ILE A 1 67 ? -58.473 8.655 -1.872 1.00 43.98 ? 367 ILE A N 1 ATOM 504 C CA . ILE A 1 67 ? -57.293 7.978 -1.362 1.00 51.83 ? 367 ILE A CA 1 ATOM 505 C C . ILE A 1 67 ? -57.489 6.483 -1.474 1.00 49.74 ? 367 ILE A C 1 ATOM 506 O O . ILE A 1 67 ? -58.567 5.968 -1.186 1.00 46.81 ? 367 ILE A O 1 ATOM 507 C CB . ILE A 1 67 ? -57.003 8.314 0.109 1.00 49.97 ? 367 ILE A CB 1 ATOM 508 C CG1 . ILE A 1 67 ? -56.950 9.828 0.322 1.00 53.12 ? 367 ILE A CG1 1 ATOM 509 C CG2 . ILE A 1 67 ? -55.698 7.665 0.556 1.00 50.94 ? 367 ILE A CG2 1 ATOM 510 C CD1 . ILE A 1 67 ? -58.249 10.408 0.813 1.00 48.79 ? 367 ILE A CD1 1 ATOM 511 N N . LYS A 1 68 ? -56.443 5.796 -1.915 1.00 48.61 ? 368 LYS A N 1 ATOM 512 C CA . LYS A 1 68 ? -56.424 4.346 -1.906 1.00 54.46 ? 368 LYS A CA 1 ATOM 513 C C . LYS A 1 68 ? -55.409 3.885 -0.863 1.00 54.94 ? 368 LYS A C 1 ATOM 514 O O . LYS A 1 68 ? -54.462 4.613 -0.546 1.00 53.56 ? 368 LYS A O 1 ATOM 515 C CB . LYS A 1 68 ? -56.087 3.792 -3.297 1.00 59.34 ? 368 LYS A CB 1 ATOM 516 C CG . LYS A 1 68 ? -54.787 4.313 -3.892 1.00 64.35 ? 368 LYS A CG 1 ATOM 517 C CD . LYS A 1 68 ? -54.400 3.538 -5.148 1.00 68.20 ? 368 LYS A CD 1 ATOM 518 C CE . LYS A 1 68 ? -54.166 2.058 -4.840 1.00 87.38 ? 368 LYS A CE 1 ATOM 519 N NZ . LYS A 1 68 ? -53.910 1.222 -6.056 1.00 79.74 ? 368 LYS A NZ 1 ATOM 520 N N . ASP A 1 69 ? -55.628 2.695 -0.310 1.00 52.42 ? 369 ASP A N 1 ATOM 521 C CA . ASP A 1 69 ? -54.700 2.111 0.653 1.00 51.49 ? 369 ASP A CA 1 ATOM 522 C C . ASP A 1 69 ? -54.582 2.991 1.890 1.00 51.75 ? 369 ASP A C 1 ATOM 523 O O . ASP A 1 69 ? -53.478 3.309 2.339 1.00 48.26 ? 369 ASP A O 1 ATOM 524 C CB . ASP A 1 69 ? -53.322 1.893 0.010 1.00 58.89 ? 369 ASP A CB 1 ATOM 525 C CG . ASP A 1 69 ? -53.334 0.800 -1.055 1.00 76.70 ? 369 ASP A CG 1 ATOM 526 O OD1 . ASP A 1 69 ? -54.370 0.114 -1.202 1.00 69.27 ? 369 ASP A OD1 1 ATOM 527 O OD2 . ASP A 1 69 ? -52.306 0.621 -1.745 1.00 71.93 ? 369 ASP A OD2 1 ATOM 528 N N . VAL A 1 70 ? -55.732 3.378 2.433 1.00 49.36 ? 370 VAL A N 1 ATOM 529 C CA . VAL A 1 70 ? -55.795 4.287 3.574 1.00 49.49 ? 370 VAL A CA 1 ATOM 530 C C . VAL A 1 70 ? -54.912 3.884 4.763 1.00 48.55 ? 370 VAL A C 1 ATOM 531 O O . VAL A 1 70 ? -54.977 2.754 5.245 1.00 51.17 ? 370 VAL A O 1 ATOM 532 C CB . VAL A 1 70 ? -57.245 4.449 4.053 1.00 47.58 ? 370 VAL A CB 1 ATOM 533 C CG1 . VAL A 1 70 ? -57.303 5.320 5.289 1.00 45.38 ? 370 VAL A CG1 1 ATOM 534 C CG2 . VAL A 1 70 ? -58.095 5.035 2.942 1.00 43.71 ? 370 VAL A CG2 1 ATOM 535 N N . LYS A 1 71 ? -54.086 4.825 5.217 1.00 48.59 ? 371 LYS A N 1 ATOM 536 C CA . LYS A 1 71 ? -53.295 4.671 6.436 1.00 51.14 ? 371 LYS A CA 1 ATOM 537 C C . LYS A 1 71 ? -53.956 5.454 7.569 1.00 46.87 ? 371 LYS A C 1 ATOM 538 O O . LYS A 1 71 ? -54.708 6.395 7.317 1.00 43.87 ? 371 LYS A O 1 ATOM 539 C CB . LYS A 1 71 ? -51.872 5.192 6.223 1.00 51.59 ? 371 LYS A CB 1 ATOM 540 C CG . LYS A 1 71 ? -51.146 4.555 5.050 1.00 57.95 ? 371 LYS A CG 1 ATOM 541 C CD . LYS A 1 71 ? -49.683 4.970 5.002 1.00 64.30 ? 371 LYS A CD 1 ATOM 542 C CE . LYS A 1 71 ? -49.522 6.425 4.597 1.00 68.24 ? 371 LYS A CE 1 ATOM 543 N NZ . LYS A 1 71 ? -48.085 6.791 4.452 1.00 74.30 ? 371 LYS A NZ 1 ATOM 544 N N . LEU A 1 72 ? -53.669 5.076 8.812 1.00 41.85 ? 372 LEU A N 1 ATOM 545 C CA . LEU A 1 72 ? -54.265 5.737 9.975 1.00 39.97 ? 372 LEU A CA 1 ATOM 546 C C . LEU A 1 72 ? -53.899 7.219 10.039 1.00 40.97 ? 372 LEU A C 1 ATOM 547 O O . LEU A 1 72 ? -54.604 8.015 10.657 1.00 41.28 ? 372 LEU A O 1 ATOM 548 C CB . LEU A 1 72 ? -53.855 5.040 11.279 1.00 43.48 ? 372 LEU A CB 1 ATOM 549 C CG . LEU A 1 72 ? -54.233 3.568 11.474 1.00 44.76 ? 372 LEU A CG 1 ATOM 550 C CD1 . LEU A 1 72 ? -53.790 3.087 12.850 1.00 43.81 ? 372 LEU A CD1 1 ATOM 551 C CD2 . LEU A 1 72 ? -55.728 3.340 11.289 1.00 41.51 ? 372 LEU A CD2 1 ATOM 552 N N . SER A 1 73 ? -52.797 7.583 9.396 1.00 41.17 ? 373 SER A N 1 ATOM 553 C CA . SER A 1 73 ? -52.369 8.973 9.333 1.00 41.74 ? 373 SER A CA 1 ATOM 554 C C . SER A 1 73 ? -53.162 9.795 8.313 1.00 43.77 ? 373 SER A C 1 ATOM 555 O O . SER A 1 73 ? -52.866 10.969 8.092 1.00 45.84 ? 373 SER A O 1 ATOM 556 C CB . SER A 1 73 ? -50.889 9.034 8.977 1.00 43.95 ? 373 SER A CB 1 ATOM 557 O OG . SER A 1 73 ? -50.674 8.478 7.693 1.00 52.95 ? 373 SER A OG 1 ATOM 558 N N . ASP A 1 74 ? -54.150 9.183 7.672 1.00 37.82 ? 374 ASP A N 1 ATOM 559 C CA . ASP A 1 74 ? -54.994 9.924 6.742 1.00 39.51 ? 374 ASP A CA 1 ATOM 560 C C . ASP A 1 74 ? -56.150 10.560 7.484 1.00 38.31 ? 374 ASP A C 1 ATOM 561 O O . ASP A 1 74 ? -56.853 11.419 6.947 1.00 38.90 ? 374 ASP A O 1 ATOM 562 C CB . ASP A 1 74 ? -55.560 9.008 5.663 1.00 42.68 ? 374 ASP A CB 1 ATOM 563 C CG . ASP A 1 74 ? -54.504 8.514 4.706 1.00 47.80 ? 374 ASP A CG 1 ATOM 564 O OD1 . ASP A 1 74 ? -53.457 9.179 4.566 1.00 44.50 ? 374 ASP A OD1 1 ATOM 565 O OD2 . ASP A 1 74 ? -54.731 7.455 4.088 1.00 50.03 ? 374 ASP A OD2 1 ATOM 566 N N . SER A 1 75 ? -56.359 10.122 8.718 1.00 32.86 ? 375 SER A N 1 ATOM 567 C CA . SER A 1 75 ? -57.497 10.599 9.486 1.00 36.03 ? 375 SER A CA 1 ATOM 568 C C . SER A 1 75 ? -57.275 12.042 9.907 1.00 37.25 ? 375 SER A C 1 ATOM 569 O O . SER A 1 75 ? -56.151 12.544 9.890 1.00 34.05 ? 375 SER A O 1 ATOM 570 C CB . SER A 1 75 ? -57.734 9.721 10.711 1.00 36.69 ? 375 SER A CB 1 ATOM 571 O OG . SER A 1 75 ? -56.836 10.072 11.739 1.00 43.94 ? 375 SER A OG 1 ATOM 572 N N . GLY A 1 76 ? -58.352 12.713 10.282 1.00 31.12 ? 376 GLY A N 1 ATOM 573 C CA . GLY A 1 76 ? -58.253 14.099 10.683 1.00 37.30 ? 376 GLY A CA 1 ATOM 574 C C . GLY A 1 76 ? -58.975 15.014 9.717 1.00 38.13 ? 376 GLY A C 1 ATOM 575 O O . GLY A 1 76 ? -59.685 14.549 8.821 1.00 31.77 ? 376 GLY A O 1 ATOM 576 N N . ARG A 1 77 ? -58.773 16.315 9.899 1.00 30.31 ? 377 ARG A N 1 ATOM 577 C CA . ARG A 1 77 ? -59.507 17.337 9.171 1.00 33.52 ? 377 ARG A CA 1 ATOM 578 C C . ARG A 1 77 ? -58.969 17.566 7.765 1.00 34.60 ? 377 ARG A C 1 ATOM 579 O O . ARG A 1 77 ? -57.761 17.523 7.530 1.00 32.92 ? 377 ARG A O 1 ATOM 580 C CB . ARG A 1 77 ? -59.493 18.659 9.958 1.00 33.87 ? 377 ARG A CB 1 ATOM 581 C CG . ARG A 1 77 ? -60.163 19.835 9.226 1.00 34.25 ? 377 ARG A CG 1 ATOM 582 C CD . ARG A 1 77 ? -60.287 21.092 10.104 1.00 36.19 ? 377 ARG A CD 1 ATOM 583 N NE . ARG A 1 77 ? -59.065 21.366 10.854 1.00 41.86 ? 377 ARG A NE 1 ATOM 584 C CZ . ARG A 1 77 ? -58.069 22.128 10.412 1.00 37.66 ? 377 ARG A CZ 1 ATOM 585 N NH1 . ARG A 1 77 ? -58.153 22.706 9.224 1.00 40.29 ? 377 ARG A NH1 1 ATOM 586 N NH2 . ARG A 1 77 ? -56.996 22.322 11.165 1.00 45.70 ? 377 ARG A NH2 1 ATOM 587 N N . TYR A 1 78 ? -59.886 17.812 6.837 1.00 32.23 ? 378 TYR A N 1 ATOM 588 C CA . TYR A 1 78 ? -59.532 18.254 5.498 1.00 36.00 ? 378 TYR A CA 1 ATOM 589 C C . TYR A 1 78 ? -60.336 19.505 5.196 1.00 34.64 ? 378 TYR A C 1 ATOM 590 O O . TYR A 1 78 ? -61.515 19.591 5.545 1.00 34.35 ? 378 TYR A O 1 ATOM 591 C CB . TYR A 1 78 ? -59.829 17.166 4.461 1.00 29.30 ? 378 TYR A CB 1 ATOM 592 C CG . TYR A 1 78 ? -58.890 15.989 4.536 1.00 33.03 ? 378 TYR A CG 1 ATOM 593 C CD1 . TYR A 1 78 ? -57.882 15.818 3.597 1.00 35.38 ? 378 TYR A CD1 1 ATOM 594 C CD2 . TYR A 1 78 ? -59.003 15.050 5.557 1.00 34.46 ? 378 TYR A CD2 1 ATOM 595 C CE1 . TYR A 1 78 ? -57.016 14.727 3.664 1.00 34.40 ? 378 TYR A CE1 1 ATOM 596 C CE2 . TYR A 1 78 ? -58.146 13.970 5.636 1.00 36.28 ? 378 TYR A CE2 1 ATOM 597 C CZ . TYR A 1 78 ? -57.153 13.811 4.688 1.00 34.97 ? 378 TYR A CZ 1 ATOM 598 O OH . TYR A 1 78 ? -56.296 12.734 4.769 1.00 40.51 ? 378 TYR A OH 1 ATOM 599 N N . ASP A 1 79 ? -59.692 20.476 4.561 1.00 32.59 ? 379 ASP A N 1 ATOM 600 C CA . ASP A 1 79 ? -60.330 21.753 4.262 1.00 35.62 ? 379 ASP A CA 1 ATOM 601 C C . ASP A 1 79 ? -60.616 21.893 2.778 1.00 38.77 ? 379 ASP A C 1 ATOM 602 O O . ASP A 1 79 ? -59.734 21.683 1.936 1.00 35.30 ? 379 ASP A O 1 ATOM 603 C CB . ASP A 1 79 ? -59.436 22.921 4.693 1.00 36.29 ? 379 ASP A CB 1 ATOM 604 C CG . ASP A 1 79 ? -59.266 23.009 6.195 1.00 43.75 ? 379 ASP A CG 1 ATOM 605 O OD1 . ASP A 1 79 ? -60.176 22.562 6.921 1.00 43.37 ? 379 ASP A OD1 1 ATOM 606 O OD2 . ASP A 1 79 ? -58.225 23.534 6.649 1.00 48.19 ? 379 ASP A OD2 1 ATOM 607 N N . CYS A 1 80 ? -61.847 22.272 2.463 1.00 33.29 ? 380 CYS A N 1 ATOM 608 C CA . CYS A 1 80 ? -62.211 22.607 1.095 1.00 42.17 ? 380 CYS A CA 1 ATOM 609 C C . CYS A 1 80 ? -62.392 24.120 0.936 1.00 43.17 ? 380 CYS A C 1 ATOM 610 O O . CYS A 1 80 ? -63.200 24.738 1.642 1.00 41.97 ? 380 CYS A O 1 ATOM 611 C CB . CYS A 1 80 ? -63.500 21.880 0.699 1.00 38.15 ? 380 CYS A CB 1 ATOM 612 S SG . CYS A 1 80 ? -64.016 22.081 -1.025 1.00 56.80 ? 380 CYS A SG 1 ATOM 613 N N . GLU A 1 81 ? -61.642 24.717 0.013 1.00 43.43 ? 381 GLU A N 1 ATOM 614 C CA . GLU A 1 81 ? -61.884 26.108 -0.354 1.00 49.38 ? 381 GLU A CA 1 ATOM 615 C C . GLU A 1 81 ? -62.363 26.262 -1.791 1.00 45.40 ? 381 GLU A C 1 ATOM 616 O O . GLU A 1 81 ? -61.665 25.893 -2.734 1.00 43.98 ? 381 GLU A O 1 ATOM 617 C CB . GLU A 1 81 ? -60.648 26.982 -0.133 1.00 50.17 ? 381 GLU A CB 1 ATOM 618 C CG . GLU A 1 81 ? -60.832 28.399 -0.681 1.00 56.03 ? 381 GLU A CG 1 ATOM 619 C CD . GLU A 1 81 ? -59.966 29.437 0.012 1.00 78.19 ? 381 GLU A CD 1 ATOM 620 O OE1 . GLU A 1 81 ? -58.727 29.274 0.025 1.00 77.75 ? 381 GLU A OE1 1 ATOM 621 O OE2 . GLU A 1 81 ? -60.532 30.427 0.529 1.00 57.25 ? 381 GLU A OE2 1 ATOM 622 N N . ALA A 1 82 ? -63.556 26.827 -1.942 1.00 46.93 ? 382 ALA A N 1 ATOM 623 C CA . ALA A 1 82 ? -64.078 27.213 -3.247 1.00 50.09 ? 382 ALA A CA 1 ATOM 624 C C . ALA A 1 82 ? -63.792 28.698 -3.507 1.00 53.30 ? 382 ALA A C 1 ATOM 625 O O . ALA A 1 82 ? -64.396 29.569 -2.880 1.00 52.19 ? 382 ALA A O 1 ATOM 626 C CB . ALA A 1 82 ? -65.571 26.941 -3.305 1.00 42.68 ? 382 ALA A CB 1 ATOM 627 N N . ALA A 1 83 ? -62.873 28.985 -4.427 1.00 56.40 ? 383 ALA A N 1 ATOM 628 C CA . ALA A 1 83 ? -62.465 30.366 -4.708 1.00 57.07 ? 383 ALA A CA 1 ATOM 629 C C . ALA A 1 83 ? -62.711 30.795 -6.163 1.00 62.72 ? 383 ALA A C 1 ATOM 630 O O . ALA A 1 83 ? -62.604 29.989 -7.089 1.00 62.89 ? 383 ALA A O 1 ATOM 631 C CB . ALA A 1 83 ? -60.994 30.565 -4.342 1.00 52.41 ? 383 ALA A CB 1 ATOM 632 N N . SER A 1 84 ? -63.038 32.069 -6.356 1.00 63.88 ? 384 SER A N 1 ATOM 633 C CA . SER A 1 84 ? -63.150 32.636 -7.700 1.00 66.21 ? 384 SER A CA 1 ATOM 634 C C . SER A 1 84 ? -62.589 34.052 -7.762 1.00 68.37 ? 384 SER A C 1 ATOM 635 O O . SER A 1 84 ? -61.903 34.507 -6.845 1.00 67.96 ? 384 SER A O 1 ATOM 636 C CB . SER A 1 84 ? -64.603 32.636 -8.179 1.00 63.18 ? 384 SER A CB 1 ATOM 637 O OG . SER A 1 84 ? -65.372 33.606 -7.493 1.00 57.40 ? 384 SER A OG 1 ATOM 638 N N . ARG A 1 85 ? -62.883 34.746 -8.855 1.00 69.48 ? 385 ARG A N 1 ATOM 639 C CA . ARG A 1 85 ? -62.449 36.125 -9.024 1.00 70.32 ? 385 ARG A CA 1 ATOM 640 C C . ARG A 1 85 ? -63.087 37.023 -7.974 1.00 68.56 ? 385 ARG A C 1 ATOM 641 O O . ARG A 1 85 ? -62.436 37.908 -7.425 1.00 65.13 ? 385 ARG A O 1 ATOM 642 C CB . ARG A 1 85 ? -62.808 36.629 -10.425 1.00 74.57 ? 385 ARG A CB 1 ATOM 643 C CG . ARG A 1 85 ? -64.166 36.143 -10.921 1.00 82.63 ? 385 ARG A CG 1 ATOM 644 C CD . ARG A 1 85 ? -64.568 36.786 -12.245 1.00 89.19 ? 385 ARG A CD 1 ATOM 645 N NE . ARG A 1 85 ? -65.365 37.995 -12.053 1.00 85.97 ? 385 ARG A NE 1 ATOM 646 C CZ . ARG A 1 85 ? -66.180 38.507 -12.970 1.00 88.48 ? 385 ARG A CZ 1 ATOM 647 N NH1 . ARG A 1 85 ? -66.311 37.913 -14.150 1.00 88.76 ? 385 ARG A NH1 1 ATOM 648 N NH2 . ARG A 1 85 ? -66.869 39.610 -12.708 1.00 97.92 ? 385 ARG A NH2 1 ATOM 649 N N . ILE A 1 86 ? -64.360 36.782 -7.687 1.00 66.80 ? 386 ILE A N 1 ATOM 650 C CA . ILE A 1 86 ? -65.127 37.683 -6.840 1.00 63.74 ? 386 ILE A CA 1 ATOM 651 C C . ILE A 1 86 ? -65.130 37.337 -5.349 1.00 66.75 ? 386 ILE A C 1 ATOM 652 O O . ILE A 1 86 ? -65.473 38.178 -4.517 1.00 67.35 ? 386 ILE A O 1 ATOM 653 C CB . ILE A 1 86 ? -66.581 37.799 -7.329 1.00 66.63 ? 386 ILE A CB 1 ATOM 654 C CG1 . ILE A 1 86 ? -67.323 36.477 -7.137 1.00 66.74 ? 386 ILE A CG1 1 ATOM 655 C CG2 . ILE A 1 86 ? -66.610 38.220 -8.791 1.00 75.13 ? 386 ILE A CG2 1 ATOM 656 C CD1 . ILE A 1 86 ? -68.804 36.562 -7.464 1.00 65.96 ? 386 ILE A CD1 1 ATOM 657 N N . GLY A 1 87 ? -64.759 36.108 -5.006 1.00 66.13 ? 387 GLY A N 1 ATOM 658 C CA . GLY A 1 87 ? -64.772 35.704 -3.611 1.00 62.71 ? 387 GLY A CA 1 ATOM 659 C C . GLY A 1 87 ? -64.473 34.242 -3.342 1.00 59.94 ? 387 GLY A C 1 ATOM 660 O O . GLY A 1 87 ? -64.424 33.419 -4.259 1.00 58.39 ? 387 GLY A O 1 ATOM 661 N N . GLY A 1 88 ? -64.275 33.923 -2.066 1.00 55.07 ? 388 GLY A N 1 ATOM 662 C CA . GLY A 1 88 ? -63.989 32.565 -1.644 1.00 47.90 ? 388 GLY A CA 1 ATOM 663 C C . GLY A 1 88 ? -64.810 32.121 -0.444 1.00 47.72 ? 388 GLY A C 1 ATOM 664 O O . GLY A 1 88 ? -65.232 32.936 0.382 1.00 47.17 ? 388 GLY A O 1 ATOM 665 N N . HIS A 1 89 ? -65.036 30.814 -0.354 1.00 50.77 ? 389 HIS A N 1 ATOM 666 C CA . HIS A 1 89 ? -65.725 30.202 0.778 1.00 47.88 ? 389 HIS A CA 1 ATOM 667 C C . HIS A 1 89 ? -64.937 28.963 1.180 1.00 45.77 ? 389 HIS A C 1 ATOM 668 O O . HIS A 1 89 ? -64.337 28.295 0.333 1.00 44.99 ? 389 HIS A O 1 ATOM 669 C CB . HIS A 1 89 ? -67.158 29.842 0.383 1.00 44.59 ? 389 HIS A CB 1 ATOM 670 C CG . HIS A 1 89 ? -68.024 29.410 1.525 1.00 44.80 ? 389 HIS A CG 1 ATOM 671 N ND1 . HIS A 1 89 ? -68.931 28.377 1.415 1.00 47.49 ? 389 HIS A ND1 1 ATOM 672 C CD2 . HIS A 1 89 ? -68.130 29.872 2.791 1.00 47.12 ? 389 HIS A CD2 1 ATOM 673 C CE1 . HIS A 1 89 ? -69.560 28.223 2.567 1.00 48.66 ? 389 HIS A CE1 1 ATOM 674 N NE2 . HIS A 1 89 ? -69.093 29.116 3.420 1.00 48.99 ? 389 HIS A NE2 1 ATOM 675 N N . GLN A 1 90 ? -64.910 28.669 2.472 1.00 41.12 ? 390 GLN A N 1 ATOM 676 C CA . GLN A 1 90 ? -64.124 27.541 2.956 1.00 45.21 ? 390 GLN A CA 1 ATOM 677 C C . GLN A 1 90 ? -64.851 26.813 4.070 1.00 43.16 ? 390 GLN A C 1 ATOM 678 O O . GLN A 1 90 ? -65.432 27.449 4.953 1.00 40.84 ? 390 GLN A O 1 ATOM 679 C CB . GLN A 1 90 ? -62.762 28.018 3.460 1.00 46.87 ? 390 GLN A CB 1 ATOM 680 C CG . GLN A 1 90 ? -61.764 26.903 3.712 1.00 52.06 ? 390 GLN A CG 1 ATOM 681 C CD . GLN A 1 90 ? -60.398 27.427 4.103 1.00 57.05 ? 390 GLN A CD 1 ATOM 682 O OE1 . GLN A 1 90 ? -60.285 28.405 4.845 1.00 59.51 ? 390 GLN A OE1 1 ATOM 683 N NE2 . GLN A 1 90 ? -59.350 26.777 3.607 1.00 59.81 ? 390 GLN A NE2 1 ATOM 684 N N . LYS A 1 91 ? -64.829 25.482 4.017 1.00 37.07 ? 391 LYS A N 1 ATOM 685 C CA . LYS A 1 91 ? -65.326 24.671 5.124 1.00 36.18 ? 391 LYS A CA 1 ATOM 686 C C . LYS A 1 91 ? -64.422 23.464 5.381 1.00 33.22 ? 391 LYS A C 1 ATOM 687 O O . LYS A 1 91 ? -63.446 23.232 4.667 1.00 30.21 ? 391 LYS A O 1 ATOM 688 C CB . LYS A 1 91 ? -66.780 24.236 4.896 1.00 42.59 ? 391 LYS A CB 1 ATOM 689 C CG . LYS A 1 91 ? -67.757 25.395 4.728 1.00 49.50 ? 391 LYS A CG 1 ATOM 690 C CD . LYS A 1 91 ? -69.198 24.914 4.677 1.00 54.70 ? 391 LYS A CD 1 ATOM 691 C CE . LYS A 1 91 ? -69.696 24.514 6.055 1.00 63.78 ? 391 LYS A CE 1 ATOM 692 N NZ . LYS A 1 91 ? -69.819 25.686 6.969 1.00 65.85 ? 391 LYS A NZ 1 ATOM 693 N N . SER A 1 92 ? -64.756 22.698 6.410 1.00 29.51 ? 392 SER A N 1 ATOM 694 C CA . SER A 1 92 ? -63.896 21.616 6.862 1.00 32.06 ? 392 SER A CA 1 ATOM 695 C C . SER A 1 92 ? -64.681 20.349 7.089 1.00 30.44 ? 392 SER A C 1 ATOM 696 O O . SER A 1 92 ? -65.850 20.400 7.465 1.00 34.15 ? 392 SER A O 1 ATOM 697 C CB . SER A 1 92 ? -63.224 21.992 8.182 1.00 35.83 ? 392 SER A CB 1 ATOM 698 O OG . SER A 1 92 ? -62.338 23.080 8.019 1.00 37.16 ? 392 SER A OG 1 ATOM 699 N N . MET A 1 93 ? -64.029 19.210 6.879 1.00 30.75 ? 393 MET A N 1 ATOM 700 C CA . MET A 1 93 ? -64.619 17.932 7.253 1.00 38.07 ? 393 MET A CA 1 ATOM 701 C C . MET A 1 93 ? -63.584 17.030 7.893 1.00 31.43 ? 393 MET A C 1 ATOM 702 O O . MET A 1 93 ? -62.384 17.320 7.854 1.00 29.30 ? 393 MET A O 1 ATOM 703 C CB . MET A 1 93 ? -65.248 17.238 6.046 1.00 28.61 ? 393 MET A CB 1 ATOM 704 C CG . MET A 1 93 ? -64.310 17.087 4.870 1.00 28.97 ? 393 MET A CG 1 ATOM 705 S SD . MET A 1 93 ? -63.164 15.730 5.055 1.00 41.84 ? 393 MET A SD 1 ATOM 706 C CE . MET A 1 93 ? -64.299 14.361 5.292 1.00 35.72 ? 393 MET A CE 1 ATOM 707 N N . TYR A 1 94 ? -64.058 15.923 8.456 1.00 33.95 ? 394 TYR A N 1 ATOM 708 C CA . TYR A 1 94 ? -63.189 14.977 9.141 1.00 34.63 ? 394 TYR A CA 1 ATOM 709 C C . TYR A 1 94 ? -63.264 13.577 8.550 1.00 35.08 ? 394 TYR A C 1 ATOM 710 O O . TYR A 1 94 ? -64.348 13.035 8.335 1.00 35.46 ? 394 TYR A O 1 ATOM 711 C CB . TYR A 1 94 ? -63.522 14.952 10.637 1.00 34.51 ? 394 TYR A CB 1 ATOM 712 C CG . TYR A 1 94 ? -63.203 16.263 11.327 1.00 38.17 ? 394 TYR A CG 1 ATOM 713 C CD1 . TYR A 1 94 ? -62.046 16.413 12.081 1.00 36.28 ? 394 TYR A CD1 1 ATOM 714 C CD2 . TYR A 1 94 ? -64.045 17.362 11.191 1.00 34.35 ? 394 TYR A CD2 1 ATOM 715 C CE1 . TYR A 1 94 ? -61.746 17.617 12.700 1.00 31.45 ? 394 TYR A CE1 1 ATOM 716 C CE2 . TYR A 1 94 ? -63.756 18.561 11.799 1.00 39.57 ? 394 TYR A CE2 1 ATOM 717 C CZ . TYR A 1 94 ? -62.606 18.687 12.552 1.00 38.44 ? 394 TYR A CZ 1 ATOM 718 O OH . TYR A 1 94 ? -62.327 19.891 13.159 1.00 36.77 ? 394 TYR A OH 1 ATOM 719 N N . LEU A 1 95 ? -62.101 12.998 8.279 1.00 36.04 ? 395 LEU A N 1 ATOM 720 C CA . LEU A 1 95 ? -62.025 11.611 7.841 1.00 32.05 ? 395 LEU A CA 1 ATOM 721 C C . LEU A 1 95 ? -61.735 10.665 9.007 1.00 33.92 ? 395 LEU A C 1 ATOM 722 O O . LEU A 1 95 ? -60.627 10.651 9.539 1.00 34.17 ? 395 LEU A O 1 ATOM 723 C CB . LEU A 1 95 ? -60.933 11.440 6.798 1.00 27.98 ? 395 LEU A CB 1 ATOM 724 C CG . LEU A 1 95 ? -60.725 9.954 6.505 1.00 27.35 ? 395 LEU A CG 1 ATOM 725 C CD1 . LEU A 1 95 ? -62.000 9.363 5.922 1.00 37.16 ? 395 LEU A CD1 1 ATOM 726 C CD2 . LEU A 1 95 ? -59.544 9.747 5.576 1.00 29.75 ? 395 LEU A CD2 1 ATOM 727 N N . ASP A 1 96 ? -62.728 9.871 9.392 1.00 38.14 ? 396 ASP A N 1 ATOM 728 C CA . ASP A 1 96 ? -62.554 8.906 10.467 1.00 36.34 ? 396 ASP A CA 1 ATOM 729 C C . ASP A 1 96 ? -62.146 7.540 9.914 1.00 40.60 ? 396 ASP A C 1 ATOM 730 O O . ASP A 1 96 ? -62.752 7.038 8.979 1.00 40.64 ? 396 ASP A O 1 ATOM 731 C CB . ASP A 1 96 ? -63.839 8.781 11.284 1.00 37.13 ? 396 ASP A CB 1 ATOM 732 C CG . ASP A 1 96 ? -63.685 7.841 12.463 1.00 50.65 ? 396 ASP A CG 1 ATOM 733 O OD1 . ASP A 1 96 ? -62.530 7.546 12.836 1.00 51.23 ? 396 ASP A OD1 1 ATOM 734 O OD2 . ASP A 1 96 ? -64.711 7.397 13.020 1.00 53.56 ? 396 ASP A OD2 1 ATOM 735 N N . ILE A 1 97 ? -61.117 6.940 10.500 1.00 35.33 ? 397 ILE A N 1 ATOM 736 C CA . ILE A 1 97 ? -60.598 5.663 10.022 1.00 38.75 ? 397 ILE A CA 1 ATOM 737 C C . ILE A 1 97 ? -60.781 4.523 11.033 1.00 42.42 ? 397 ILE A C 1 ATOM 738 O O . ILE A 1 97 ? -60.240 4.553 12.142 1.00 38.51 ? 397 ILE A O 1 ATOM 739 C CB . ILE A 1 97 ? -59.113 5.785 9.626 1.00 41.89 ? 397 ILE A CB 1 ATOM 740 C CG1 . ILE A 1 97 ? -58.953 6.856 8.546 1.00 41.49 ? 397 ILE A CG1 1 ATOM 741 C CG2 . ILE A 1 97 ? -58.552 4.437 9.147 1.00 35.17 ? 397 ILE A CG2 1 ATOM 742 C CD1 . ILE A 1 97 ? -57.514 7.143 8.187 1.00 41.77 ? 397 ILE A CD1 1 ATOM 743 N N . GLU A 1 98 ? -61.542 3.514 10.624 1.00 35.74 ? 398 GLU A N 1 ATOM 744 C CA . GLU A 1 98 ? -61.862 2.375 11.471 1.00 34.57 ? 398 GLU A CA 1 ATOM 745 C C . GLU A 1 98 ? -60.958 1.177 11.202 1.00 37.74 ? 398 GLU A C 1 ATOM 746 O O . GLU A 1 98 ? -60.435 1.019 10.100 1.00 38.39 ? 398 GLU A O 1 ATOM 747 C CB . GLU A 1 98 ? -63.309 1.962 11.244 1.00 33.59 ? 398 GLU A CB 1 ATOM 748 C CG . GLU A 1 98 ? -64.326 2.978 11.726 1.00 33.14 ? 398 GLU A CG 1 ATOM 749 C CD . GLU A 1 98 ? -65.754 2.499 11.526 1.00 43.39 ? 398 GLU A CD 1 ATOM 750 O OE1 . GLU A 1 98 ? -65.984 1.723 10.576 1.00 47.94 ? 398 GLU A OE1 1 ATOM 751 O OE2 . GLU A 1 98 ? -66.646 2.899 12.308 1.00 47.14 ? 398 GLU A OE2 1 ATOM 752 N N . TYR A 1 99 ? -60.794 0.326 12.214 1.00 32.37 ? 399 TYR A N 1 ATOM 753 C CA . TYR A 1 99 ? -59.972 -0.878 12.084 1.00 33.41 ? 399 TYR A CA 1 ATOM 754 C C . TYR A 1 99 ? -60.342 -1.939 13.117 1.00 29.94 ? 399 TYR A C 1 ATOM 755 O O . TYR A 1 99 ? -60.929 -1.626 14.156 1.00 27.62 ? 399 TYR A O 1 ATOM 756 C CB . TYR A 1 99 ? -58.492 -0.528 12.210 1.00 34.92 ? 399 TYR A CB 1 ATOM 757 C CG . TYR A 1 99 ? -58.201 0.385 13.368 1.00 32.59 ? 399 TYR A CG 1 ATOM 758 C CD1 . TYR A 1 99 ? -57.814 -0.123 14.602 1.00 35.90 ? 399 TYR A CD1 1 ATOM 759 C CD2 . TYR A 1 99 ? -58.330 1.755 13.238 1.00 32.93 ? 399 TYR A CD2 1 ATOM 760 C CE1 . TYR A 1 99 ? -57.556 0.720 15.671 1.00 32.67 ? 399 TYR A CE1 1 ATOM 761 C CE2 . TYR A 1 99 ? -58.075 2.604 14.299 1.00 34.91 ? 399 TYR A CE2 1 ATOM 762 C CZ . TYR A 1 99 ? -57.684 2.086 15.515 1.00 39.84 ? 399 TYR A CZ 1 ATOM 763 O OH . TYR A 1 99 ? -57.428 2.936 16.575 1.00 38.47 ? 399 TYR A OH 1 ATOM 764 N N . ALA A 1 100 ? -60.019 -3.195 12.806 1.00 28.81 ? 400 ALA A N 1 ATOM 765 C CA . ALA A 1 100 ? -60.155 -4.305 13.751 1.00 30.51 ? 400 ALA A CA 1 ATOM 766 C C . ALA A 1 100 ? -59.169 -4.134 14.908 1.00 29.35 ? 400 ALA A C 1 ATOM 767 O O . ALA A 1 100 ? -58.055 -3.641 14.711 1.00 28.76 ? 400 ALA A O 1 ATOM 768 C CB . ALA A 1 100 ? -59.910 -5.645 13.046 1.00 26.71 ? 400 ALA A CB 1 ATOM 769 N N . PRO A 1 101 ? -59.562 -4.574 16.114 1.00 27.32 ? 401 PRO A N 1 ATOM 770 C CA . PRO A 1 101 ? -58.779 -4.317 17.328 1.00 33.94 ? 401 PRO A CA 1 ATOM 771 C C . PRO A 1 101 ? -57.310 -4.701 17.190 1.00 29.70 ? 401 PRO A C 1 ATOM 772 O O . PRO A 1 101 ? -56.985 -5.706 16.576 1.00 24.53 ? 401 PRO A O 1 ATOM 773 C CB . PRO A 1 101 ? -59.455 -5.203 18.376 1.00 24.37 ? 401 PRO A CB 1 ATOM 774 C CG . PRO A 1 101 ? -60.852 -5.389 17.869 1.00 29.84 ? 401 PRO A CG 1 ATOM 775 C CD . PRO A 1 101 ? -60.739 -5.419 16.381 1.00 27.14 ? 401 PRO A CD 1 ATOM 776 N N . LYS A 1 102 ? -56.434 -3.880 17.753 1.00 26.47 ? 402 LYS A N 1 ATOM 777 C CA . LYS A 1 102 ? -55.016 -4.187 17.794 1.00 28.21 ? 402 LYS A CA 1 ATOM 778 C C . LYS A 1 102 ? -54.621 -4.315 19.256 1.00 30.63 ? 402 LYS A C 1 ATOM 779 O O . LYS A 1 102 ? -55.122 -3.583 20.110 1.00 32.86 ? 402 LYS A O 1 ATOM 780 C CB . LYS A 1 102 ? -54.202 -3.071 17.138 1.00 32.08 ? 402 LYS A CB 1 ATOM 781 C CG . LYS A 1 102 ? -54.588 -2.745 15.708 1.00 35.95 ? 402 LYS A CG 1 ATOM 782 C CD . LYS A 1 102 ? -53.903 -1.468 15.240 1.00 36.78 ? 402 LYS A CD 1 ATOM 783 C CE . LYS A 1 102 ? -54.356 -1.062 13.845 1.00 41.52 ? 402 LYS A CE 1 ATOM 784 N NZ . LYS A 1 102 ? -53.901 -2.017 12.794 1.00 44.04 ? 402 LYS A NZ 1 ATOM 785 N N . PHE A 1 103 ? -53.727 -5.250 19.543 1.00 30.65 ? 403 PHE A N 1 ATOM 786 C CA . PHE A 1 103 ? -53.249 -5.466 20.902 1.00 31.49 ? 403 PHE A CA 1 ATOM 787 C C . PHE A 1 103 ? -51.890 -4.801 21.079 1.00 30.45 ? 403 PHE A C 1 ATOM 788 O O . PHE A 1 103 ? -50.963 -5.067 20.319 1.00 32.02 ? 403 PHE A O 1 ATOM 789 C CB . PHE A 1 103 ? -53.143 -6.966 21.182 1.00 31.87 ? 403 PHE A CB 1 ATOM 790 C CG . PHE A 1 103 ? -54.453 -7.691 21.093 1.00 34.03 ? 403 PHE A CG 1 ATOM 791 C CD1 . PHE A 1 103 ? -55.211 -7.913 22.228 1.00 27.57 ? 403 PHE A CD1 1 ATOM 792 C CD2 . PHE A 1 103 ? -54.936 -8.138 19.871 1.00 34.13 ? 403 PHE A CD2 1 ATOM 793 C CE1 . PHE A 1 103 ? -56.422 -8.574 22.153 1.00 28.67 ? 403 PHE A CE1 1 ATOM 794 C CE2 . PHE A 1 103 ? -56.148 -8.802 19.790 1.00 31.95 ? 403 PHE A CE2 1 ATOM 795 C CZ . PHE A 1 103 ? -56.891 -9.018 20.932 1.00 32.10 ? 403 PHE A CZ 1 ATOM 796 N N . ILE A 1 104 ? -51.771 -3.931 22.073 1.00 27.76 ? 404 ILE A N 1 ATOM 797 C CA . ILE A 1 104 ? -50.514 -3.227 22.290 1.00 30.43 ? 404 ILE A CA 1 ATOM 798 C C . ILE A 1 104 ? -49.816 -3.575 23.610 1.00 36.61 ? 404 ILE A C 1 ATOM 799 O O . ILE A 1 104 ? -48.901 -2.868 24.030 1.00 41.73 ? 404 ILE A O 1 ATOM 800 C CB . ILE A 1 104 ? -50.707 -1.706 22.212 1.00 36.33 ? 404 ILE A CB 1 ATOM 801 C CG1 . ILE A 1 104 ? -51.596 -1.228 23.355 1.00 32.83 ? 404 ILE A CG1 1 ATOM 802 C CG2 . ILE A 1 104 ? -51.308 -1.314 20.870 1.00 39.06 ? 404 ILE A CG2 1 ATOM 803 C CD1 . ILE A 1 104 ? -52.219 0.127 23.101 1.00 42.07 ? 404 ILE A CD1 1 ATOM 804 N N . SER A 1 105 ? -50.249 -4.660 24.251 1.00 32.10 ? 405 SER A N 1 ATOM 805 C CA . SER A 1 105 ? -49.601 -5.180 25.453 1.00 39.12 ? 405 SER A CA 1 ATOM 806 C C . SER A 1 105 ? -48.129 -5.528 25.215 1.00 41.63 ? 405 SER A C 1 ATOM 807 O O . SER A 1 105 ? -47.799 -6.232 24.271 1.00 37.78 ? 405 SER A O 1 ATOM 808 C CB . SER A 1 105 ? -50.342 -6.419 25.965 1.00 39.19 ? 405 SER A CB 1 ATOM 809 O OG . SER A 1 105 ? -51.586 -6.068 26.546 1.00 46.41 ? 405 SER A OG 1 ATOM 810 N N . ASN A 1 106 ? -47.251 -5.039 26.086 1.00 49.70 ? 406 ASN A N 1 ATOM 811 C CA . ASN A 1 106 ? -45.821 -5.315 25.968 1.00 53.50 ? 406 ASN A CA 1 ATOM 812 C C . ASN A 1 106 ? -45.383 -6.653 26.580 1.00 51.35 ? 406 ASN A C 1 ATOM 813 O O . ASN A 1 106 ? -44.236 -7.069 26.417 1.00 51.56 ? 406 ASN A O 1 ATOM 814 C CB . ASN A 1 106 ? -44.995 -4.162 26.558 1.00 64.40 ? 406 ASN A CB 1 ATOM 815 C CG . ASN A 1 106 ? -45.114 -4.060 28.077 1.00 89.80 ? 406 ASN A CG 1 ATOM 816 O OD1 . ASN A 1 106 ? -44.353 -3.332 28.724 1.00 75.55 ? 406 ASN A OD1 1 ATOM 817 N ND2 . ASN A 1 106 ? -46.069 -4.788 28.650 1.00 71.68 ? 406 ASN A ND2 1 ATOM 818 N N . GLN A 1 107 ? -46.296 -7.326 27.274 1.00 46.77 ? 407 GLN A N 1 ATOM 819 C CA . GLN A 1 107 ? -45.966 -8.576 27.956 1.00 40.24 ? 407 GLN A CA 1 ATOM 820 C C . GLN A 1 107 ? -47.059 -9.630 27.784 1.00 33.78 ? 407 GLN A C 1 ATOM 821 O O . GLN A 1 107 ? -48.211 -9.406 28.154 1.00 34.37 ? 407 GLN A O 1 ATOM 822 C CB . GLN A 1 107 ? -45.716 -8.305 29.445 1.00 37.50 ? 407 GLN A CB 1 ATOM 823 C CG . GLN A 1 107 ? -45.465 -9.538 30.292 1.00 36.57 ? 407 GLN A CG 1 ATOM 824 C CD . GLN A 1 107 ? -45.141 -9.191 31.743 1.00 32.29 ? 407 GLN A CD 1 ATOM 825 O OE1 . GLN A 1 107 ? -45.018 -8.023 32.097 1.00 36.03 ? 407 GLN A OE1 1 ATOM 826 N NE2 . GLN A 1 107 ? -45.001 -10.209 32.583 1.00 29.12 ? 407 GLN A NE2 1 ATOM 827 N N . THR A 1 108 ? -46.691 -10.786 27.236 1.00 30.26 ? 408 THR A N 1 ATOM 828 C CA . THR A 1 108 ? -47.647 -11.880 27.048 1.00 31.21 ? 408 THR A CA 1 ATOM 829 C C . THR A 1 108 ? -47.257 -13.187 27.759 1.00 33.45 ? 408 THR A C 1 ATOM 830 O O . THR A 1 108 ? -48.028 -14.146 27.788 1.00 33.60 ? 408 THR A O 1 ATOM 831 C CB . THR A 1 108 ? -47.921 -12.144 25.548 1.00 37.97 ? 408 THR A CB 1 ATOM 832 O OG1 . THR A 1 108 ? -46.719 -12.587 24.908 1.00 38.45 ? 408 THR A OG1 1 ATOM 833 C CG2 . THR A 1 108 ? -48.426 -10.866 24.856 1.00 27.86 ? 408 THR A CG2 1 ATOM 834 N N . ILE A 1 109 ? -46.065 -13.229 28.340 1.00 33.14 ? 409 ILE A N 1 ATOM 835 C CA . ILE A 1 109 ? -45.693 -14.374 29.165 1.00 35.38 ? 409 ILE A CA 1 ATOM 836 C C . ILE A 1 109 ? -45.556 -13.967 30.637 1.00 32.13 ? 409 ILE A C 1 ATOM 837 O O . ILE A 1 109 ? -44.795 -13.059 30.978 1.00 34.92 ? 409 ILE A O 1 ATOM 838 C CB . ILE A 1 109 ? -44.417 -15.059 28.651 1.00 33.59 ? 409 ILE A CB 1 ATOM 839 C CG1 . ILE A 1 109 ? -44.631 -15.531 27.214 1.00 37.59 ? 409 ILE A CG1 1 ATOM 840 C CG2 . ILE A 1 109 ? -44.068 -16.249 29.519 1.00 33.51 ? 409 ILE A CG2 1 ATOM 841 C CD1 . ILE A 1 109 ? -43.423 -16.209 26.609 1.00 34.94 ? 409 ILE A CD1 1 ATOM 842 N N . TYR A 1 110 ? -46.325 -14.625 31.500 1.00 30.02 ? 410 TYR A N 1 ATOM 843 C CA . TYR A 1 110 ? -46.338 -14.293 32.921 1.00 32.54 ? 410 TYR A CA 1 ATOM 844 C C . TYR A 1 110 ? -45.972 -15.494 33.786 1.00 35.09 ? 410 TYR A C 1 ATOM 845 O O . TYR A 1 110 ? -46.268 -16.638 33.429 1.00 28.14 ? 410 TYR A O 1 ATOM 846 C CB . TYR A 1 110 ? -47.720 -13.809 33.337 1.00 32.45 ? 410 TYR A CB 1 ATOM 847 C CG . TYR A 1 110 ? -48.101 -12.415 32.894 1.00 31.42 ? 410 TYR A CG 1 ATOM 848 C CD1 . TYR A 1 110 ? -48.036 -11.346 33.778 1.00 27.07 ? 410 TYR A CD1 1 ATOM 849 C CD2 . TYR A 1 110 ? -48.571 -12.176 31.605 1.00 26.71 ? 410 TYR A CD2 1 ATOM 850 C CE1 . TYR A 1 110 ? -48.411 -10.071 33.387 1.00 34.44 ? 410 TYR A CE1 1 ATOM 851 C CE2 . TYR A 1 110 ? -48.955 -10.904 31.206 1.00 29.14 ? 410 TYR A CE2 1 ATOM 852 C CZ . TYR A 1 110 ? -48.872 -9.857 32.097 1.00 32.97 ? 410 TYR A CZ 1 ATOM 853 O OH . TYR A 1 110 ? -49.251 -8.599 31.694 1.00 32.82 ? 410 TYR A OH 1 ATOM 854 N N . TYR A 1 111 ? -45.368 -15.225 34.942 1.00 29.59 ? 411 TYR A N 1 ATOM 855 C CA . TYR A 1 111 ? -44.905 -16.290 35.820 1.00 28.75 ? 411 TYR A CA 1 ATOM 856 C C . TYR A 1 111 ? -45.484 -16.205 37.222 1.00 26.97 ? 411 TYR A C 1 ATOM 857 O O . TYR A 1 111 ? -45.491 -15.142 37.837 1.00 31.15 ? 411 TYR A O 1 ATOM 858 C CB . TYR A 1 111 ? -43.382 -16.273 35.917 1.00 32.60 ? 411 TYR A CB 1 ATOM 859 C CG . TYR A 1 111 ? -42.666 -16.756 34.681 1.00 30.14 ? 411 TYR A CG 1 ATOM 860 C CD1 . TYR A 1 111 ? -42.279 -18.081 34.557 1.00 32.60 ? 411 TYR A CD1 1 ATOM 861 C CD2 . TYR A 1 111 ? -42.359 -15.884 33.649 1.00 33.44 ? 411 TYR A CD2 1 ATOM 862 C CE1 . TYR A 1 111 ? -41.608 -18.528 33.433 1.00 35.66 ? 411 TYR A CE1 1 ATOM 863 C CE2 . TYR A 1 111 ? -41.687 -16.320 32.518 1.00 38.37 ? 411 TYR A CE2 1 ATOM 864 C CZ . TYR A 1 111 ? -41.314 -17.642 32.417 1.00 37.84 ? 411 TYR A CZ 1 ATOM 865 O OH . TYR A 1 111 ? -40.653 -18.084 31.294 1.00 44.43 ? 411 TYR A OH 1 ATOM 866 N N . SER A 1 112 ? -45.943 -17.341 37.733 1.00 31.45 ? 412 SER A N 1 ATOM 867 C CA . SER A 1 112 ? -46.404 -17.411 39.111 1.00 36.26 ? 412 SER A CA 1 ATOM 868 C C . SER A 1 112 ? -46.268 -18.830 39.651 1.00 35.07 ? 412 SER A C 1 ATOM 869 O O . SER A 1 112 ? -45.615 -19.678 39.039 1.00 32.60 ? 412 SER A O 1 ATOM 870 C CB . SER A 1 112 ? -47.855 -16.943 39.215 1.00 32.43 ? 412 SER A CB 1 ATOM 871 O OG . SER A 1 112 ? -48.140 -16.480 40.525 1.00 37.84 ? 412 SER A OG 1 ATOM 872 N N . TRP A 1 113 ? -46.900 -19.092 40.789 1.00 34.87 ? 413 TRP A N 1 ATOM 873 C CA . TRP A 1 113 ? -46.839 -20.417 41.396 1.00 38.47 ? 413 TRP A CA 1 ATOM 874 C C . TRP A 1 113 ? -48.048 -20.654 42.306 1.00 38.54 ? 413 TRP A C 1 ATOM 875 O O . TRP A 1 113 ? -48.709 -19.699 42.711 1.00 36.01 ? 413 TRP A O 1 ATOM 876 C CB . TRP A 1 113 ? -45.522 -20.580 42.166 1.00 36.24 ? 413 TRP A CB 1 ATOM 877 C CG . TRP A 1 113 ? -45.337 -19.585 43.288 1.00 29.68 ? 413 TRP A CG 1 ATOM 878 C CD1 . TRP A 1 113 ? -45.656 -19.765 44.610 1.00 32.39 ? 413 TRP A CD1 1 ATOM 879 C CD2 . TRP A 1 113 ? -44.792 -18.267 43.188 1.00 27.30 ? 413 TRP A CD2 1 ATOM 880 N NE1 . TRP A 1 113 ? -45.345 -18.639 45.330 1.00 30.75 ? 413 TRP A NE1 1 ATOM 881 C CE2 . TRP A 1 113 ? -44.815 -17.703 44.482 1.00 26.60 ? 413 TRP A CE2 1 ATOM 882 C CE3 . TRP A 1 113 ? -44.287 -17.506 42.133 1.00 33.21 ? 413 TRP A CE3 1 ATOM 883 C CZ2 . TRP A 1 113 ? -44.348 -16.422 44.747 1.00 31.00 ? 413 TRP A CZ2 1 ATOM 884 C CZ3 . TRP A 1 113 ? -43.828 -16.230 42.398 1.00 32.91 ? 413 TRP A CZ3 1 ATOM 885 C CH2 . TRP A 1 113 ? -43.863 -15.700 43.693 1.00 34.84 ? 413 TRP A CH2 1 ATOM 886 N N . GLU A 1 114 ? -48.337 -21.920 42.615 1.00 40.13 ? 414 GLU A N 1 ATOM 887 C CA . GLU A 1 114 ? -49.500 -22.260 43.437 1.00 43.70 ? 414 GLU A CA 1 ATOM 888 C C . GLU A 1 114 ? -49.645 -21.320 44.627 1.00 42.29 ? 414 GLU A C 1 ATOM 889 O O . GLU A 1 114 ? -48.695 -21.092 45.365 1.00 39.39 ? 414 GLU A O 1 ATOM 890 C CB . GLU A 1 114 ? -49.426 -23.706 43.933 1.00 49.82 ? 414 GLU A CB 1 ATOM 891 C CG . GLU A 1 114 ? -49.931 -24.747 42.941 1.00 62.53 ? 414 GLU A CG 1 ATOM 892 C CD . GLU A 1 114 ? -48.842 -25.257 42.015 1.00 84.15 ? 414 GLU A CD 1 ATOM 893 O OE1 . GLU A 1 114 ? -47.671 -24.854 42.193 1.00 74.45 ? 414 GLU A OE1 1 ATOM 894 O OE2 . GLU A 1 114 ? -49.155 -26.069 41.115 1.00 74.53 ? 414 GLU A OE2 1 ATOM 895 N N . GLY A 1 115 ? -50.836 -20.761 44.797 1.00 42.93 ? 415 GLY A N 1 ATOM 896 C CA . GLY A 1 115 ? -51.112 -19.913 45.942 1.00 35.25 ? 415 GLY A CA 1 ATOM 897 C C . GLY A 1 115 ? -50.680 -18.470 45.803 1.00 36.36 ? 415 GLY A C 1 ATOM 898 O O . GLY A 1 115 ? -50.848 -17.684 46.737 1.00 36.73 ? 415 GLY A O 1 ATOM 899 N N . ASN A 1 116 ? -50.125 -18.113 44.646 1.00 36.32 ? 416 ASN A N 1 ATOM 900 C CA . ASN A 1 116 ? -49.703 -16.732 44.394 1.00 36.56 ? 416 ASN A CA 1 ATOM 901 C C . ASN A 1 116 ? -50.543 -16.028 43.318 1.00 38.99 ? 416 ASN A C 1 ATOM 902 O O . ASN A 1 116 ? -50.383 -16.280 42.120 1.00 36.42 ? 416 ASN A O 1 ATOM 903 C CB . ASN A 1 116 ? -48.219 -16.687 44.019 1.00 31.61 ? 416 ASN A CB 1 ATOM 904 C CG . ASN A 1 116 ? -47.696 -15.267 43.867 1.00 36.72 ? 416 ASN A CG 1 ATOM 905 O OD1 . ASN A 1 116 ? -47.034 -14.943 42.881 1.00 38.58 ? 416 ASN A OD1 1 ATOM 906 N ND2 . ASN A 1 116 ? -48.001 -14.410 44.839 1.00 36.37 ? 416 ASN A ND2 1 ATOM 907 N N . PRO A 1 117 ? -51.444 -15.138 43.745 1.00 38.07 ? 417 PRO A N 1 ATOM 908 C CA . PRO A 1 117 ? -52.347 -14.442 42.821 1.00 33.81 ? 417 PRO A CA 1 ATOM 909 C C . PRO A 1 117 ? -51.611 -13.526 41.846 1.00 31.15 ? 417 PRO A C 1 ATOM 910 O O . PRO A 1 117 ? -50.710 -12.784 42.240 1.00 33.43 ? 417 PRO A O 1 ATOM 911 C CB . PRO A 1 117 ? -53.232 -13.613 43.757 1.00 37.10 ? 417 PRO A CB 1 ATOM 912 C CG . PRO A 1 117 ? -53.133 -14.297 45.086 1.00 36.90 ? 417 PRO A CG 1 ATOM 913 C CD . PRO A 1 117 ? -51.733 -14.812 45.149 1.00 35.45 ? 417 PRO A CD 1 ATOM 914 N N . ILE A 1 118 ? -52.012 -13.570 40.579 1.00 33.71 ? 418 ILE A N 1 ATOM 915 C CA . ILE A 1 118 ? -51.395 -12.731 39.561 1.00 31.47 ? 418 ILE A CA 1 ATOM 916 C C . ILE A 1 118 ? -52.412 -12.166 38.564 1.00 29.44 ? 418 ILE A C 1 ATOM 917 O O . ILE A 1 118 ? -53.342 -12.855 38.135 1.00 30.50 ? 418 ILE A O 1 ATOM 918 C CB . ILE A 1 118 ? -50.270 -13.497 38.835 1.00 29.01 ? 418 ILE A CB 1 ATOM 919 C CG1 . ILE A 1 118 ? -49.549 -12.599 37.839 1.00 33.07 ? 418 ILE A CG1 1 ATOM 920 C CG2 . ILE A 1 118 ? -50.807 -14.746 38.173 1.00 30.96 ? 418 ILE A CG2 1 ATOM 921 C CD1 . ILE A 1 118 ? -48.237 -13.187 37.380 1.00 31.82 ? 418 ILE A CD1 1 ATOM 922 N N . ASN A 1 119 ? -52.224 -10.897 38.218 1.00 25.51 ? 419 ASN A N 1 ATOM 923 C CA . ASN A 1 119 ? -53.053 -10.202 37.251 1.00 27.15 ? 419 ASN A CA 1 ATOM 924 C C . ASN A 1 119 ? -52.371 -10.180 35.889 1.00 32.82 ? 419 ASN A C 1 ATOM 925 O O . ASN A 1 119 ? -51.250 -9.698 35.773 1.00 30.14 ? 419 ASN A O 1 ATOM 926 C CB . ASN A 1 119 ? -53.257 -8.746 37.688 1.00 27.23 ? 419 ASN A CB 1 ATOM 927 C CG . ASN A 1 119 ? -54.425 -8.561 38.643 1.00 26.35 ? 419 ASN A CG 1 ATOM 928 O OD1 . ASN A 1 119 ? -55.207 -9.476 38.883 1.00 22.08 ? 419 ASN A OD1 1 ATOM 929 N ND2 . ASN A 1 119 ? -54.539 -7.352 39.193 1.00 27.92 ? 419 ASN A ND2 1 ATOM 930 N N . ILE A 1 120 ? -53.040 -10.674 34.853 1.00 32.26 ? 420 ILE A N 1 ATOM 931 C CA . ILE A 1 120 ? -52.517 -10.514 33.495 1.00 30.79 ? 420 ILE A CA 1 ATOM 932 C C . ILE A 1 120 ? -53.317 -9.449 32.739 1.00 29.87 ? 420 ILE A C 1 ATOM 933 O O . ILE A 1 120 ? -54.541 -9.406 32.815 1.00 28.27 ? 420 ILE A O 1 ATOM 934 C CB . ILE A 1 120 ? -52.490 -11.843 32.727 1.00 30.08 ? 420 ILE A CB 1 ATOM 935 C CG1 . ILE A 1 120 ? -53.890 -12.222 32.266 1.00 31.11 ? 420 ILE A CG1 1 ATOM 936 C CG2 . ILE A 1 120 ? -51.911 -12.959 33.604 1.00 26.11 ? 420 ILE A CG2 1 ATOM 937 C CD1 . ILE A 1 120 ? -54.005 -13.660 31.822 1.00 35.41 ? 420 ILE A CD1 1 ATOM 938 N N . SER A 1 121 ? -52.621 -8.567 32.033 1.00 29.93 ? 421 SER A N 1 ATOM 939 C CA . SER A 1 121 ? -53.283 -7.420 31.430 1.00 33.81 ? 421 SER A CA 1 ATOM 940 C C . SER A 1 121 ? -53.350 -7.511 29.913 1.00 33.44 ? 421 SER A C 1 ATOM 941 O O . SER A 1 121 ? -52.366 -7.834 29.256 1.00 29.27 ? 421 SER A O 1 ATOM 942 C CB . SER A 1 121 ? -52.590 -6.116 31.837 1.00 34.42 ? 421 SER A CB 1 ATOM 943 O OG . SER A 1 121 ? -51.462 -5.868 31.020 1.00 50.19 ? 421 SER A OG 1 ATOM 944 N N . CYS A 1 122 ? -54.523 -7.210 29.371 1.00 36.04 ? 422 CYS A N 1 ATOM 945 C CA . CYS A 1 122 ? -54.735 -7.158 27.927 1.00 38.17 ? 422 CYS A CA 1 ATOM 946 C C . CYS A 1 122 ? -55.041 -5.715 27.558 1.00 33.10 ? 422 CYS A C 1 ATOM 947 O O . CYS A 1 122 ? -55.978 -5.123 28.088 1.00 38.36 ? 422 CYS A O 1 ATOM 948 C CB . CYS A 1 122 ? -55.911 -8.067 27.540 1.00 36.91 ? 422 CYS A CB 1 ATOM 949 S SG . CYS A 1 122 ? -56.344 -8.175 25.768 1.00 45.06 ? 422 CYS A SG 1 ATOM 950 N N . ASP A 1 123 ? -54.256 -5.140 26.656 1.00 38.15 ? 423 ASP A N 1 ATOM 951 C CA . ASP A 1 123 ? -54.449 -3.743 26.281 1.00 38.38 ? 423 ASP A CA 1 ATOM 952 C C . ASP A 1 123 ? -54.773 -3.638 24.795 1.00 39.87 ? 423 ASP A C 1 ATOM 953 O O . ASP A 1 123 ? -54.064 -4.200 23.951 1.00 35.95 ? 423 ASP A O 1 ATOM 954 C CB . ASP A 1 123 ? -53.201 -2.926 26.620 1.00 45.69 ? 423 ASP A CB 1 ATOM 955 C CG . ASP A 1 123 ? -53.461 -1.437 26.607 1.00 64.29 ? 423 ASP A CG 1 ATOM 956 O OD1 . ASP A 1 123 ? -54.586 -1.040 26.244 1.00 62.07 ? 423 ASP A OD1 1 ATOM 957 O OD2 . ASP A 1 123 ? -52.544 -0.664 26.963 1.00 95.15 ? 423 ASP A OD2 1 ATOM 958 N N . VAL A 1 124 ? -55.843 -2.914 24.473 1.00 39.68 ? 424 VAL A N 1 ATOM 959 C CA . VAL A 1 124 ? -56.352 -2.900 23.107 1.00 33.97 ? 424 VAL A CA 1 ATOM 960 C C . VAL A 1 124 ? -56.711 -1.511 22.587 1.00 29.37 ? 424 VAL A C 1 ATOM 961 O O . VAL A 1 124 ? -57.484 -0.788 23.212 1.00 27.93 ? 424 VAL A O 1 ATOM 962 C CB . VAL A 1 124 ? -57.615 -3.789 22.985 1.00 32.65 ? 424 VAL A CB 1 ATOM 963 C CG1 . VAL A 1 124 ? -58.169 -3.723 21.580 1.00 35.37 ? 424 VAL A CG1 1 ATOM 964 C CG2 . VAL A 1 124 ? -57.311 -5.221 23.385 1.00 35.45 ? 424 VAL A CG2 1 ATOM 965 N N . LYS A 1 125 ? -56.169 -1.155 21.426 1.00 28.77 ? 425 LYS A N 1 ATOM 966 C CA . LYS A 1 125 ? -56.681 -0.008 20.680 1.00 32.34 ? 425 LYS A CA 1 ATOM 967 C C . LYS A 1 125 ? -57.605 -0.459 19.532 1.00 35.59 ? 425 LYS A C 1 ATOM 968 O O . LYS A 1 125 ? -57.279 -1.375 18.777 1.00 31.83 ? 425 LYS A O 1 ATOM 969 C CB . LYS A 1 125 ? -55.539 0.871 20.154 1.00 41.38 ? 425 LYS A CB 1 ATOM 970 C CG . LYS A 1 125 ? -54.735 0.263 19.020 1.00 47.73 ? 425 LYS A CG 1 ATOM 971 C CD . LYS A 1 125 ? -53.729 1.255 18.442 1.00 46.45 ? 425 LYS A CD 1 ATOM 972 C CE . LYS A 1 125 ? -54.405 2.498 17.872 1.00 53.14 ? 425 LYS A CE 1 ATOM 973 N NZ . LYS A 1 125 ? -53.430 3.403 17.191 1.00 52.93 ? 425 LYS A NZ 1 ATOM 974 N N . SER A 1 126 ? -58.770 0.171 19.417 1.00 36.36 ? 426 SER A N 1 ATOM 975 C CA . SER A 1 126 ? -59.703 -0.166 18.344 1.00 37.06 ? 426 SER A CA 1 ATOM 976 C C . SER A 1 126 ? -60.688 0.964 18.083 1.00 37.82 ? 426 SER A C 1 ATOM 977 O O . SER A 1 126 ? -60.994 1.749 18.981 1.00 35.37 ? 426 SER A O 1 ATOM 978 C CB . SER A 1 126 ? -60.467 -1.453 18.668 1.00 34.82 ? 426 SER A CB 1 ATOM 979 O OG . SER A 1 126 ? -61.514 -1.205 19.590 1.00 40.34 ? 426 SER A OG 1 ATOM 980 N N . ASN A 1 127 ? -61.180 1.036 16.848 1.00 32.75 ? 427 ASN A N 1 ATOM 981 C CA . ASN A 1 127 ? -62.173 2.038 16.452 1.00 33.96 ? 427 ASN A CA 1 ATOM 982 C C . ASN A 1 127 ? -63.139 1.433 15.440 1.00 32.09 ? 427 ASN A C 1 ATOM 983 O O . ASN A 1 127 ? -62.739 1.061 14.334 1.00 29.91 ? 427 ASN A O 1 ATOM 984 C CB . ASN A 1 127 ? -61.483 3.279 15.868 1.00 31.09 ? 427 ASN A CB 1 ATOM 985 C CG . ASN A 1 127 ? -62.467 4.286 15.270 1.00 34.32 ? 427 ASN A CG 1 ATOM 986 O OD1 . ASN A 1 127 ? -63.530 4.558 15.828 1.00 32.02 ? 427 ASN A OD1 1 ATOM 987 N ND2 . ASN A 1 127 ? -62.099 4.851 14.130 1.00 36.83 ? 427 ASN A ND2 1 ATOM 988 N N . PRO A 1 128 ? -64.417 1.315 15.817 1.00 32.73 ? 428 PRO A N 1 ATOM 989 C CA . PRO A 1 128 ? -64.989 1.724 17.104 1.00 32.05 ? 428 PRO A CA 1 ATOM 990 C C . PRO A 1 128 ? -64.485 0.850 18.240 1.00 36.00 ? 428 PRO A C 1 ATOM 991 O O . PRO A 1 128 ? -63.867 -0.179 17.981 1.00 39.55 ? 428 PRO A O 1 ATOM 992 C CB . PRO A 1 128 ? -66.495 1.473 16.921 1.00 32.62 ? 428 PRO A CB 1 ATOM 993 C CG . PRO A 1 128 ? -66.697 1.175 15.489 1.00 36.50 ? 428 PRO A CG 1 ATOM 994 C CD . PRO A 1 128 ? -65.412 0.653 14.961 1.00 36.90 ? 428 PRO A CD 1 ATOM 995 N N . PRO A 1 129 ? -64.767 1.247 19.486 1.00 37.73 ? 429 PRO A N 1 ATOM 996 C CA . PRO A 1 129 ? -64.368 0.488 20.677 1.00 40.12 ? 429 PRO A CA 1 ATOM 997 C C . PRO A 1 129 ? -64.792 -0.975 20.591 1.00 42.14 ? 429 PRO A C 1 ATOM 998 O O . PRO A 1 129 ? -65.871 -1.262 20.079 1.00 41.97 ? 429 PRO A O 1 ATOM 999 C CB . PRO A 1 129 ? -65.127 1.190 21.803 1.00 41.70 ? 429 PRO A CB 1 ATOM 1000 C CG . PRO A 1 129 ? -65.297 2.606 21.311 1.00 40.02 ? 429 PRO A CG 1 ATOM 1001 C CD . PRO A 1 129 ? -65.465 2.501 19.826 1.00 37.42 ? 429 PRO A CD 1 ATOM 1002 N N . ALA A 1 130 ? -63.949 -1.879 21.086 1.00 34.06 ? 430 ALA A N 1 ATOM 1003 C CA . ALA A 1 130 ? -64.219 -3.309 21.021 1.00 38.47 ? 430 ALA A CA 1 ATOM 1004 C C . ALA A 1 130 ? -64.898 -3.819 22.278 1.00 39.89 ? 430 ALA A C 1 ATOM 1005 O O . ALA A 1 130 ? -64.846 -3.182 23.328 1.00 35.64 ? 430 ALA A O 1 ATOM 1006 C CB . ALA A 1 130 ? -62.927 -4.082 20.794 1.00 34.30 ? 430 ALA A CB 1 ATOM 1007 N N . SER A 1 131 ? -65.547 -4.971 22.156 1.00 36.94 ? 431 SER A N 1 ATOM 1008 C CA . SER A 1 131 ? -65.962 -5.727 23.319 1.00 39.44 ? 431 SER A CA 1 ATOM 1009 C C . SER A 1 131 ? -64.904 -6.802 23.502 1.00 33.17 ? 431 SER A C 1 ATOM 1010 O O . SER A 1 131 ? -64.482 -7.442 22.538 1.00 31.91 ? 431 SER A O 1 ATOM 1011 C CB . SER A 1 131 ? -67.359 -6.331 23.137 1.00 38.78 ? 431 SER A CB 1 ATOM 1012 O OG . SER A 1 131 ? -67.326 -7.488 22.327 1.00 40.55 ? 431 SER A OG 1 ATOM 1013 N N . ILE A 1 132 ? -64.482 -6.988 24.747 1.00 31.03 ? 432 ILE A N 1 ATOM 1014 C CA . ILE A 1 132 ? -63.281 -7.742 25.045 1.00 34.99 ? 432 ILE A CA 1 ATOM 1015 C C . ILE A 1 132 ? -63.591 -8.844 26.038 1.00 32.48 ? 432 ILE A C 1 ATOM 1016 O O . ILE A 1 132 ? -64.288 -8.626 27.019 1.00 35.33 ? 432 ILE A O 1 ATOM 1017 C CB . ILE A 1 132 ? -62.206 -6.803 25.616 1.00 33.00 ? 432 ILE A CB 1 ATOM 1018 C CG1 . ILE A 1 132 ? -61.893 -5.710 24.595 1.00 29.94 ? 432 ILE A CG1 1 ATOM 1019 C CG2 . ILE A 1 132 ? -60.952 -7.562 25.955 1.00 32.00 ? 432 ILE A CG2 1 ATOM 1020 C CD1 . ILE A 1 132 ? -61.180 -4.509 25.167 1.00 39.79 ? 432 ILE A CD1 1 ATOM 1021 N N . HIS A 1 133 ? -63.089 -10.041 25.771 1.00 34.59 ? 433 HIS A N 1 ATOM 1022 C CA . HIS A 1 133 ? -63.277 -11.148 26.699 1.00 34.42 ? 433 HIS A CA 1 ATOM 1023 C C . HIS A 1 133 ? -62.033 -12.017 26.785 1.00 32.22 ? 433 HIS A C 1 ATOM 1024 O O . HIS A 1 133 ? -61.308 -12.200 25.799 1.00 28.84 ? 433 HIS A O 1 ATOM 1025 C CB . HIS A 1 133 ? -64.480 -12.016 26.303 1.00 38.55 ? 433 HIS A CB 1 ATOM 1026 C CG . HIS A 1 133 ? -65.786 -11.283 26.297 1.00 44.00 ? 433 HIS A CG 1 ATOM 1027 N ND1 . HIS A 1 133 ? -66.279 -10.654 25.175 1.00 45.50 ? 433 HIS A ND1 1 ATOM 1028 C CD2 . HIS A 1 133 ? -66.706 -11.093 27.272 1.00 42.48 ? 433 HIS A CD2 1 ATOM 1029 C CE1 . HIS A 1 133 ? -67.442 -10.095 25.462 1.00 45.16 ? 433 HIS A CE1 1 ATOM 1030 N NE2 . HIS A 1 133 ? -67.724 -10.347 26.727 1.00 42.70 ? 433 HIS A NE2 1 ATOM 1031 N N . TRP A 1 134 ? -61.793 -12.541 27.981 1.00 32.93 ? 434 TRP A N 1 ATOM 1032 C CA . TRP A 1 134 ? -60.788 -13.567 28.192 1.00 34.97 ? 434 TRP A CA 1 ATOM 1033 C C . TRP A 1 134 ? -61.461 -14.914 28.006 1.00 34.40 ? 434 TRP A C 1 ATOM 1034 O O . TRP A 1 134 ? -62.598 -15.104 28.444 1.00 36.31 ? 434 TRP A O 1 ATOM 1035 C CB . TRP A 1 134 ? -60.242 -13.484 29.612 1.00 32.30 ? 434 TRP A CB 1 ATOM 1036 C CG . TRP A 1 134 ? -59.280 -12.373 29.839 1.00 32.54 ? 434 TRP A CG 1 ATOM 1037 C CD1 . TRP A 1 134 ? -59.532 -11.179 30.450 1.00 30.41 ? 434 TRP A CD1 1 ATOM 1038 C CD2 . TRP A 1 134 ? -57.897 -12.356 29.474 1.00 28.46 ? 434 TRP A CD2 1 ATOM 1039 N NE1 . TRP A 1 134 ? -58.388 -10.416 30.486 1.00 32.34 ? 434 TRP A NE1 1 ATOM 1040 C CE2 . TRP A 1 134 ? -57.371 -11.115 29.893 1.00 29.48 ? 434 TRP A CE2 1 ATOM 1041 C CE3 . TRP A 1 134 ? -57.051 -13.270 28.838 1.00 28.10 ? 434 TRP A CE3 1 ATOM 1042 C CZ2 . TRP A 1 134 ? -56.034 -10.768 29.699 1.00 28.12 ? 434 TRP A CZ2 1 ATOM 1043 C CZ3 . TRP A 1 134 ? -55.726 -12.921 28.641 1.00 33.39 ? 434 TRP A CZ3 1 ATOM 1044 C CH2 . TRP A 1 134 ? -55.229 -11.683 29.074 1.00 29.74 ? 434 TRP A CH2 1 ATOM 1045 N N . ARG A 1 135 ? -60.767 -15.851 27.369 1.00 33.13 ? 435 ARG A N 1 ATOM 1046 C CA . ARG A 1 135 ? -61.330 -17.183 27.179 1.00 40.68 ? 435 ARG A CA 1 ATOM 1047 C C . ARG A 1 135 ? -60.304 -18.304 26.997 1.00 42.48 ? 435 ARG A C 1 ATOM 1048 O O . ARG A 1 135 ? -59.135 -18.062 26.683 1.00 39.81 ? 435 ARG A O 1 ATOM 1049 C CB . ARG A 1 135 ? -62.333 -17.181 26.017 1.00 47.11 ? 435 ARG A CB 1 ATOM 1050 C CG . ARG A 1 135 ? -62.062 -16.135 24.955 1.00 48.68 ? 435 ARG A CG 1 ATOM 1051 C CD . ARG A 1 135 ? -63.258 -15.945 24.030 1.00 52.85 ? 435 ARG A CD 1 ATOM 1052 N NE . ARG A 1 135 ? -63.193 -16.810 22.856 1.00 62.33 ? 435 ARG A NE 1 ATOM 1053 C CZ . ARG A 1 135 ? -64.111 -16.830 21.895 1.00 71.31 ? 435 ARG A CZ 1 ATOM 1054 N NH1 . ARG A 1 135 ? -65.169 -16.034 21.975 1.00 92.05 ? 435 ARG A NH1 1 ATOM 1055 N NH2 . ARG A 1 135 ? -63.975 -17.644 20.854 1.00 61.97 ? 435 ARG A NH2 1 ATOM 1056 N N . ARG A 1 136 ? -60.764 -19.531 27.227 1.00 46.66 ? 436 ARG A N 1 ATOM 1057 C CA . ARG A 1 136 ? -60.006 -20.739 26.919 1.00 49.70 ? 436 ARG A CA 1 ATOM 1058 C C . ARG A 1 136 ? -60.842 -21.635 26.004 1.00 51.84 ? 436 ARG A C 1 ATOM 1059 O O . ARG A 1 136 ? -61.904 -22.123 26.400 1.00 51.92 ? 436 ARG A O 1 ATOM 1060 C CB . ARG A 1 136 ? -59.639 -21.494 28.199 1.00 46.64 ? 436 ARG A CB 1 ATOM 1061 C CG . ARG A 1 136 ? -58.211 -21.284 28.670 1.00 43.47 ? 436 ARG A CG 1 ATOM 1062 C CD . ARG A 1 136 ? -57.857 -22.228 29.819 1.00 49.07 ? 436 ARG A CD 1 ATOM 1063 N NE . ARG A 1 136 ? -56.436 -22.171 30.159 1.00 46.98 ? 436 ARG A NE 1 ATOM 1064 C CZ . ARG A 1 136 ? -55.887 -22.769 31.213 1.00 46.24 ? 436 ARG A CZ 1 ATOM 1065 N NH1 . ARG A 1 136 ? -56.632 -23.480 32.050 1.00 44.66 ? 436 ARG A NH1 1 ATOM 1066 N NH2 . ARG A 1 136 ? -54.587 -22.654 31.431 1.00 47.01 ? 436 ARG A NH2 1 ATOM 1067 N N . ASP A 1 137 ? -60.371 -21.841 24.780 1.00 54.62 ? 437 ASP A N 1 ATOM 1068 C CA . ASP A 1 137 ? -61.116 -22.629 23.806 1.00 58.50 ? 437 ASP A CA 1 ATOM 1069 C C . ASP A 1 137 ? -62.581 -22.215 23.774 1.00 59.07 ? 437 ASP A C 1 ATOM 1070 O O . ASP A 1 137 ? -63.462 -23.012 24.109 1.00 63.05 ? 437 ASP A O 1 ATOM 1071 C CB . ASP A 1 137 ? -61.021 -24.119 24.134 1.00 58.16 ? 437 ASP A CB 1 ATOM 1072 C CG . ASP A 1 137 ? -59.598 -24.622 24.147 1.00 66.52 ? 437 ASP A CG 1 ATOM 1073 O OD1 . ASP A 1 137 ? -58.848 -24.309 23.198 1.00 69.93 ? 437 ASP A OD1 1 ATOM 1074 O OD2 . ASP A 1 137 ? -59.232 -25.338 25.103 1.00 70.12 ? 437 ASP A OD2 1 ATOM 1075 N N . LYS A 1 138 ? -62.837 -20.969 23.387 1.00 60.47 ? 438 LYS A N 1 ATOM 1076 C CA . LYS A 1 138 ? -64.208 -20.479 23.220 1.00 64.02 ? 438 LYS A CA 1 ATOM 1077 C C . LYS A 1 138 ? -65.014 -20.376 24.522 1.00 61.95 ? 438 LYS A C 1 ATOM 1078 O O . LYS A 1 138 ? -66.211 -20.096 24.488 1.00 65.10 ? 438 LYS A O 1 ATOM 1079 C CB . LYS A 1 138 ? -64.966 -21.346 22.206 1.00 68.51 ? 438 LYS A CB 1 ATOM 1080 C CG . LYS A 1 138 ? -64.286 -21.443 20.849 1.00 72.28 ? 438 LYS A CG 1 ATOM 1081 C CD . LYS A 1 138 ? -64.718 -22.689 20.090 1.00 84.94 ? 438 LYS A CD 1 ATOM 1082 C CE . LYS A 1 138 ? -63.814 -22.934 18.887 1.00 96.23 ? 438 LYS A CE 1 ATOM 1083 N NZ . LYS A 1 138 ? -63.962 -24.309 18.324 1.00 77.71 ? 438 LYS A NZ 1 ATOM 1084 N N . LEU A 1 139 ? -64.371 -20.595 25.665 1.00 57.95 ? 439 LEU A N 1 ATOM 1085 C CA . LEU A 1 139 ? -65.057 -20.460 26.950 1.00 53.05 ? 439 LEU A CA 1 ATOM 1086 C C . LEU A 1 139 ? -64.667 -19.153 27.656 1.00 49.92 ? 439 LEU A C 1 ATOM 1087 O O . LEU A 1 139 ? -63.509 -18.958 28.015 1.00 47.98 ? 439 LEU A O 1 ATOM 1088 C CB . LEU A 1 139 ? -64.778 -21.677 27.845 1.00 50.05 ? 439 LEU A CB 1 ATOM 1089 C CG . LEU A 1 139 ? -65.294 -21.645 29.290 1.00 50.02 ? 439 LEU A CG 1 ATOM 1090 C CD1 . LEU A 1 139 ? -66.800 -21.859 29.359 1.00 51.45 ? 439 LEU A CD1 1 ATOM 1091 C CD2 . LEU A 1 139 ? -64.572 -22.684 30.137 1.00 50.58 ? 439 LEU A CD2 1 ATOM 1092 N N . VAL A 1 140 ? -65.640 -18.264 27.844 1.00 41.52 ? 440 VAL A N 1 ATOM 1093 C CA . VAL A 1 140 ? -65.398 -16.971 28.475 1.00 43.37 ? 440 VAL A CA 1 ATOM 1094 C C . VAL A 1 140 ? -65.133 -17.106 29.970 1.00 41.81 ? 440 VAL A C 1 ATOM 1095 O O . VAL A 1 140 ? -65.809 -17.861 30.669 1.00 42.79 ? 440 VAL A O 1 ATOM 1096 C CB . VAL A 1 140 ? -66.592 -16.029 28.279 1.00 44.88 ? 440 VAL A CB 1 ATOM 1097 C CG1 . VAL A 1 140 ? -67.869 -16.711 28.728 1.00 55.32 ? 440 VAL A CG1 1 ATOM 1098 C CG2 . VAL A 1 140 ? -66.380 -14.738 29.058 1.00 42.08 ? 440 VAL A CG2 1 ATOM 1099 N N . LEU A 1 141 ? -64.166 -16.341 30.460 1.00 36.56 ? 441 LEU A N 1 ATOM 1100 C CA . LEU A 1 141 ? -63.706 -16.476 31.836 1.00 39.82 ? 441 LEU A CA 1 ATOM 1101 C C . LEU A 1 141 ? -63.939 -15.213 32.654 1.00 33.50 ? 441 LEU A C 1 ATOM 1102 O O . LEU A 1 141 ? -63.746 -14.104 32.166 1.00 32.10 ? 441 LEU A O 1 ATOM 1103 C CB . LEU A 1 141 ? -62.225 -16.838 31.836 1.00 34.83 ? 441 LEU A CB 1 ATOM 1104 C CG . LEU A 1 141 ? -61.943 -17.972 30.852 1.00 36.46 ? 441 LEU A CG 1 ATOM 1105 C CD1 . LEU A 1 141 ? -60.448 -18.193 30.687 1.00 40.42 ? 441 LEU A CD1 1 ATOM 1106 C CD2 . LEU A 1 141 ? -62.623 -19.238 31.343 1.00 33.57 ? 441 LEU A CD2 1 ATOM 1107 N N . PRO A 1 142 ? -64.351 -15.377 33.914 1.00 31.62 ? 442 PRO A N 1 ATOM 1108 C CA . PRO A 1 142 ? -64.603 -16.669 34.562 1.00 35.17 ? 442 PRO A CA 1 ATOM 1109 C C . PRO A 1 142 ? -65.902 -17.308 34.093 1.00 37.82 ? 442 PRO A C 1 ATOM 1110 O O . PRO A 1 142 ? -66.857 -16.596 33.787 1.00 37.44 ? 442 PRO A O 1 ATOM 1111 C CB . PRO A 1 142 ? -64.774 -16.302 36.046 1.00 33.01 ? 442 PRO A CB 1 ATOM 1112 C CG . PRO A 1 142 ? -64.566 -14.820 36.151 1.00 34.95 ? 442 PRO A CG 1 ATOM 1113 C CD . PRO A 1 142 ? -64.642 -14.234 34.794 1.00 27.47 ? 442 PRO A CD 1 ATOM 1114 N N . ALA A 1 143 ? -65.932 -18.636 34.049 1.00 38.46 ? 443 ALA A N 1 ATOM 1115 C CA . ALA A 1 143 ? -67.194 -19.360 33.962 1.00 43.04 ? 443 ALA A CA 1 ATOM 1116 C C . ALA A 1 143 ? -67.605 -19.720 35.384 1.00 46.34 ? 443 ALA A C 1 ATOM 1117 O O . ALA A 1 143 ? -66.803 -19.609 36.315 1.00 44.72 ? 443 ALA A O 1 ATOM 1118 C CB . ALA A 1 143 ? -67.048 -20.614 33.117 1.00 40.65 ? 443 ALA A CB 1 ATOM 1119 N N . LYS A 1 144 ? -68.846 -20.153 35.553 1.00 47.65 ? 444 LYS A N 1 ATOM 1120 C CA . LYS A 1 144 ? -69.359 -20.494 36.877 1.00 48.32 ? 444 LYS A CA 1 ATOM 1121 C C . LYS A 1 144 ? -68.519 -21.568 37.566 1.00 44.94 ? 444 LYS A C 1 ATOM 1122 O O . LYS A 1 144 ? -68.439 -21.599 38.796 1.00 44.44 ? 444 LYS A O 1 ATOM 1123 C CB . LYS A 1 144 ? -70.820 -20.929 36.786 1.00 55.06 ? 444 LYS A CB 1 ATOM 1124 C CG . LYS A 1 144 ? -71.775 -19.788 36.476 1.00 62.78 ? 444 LYS A CG 1 ATOM 1125 C CD . LYS A 1 144 ? -72.837 -20.213 35.470 1.00 80.15 ? 444 LYS A CD 1 ATOM 1126 C CE . LYS A 1 144 ? -72.283 -20.242 34.051 1.00 69.87 ? 444 LYS A CE 1 ATOM 1127 N NZ . LYS A 1 144 ? -72.039 -18.866 33.533 1.00 66.14 ? 444 LYS A NZ 1 ATOM 1128 N N . ASN A 1 145 ? -67.885 -22.434 36.777 1.00 43.43 ? 445 ASN A N 1 ATOM 1129 C CA . ASN A 1 145 ? -67.026 -23.483 37.333 1.00 46.96 ? 445 ASN A CA 1 ATOM 1130 C C . ASN A 1 145 ? -65.531 -23.138 37.419 1.00 47.32 ? 445 ASN A C 1 ATOM 1131 O O . ASN A 1 145 ? -64.696 -24.041 37.462 1.00 43.28 ? 445 ASN A O 1 ATOM 1132 C CB . ASN A 1 145 ? -67.204 -24.792 36.561 1.00 47.06 ? 445 ASN A CB 1 ATOM 1133 C CG . ASN A 1 145 ? -66.710 -24.701 35.130 1.00 53.10 ? 445 ASN A CG 1 ATOM 1134 O OD1 . ASN A 1 145 ? -66.294 -23.637 34.671 1.00 50.10 ? 445 ASN A OD1 1 ATOM 1135 N ND2 . ASN A 1 145 ? -66.775 -25.820 34.410 1.00 61.31 ? 445 ASN A ND2 1 ATOM 1136 N N . THR A 1 146 ? -65.194 -21.848 37.432 1.00 45.55 ? 446 THR A N 1 ATOM 1137 C CA . THR A 1 146 ? -63.805 -21.417 37.627 1.00 42.30 ? 446 THR A CA 1 ATOM 1138 C C . THR A 1 146 ? -63.758 -20.335 38.689 1.00 41.75 ? 446 THR A C 1 ATOM 1139 O O . THR A 1 146 ? -63.527 -19.165 38.391 1.00 40.47 ? 446 THR A O 1 ATOM 1140 C CB . THR A 1 146 ? -63.137 -20.879 36.330 1.00 43.76 ? 446 THR A CB 1 ATOM 1141 O OG1 . THR A 1 146 ? -63.778 -19.666 35.903 1.00 40.38 ? 446 THR A OG1 1 ATOM 1142 C CG2 . THR A 1 146 ? -63.198 -21.909 35.212 1.00 40.00 ? 446 THR A CG2 1 ATOM 1143 N N . THR A 1 147 ? -63.971 -20.742 39.933 1.00 43.86 ? 447 THR A N 1 ATOM 1144 C CA . THR A 1 147 ? -64.108 -19.810 41.041 1.00 43.93 ? 447 THR A CA 1 ATOM 1145 C C . THR A 1 147 ? -62.829 -19.048 41.363 1.00 44.36 ? 447 THR A C 1 ATOM 1146 O O . THR A 1 147 ? -62.875 -18.017 42.028 1.00 40.64 ? 447 THR A O 1 ATOM 1147 C CB . THR A 1 147 ? -64.566 -20.540 42.304 1.00 51.24 ? 447 THR A CB 1 ATOM 1148 O OG1 . THR A 1 147 ? -63.624 -21.575 42.617 1.00 52.85 ? 447 THR A OG1 1 ATOM 1149 C CG2 . THR A 1 147 ? -65.934 -21.159 42.075 1.00 54.61 ? 447 THR A CG2 1 ATOM 1150 N N . ASN A 1 148 ? -61.689 -19.555 40.904 1.00 41.97 ? 448 ASN A N 1 ATOM 1151 C CA . ASN A 1 148 ? -60.418 -18.873 41.145 1.00 44.52 ? 448 ASN A CA 1 ATOM 1152 C C . ASN A 1 148 ? -60.060 -17.789 40.117 1.00 44.51 ? 448 ASN A C 1 ATOM 1153 O O . ASN A 1 148 ? -58.963 -17.230 40.166 1.00 41.94 ? 448 ASN A O 1 ATOM 1154 C CB . ASN A 1 148 ? -59.283 -19.887 41.221 1.00 38.86 ? 448 ASN A CB 1 ATOM 1155 C CG . ASN A 1 148 ? -59.085 -20.627 39.924 1.00 44.83 ? 448 ASN A CG 1 ATOM 1156 O OD1 . ASN A 1 148 ? -60.047 -20.927 39.208 1.00 42.06 ? 448 ASN A OD1 1 ATOM 1157 N ND2 . ASN A 1 148 ? -57.833 -20.937 39.611 1.00 46.46 ? 448 ASN A ND2 1 ATOM 1158 N N . LEU A 1 149 ? -60.973 -17.499 39.190 1.00 40.80 ? 449 LEU A N 1 ATOM 1159 C CA . LEU A 1 149 ? -60.734 -16.479 38.165 1.00 40.82 ? 449 LEU A CA 1 ATOM 1160 C C . LEU A 1 149 ? -61.694 -15.309 38.295 1.00 37.93 ? 449 LEU A C 1 ATOM 1161 O O . LEU A 1 149 ? -62.857 -15.482 38.650 1.00 40.78 ? 449 LEU A O 1 ATOM 1162 C CB . LEU A 1 149 ? -60.875 -17.064 36.758 1.00 36.26 ? 449 LEU A CB 1 ATOM 1163 C CG . LEU A 1 149 ? -59.967 -18.211 36.320 1.00 35.80 ? 449 LEU A CG 1 ATOM 1164 C CD1 . LEU A 1 149 ? -60.213 -18.506 34.857 1.00 36.61 ? 449 LEU A CD1 1 ATOM 1165 C CD2 . LEU A 1 149 ? -58.503 -17.887 36.561 1.00 39.94 ? 449 LEU A CD2 1 ATOM 1166 N N . LYS A 1 150 ? -61.198 -14.117 37.992 1.00 36.21 ? 450 LYS A N 1 ATOM 1167 C CA . LYS A 1 150 ? -62.027 -12.916 37.958 1.00 36.59 ? 450 LYS A CA 1 ATOM 1168 C C . LYS A 1 150 ? -61.500 -12.000 36.874 1.00 34.86 ? 450 LYS A C 1 ATOM 1169 O O . LYS A 1 150 ? -60.300 -11.985 36.610 1.00 32.74 ? 450 LYS A O 1 ATOM 1170 C CB . LYS A 1 150 ? -61.984 -12.181 39.298 1.00 39.61 ? 450 LYS A CB 1 ATOM 1171 C CG . LYS A 1 150 ? -62.694 -12.900 40.422 1.00 49.17 ? 450 LYS A CG 1 ATOM 1172 C CD . LYS A 1 150 ? -63.060 -11.931 41.536 1.00 57.49 ? 450 LYS A CD 1 ATOM 1173 C CE . LYS A 1 150 ? -63.991 -12.580 42.552 1.00 80.97 ? 450 LYS A CE 1 ATOM 1174 N NZ . LYS A 1 150 ? -65.278 -13.018 41.940 1.00 73.95 ? 450 LYS A NZ 1 ATOM 1175 N N . THR A 1 151 ? -62.382 -11.235 36.241 1.00 28.79 ? 451 THR A N 1 ATOM 1176 C CA . THR A 1 151 ? -61.924 -10.271 35.256 1.00 30.14 ? 451 THR A CA 1 ATOM 1177 C C . THR A 1 151 ? -62.354 -8.863 35.640 1.00 29.52 ? 451 THR A C 1 ATOM 1178 O O . THR A 1 151 ? -63.449 -8.666 36.167 1.00 32.63 ? 451 THR A O 1 ATOM 1179 C CB . THR A 1 151 ? -62.420 -10.606 33.835 1.00 32.11 ? 451 THR A CB 1 ATOM 1180 O OG1 . THR A 1 151 ? -63.840 -10.430 33.765 1.00 41.40 ? 451 THR A OG1 1 ATOM 1181 C CG2 . THR A 1 151 ? -62.072 -12.030 33.485 1.00 25.87 ? 451 THR A CG2 1 ATOM 1182 N N . TYR A 1 152 ? -61.475 -7.894 35.385 1.00 26.62 ? 452 TYR A N 1 ATOM 1183 C CA . TYR A 1 152 ? -61.760 -6.494 35.656 1.00 31.11 ? 452 TYR A CA 1 ATOM 1184 C C . TYR A 1 152 ? -61.576 -5.675 34.391 1.00 30.45 ? 452 TYR A C 1 ATOM 1185 O O . TYR A 1 152 ? -60.731 -5.991 33.554 1.00 28.15 ? 452 TYR A O 1 ATOM 1186 C CB . TYR A 1 152 ? -60.803 -5.948 36.717 1.00 27.92 ? 452 TYR A CB 1 ATOM 1187 C CG . TYR A 1 152 ? -60.788 -6.711 38.022 1.00 29.52 ? 452 TYR A CG 1 ATOM 1188 C CD1 . TYR A 1 152 ? -61.524 -6.275 39.117 1.00 34.20 ? 452 TYR A CD1 1 ATOM 1189 C CD2 . TYR A 1 152 ? -60.027 -7.861 38.162 1.00 30.85 ? 452 TYR A CD2 1 ATOM 1190 C CE1 . TYR A 1 152 ? -61.508 -6.973 40.315 1.00 32.06 ? 452 TYR A CE1 1 ATOM 1191 C CE2 . TYR A 1 152 ? -60.003 -8.563 39.349 1.00 37.62 ? 452 TYR A CE2 1 ATOM 1192 C CZ . TYR A 1 152 ? -60.739 -8.117 40.423 1.00 36.69 ? 452 TYR A CZ 1 ATOM 1193 O OH . TYR A 1 152 ? -60.706 -8.829 41.599 1.00 43.05 ? 452 TYR A OH 1 ATOM 1194 N N . SER A 1 153 ? -62.359 -4.613 34.257 1.00 33.61 ? 453 SER A N 1 ATOM 1195 C CA . SER A 1 153 ? -62.099 -3.612 33.230 1.00 38.08 ? 453 SER A CA 1 ATOM 1196 C C . SER A 1 153 ? -61.746 -2.293 33.917 1.00 47.30 ? 453 SER A C 1 ATOM 1197 O O . SER A 1 153 ? -62.407 -1.890 34.874 1.00 44.27 ? 453 SER A O 1 ATOM 1198 C CB . SER A 1 153 ? -63.307 -3.448 32.306 1.00 41.95 ? 453 SER A CB 1 ATOM 1199 O OG . SER A 1 153 ? -63.033 -2.522 31.265 1.00 48.73 ? 453 SER A OG 1 ATOM 1200 N N . THR A 1 154 ? -60.688 -1.634 33.453 1.00 52.91 ? 454 THR A N 1 ATOM 1201 C CA . THR A 1 154 ? -60.247 -0.388 34.077 1.00 60.47 ? 454 THR A CA 1 ATOM 1202 C C . THR A 1 154 ? -60.454 0.813 33.163 1.00 70.56 ? 454 THR A C 1 ATOM 1203 O O . THR A 1 154 ? -60.209 1.955 33.553 1.00 79.75 ? 454 THR A O 1 ATOM 1204 C CB . THR A 1 154 ? -58.763 -0.430 34.456 1.00 61.88 ? 454 THR A CB 1 ATOM 1205 O OG1 . THR A 1 154 ? -58.487 0.618 35.392 1.00 65.31 ? 454 THR A OG1 1 ATOM 1206 C CG2 . THR A 1 154 ? -57.893 -0.231 33.220 1.00 66.76 ? 454 THR A CG2 1 ATOM 1207 N N . GLY A 1 155 ? -60.906 0.548 31.944 1.00 70.90 ? 455 GLY A N 1 ATOM 1208 C CA . GLY A 1 155 ? -61.042 1.588 30.946 1.00 77.40 ? 455 GLY A CA 1 ATOM 1209 C C . GLY A 1 155 ? -60.100 1.302 29.796 1.00 82.05 ? 455 GLY A C 1 ATOM 1210 O O . GLY A 1 155 ? -60.532 1.001 28.681 1.00 80.18 ? 455 GLY A O 1 ATOM 1211 N N . ARG A 1 156 ? -58.804 1.375 30.076 1.00 81.74 ? 456 ARG A N 1 ATOM 1212 C CA . ARG A 1 156 ? -57.795 1.144 29.051 1.00 84.81 ? 456 ARG A CA 1 ATOM 1213 C C . ARG A 1 156 ? -57.222 -0.276 29.082 1.00 72.52 ? 456 ARG A C 1 ATOM 1214 O O . ARG A 1 156 ? -56.430 -0.646 28.215 1.00 69.92 ? 456 ARG A O 1 ATOM 1215 C CB . ARG A 1 156 ? -56.679 2.189 29.159 1.00 98.71 ? 456 ARG A CB 1 ATOM 1216 C CG . ARG A 1 156 ? -56.271 2.522 30.588 1.00 103.11 ? 456 ARG A CG 1 ATOM 1217 C CD . ARG A 1 156 ? -55.436 3.797 30.650 1.00 108.77 ? 456 ARG A CD 1 ATOM 1218 N NE . ARG A 1 156 ? -56.211 4.985 30.299 1.00 106.06 ? 456 ARG A NE 1 ATOM 1219 C CZ . ARG A 1 156 ? -55.773 6.233 30.442 1.00 111.35 ? 456 ARG A CZ 1 ATOM 1220 N NH1 . ARG A 1 156 ? -54.563 6.462 30.935 1.00 99.93 ? 456 ARG A NH1 1 ATOM 1221 N NH2 . ARG A 1 156 ? -56.546 7.255 30.098 1.00 98.74 ? 456 ARG A NH2 1 ATOM 1222 N N . LYS A 1 157 ? -57.633 -1.072 30.068 1.00 63.61 ? 457 LYS A N 1 ATOM 1223 C CA . LYS A 1 157 ? -57.133 -2.440 30.202 1.00 52.85 ? 457 LYS A CA 1 ATOM 1224 C C . LYS A 1 157 ? -58.216 -3.472 30.540 1.00 41.38 ? 457 LYS A C 1 ATOM 1225 O O . LYS A 1 157 ? -59.225 -3.159 31.167 1.00 43.91 ? 457 LYS A O 1 ATOM 1226 C CB . LYS A 1 157 ? -56.018 -2.510 31.255 1.00 55.03 ? 457 LYS A CB 1 ATOM 1227 C CG . LYS A 1 157 ? -54.737 -1.772 30.888 1.00 62.51 ? 457 LYS A CG 1 ATOM 1228 C CD . LYS A 1 157 ? -53.688 -1.922 31.984 1.00 62.19 ? 457 LYS A CD 1 ATOM 1229 C CE . LYS A 1 157 ? -52.396 -1.196 31.633 1.00 71.31 ? 457 LYS A CE 1 ATOM 1230 N NZ . LYS A 1 157 ? -51.723 -1.773 30.436 1.00 76.21 ? 457 LYS A NZ 1 ATOM 1231 N N . MET A 1 158 ? -57.984 -4.708 30.114 1.00 33.10 ? 458 MET A N 1 ATOM 1232 C CA . MET A 1 158 ? -58.794 -5.834 30.523 1.00 36.41 ? 458 MET A CA 1 ATOM 1233 C C . MET A 1 158 ? -57.926 -6.801 31.331 1.00 32.84 ? 458 MET A C 1 ATOM 1234 O O . MET A 1 158 ? -56.954 -7.346 30.820 1.00 34.58 ? 458 MET A O 1 ATOM 1235 C CB . MET A 1 158 ? -59.358 -6.534 29.298 1.00 36.18 ? 458 MET A CB 1 ATOM 1236 C CG . MET A 1 158 ? -60.524 -7.419 29.610 1.00 37.85 ? 458 MET A CG 1 ATOM 1237 S SD . MET A 1 158 ? -61.950 -6.436 30.092 1.00 57.41 ? 458 MET A SD 1 ATOM 1238 C CE . MET A 1 158 ? -63.055 -7.752 30.583 1.00 47.50 ? 458 MET A CE 1 ATOM 1239 N N . ILE A 1 159 ? -58.286 -7.020 32.586 1.00 30.13 ? 459 ILE A N 1 ATOM 1240 C CA . ILE A 1 159 ? -57.448 -7.793 33.491 1.00 26.67 ? 459 ILE A CA 1 ATOM 1241 C C . ILE A 1 159 ? -58.028 -9.149 33.853 1.00 28.24 ? 459 ILE A C 1 ATOM 1242 O O . ILE A 1 159 ? -59.189 -9.243 34.246 1.00 31.70 ? 459 ILE A O 1 ATOM 1243 C CB . ILE A 1 159 ? -57.195 -7.012 34.791 1.00 33.42 ? 459 ILE A CB 1 ATOM 1244 C CG1 . ILE A 1 159 ? -56.542 -5.661 34.485 1.00 31.25 ? 459 ILE A CG1 1 ATOM 1245 C CG2 . ILE A 1 159 ? -56.342 -7.823 35.743 1.00 28.42 ? 459 ILE A CG2 1 ATOM 1246 C CD1 . ILE A 1 159 ? -56.129 -4.893 35.724 1.00 38.08 ? 459 ILE A CD1 1 ATOM 1247 N N . LEU A 1 160 ? -57.212 -10.195 33.714 1.00 27.38 ? 460 LEU A N 1 ATOM 1248 C CA . LEU A 1 160 ? -57.556 -11.527 34.215 1.00 28.13 ? 460 LEU A CA 1 ATOM 1249 C C . LEU A 1 160 ? -56.765 -11.845 35.482 1.00 28.10 ? 460 LEU A C 1 ATOM 1250 O O . LEU A 1 160 ? -55.533 -11.945 35.453 1.00 28.07 ? 460 LEU A O 1 ATOM 1251 C CB . LEU A 1 160 ? -57.285 -12.607 33.167 1.00 26.40 ? 460 LEU A CB 1 ATOM 1252 C CG . LEU A 1 160 ? -57.668 -14.026 33.605 1.00 31.57 ? 460 LEU A CG 1 ATOM 1253 C CD1 . LEU A 1 160 ? -59.172 -14.145 33.802 1.00 27.91 ? 460 LEU A CD1 1 ATOM 1254 C CD2 . LEU A 1 160 ? -57.184 -15.065 32.616 1.00 32.34 ? 460 LEU A CD2 1 ATOM 1255 N N . GLU A 1 161 ? -57.475 -11.995 36.595 1.00 29.10 ? 461 GLU A N 1 ATOM 1256 C CA . GLU A 1 161 ? -56.836 -12.281 37.873 1.00 31.66 ? 461 GLU A CA 1 ATOM 1257 C C . GLU A 1 161 ? -56.883 -13.775 38.139 1.00 34.19 ? 461 GLU A C 1 ATOM 1258 O O . GLU A 1 161 ? -57.959 -14.369 38.226 1.00 38.76 ? 461 GLU A O 1 ATOM 1259 C CB . GLU A 1 161 ? -57.521 -11.525 39.012 1.00 33.95 ? 461 GLU A CB 1 ATOM 1260 C CG . GLU A 1 161 ? -56.804 -11.641 40.357 1.00 35.06 ? 461 GLU A CG 1 ATOM 1261 C CD . GLU A 1 161 ? -57.613 -11.073 41.510 1.00 40.87 ? 461 GLU A CD 1 ATOM 1262 O OE1 . GLU A 1 161 ? -58.680 -11.644 41.825 1.00 44.58 ? 461 GLU A OE1 1 ATOM 1263 O OE2 . GLU A 1 161 ? -57.173 -10.066 42.111 1.00 43.96 ? 461 GLU A OE2 1 ATOM 1264 N N . ILE A 1 162 ? -55.713 -14.386 38.258 1.00 31.38 ? 462 ILE A N 1 ATOM 1265 C CA . ILE A 1 162 ? -55.639 -15.816 38.508 1.00 35.77 ? 462 ILE A CA 1 ATOM 1266 C C . ILE A 1 162 ? -55.056 -16.122 39.887 1.00 37.78 ? 462 ILE A C 1 ATOM 1267 O O . ILE A 1 162 ? -53.951 -15.691 40.216 1.00 38.26 ? 462 ILE A O 1 ATOM 1268 C CB . ILE A 1 162 ? -54.791 -16.524 37.436 1.00 37.61 ? 462 ILE A CB 1 ATOM 1269 C CG1 . ILE A 1 162 ? -55.303 -16.172 36.041 1.00 34.25 ? 462 ILE A CG1 1 ATOM 1270 C CG2 . ILE A 1 162 ? -54.802 -18.035 37.656 1.00 39.07 ? 462 ILE A CG2 1 ATOM 1271 C CD1 . ILE A 1 162 ? -54.354 -16.572 34.931 1.00 33.42 ? 462 ILE A CD1 1 ATOM 1272 N N . ALA A 1 163 ? -55.812 -16.858 40.693 1.00 37.12 ? 463 ALA A N 1 ATOM 1273 C CA . ALA A 1 163 ? -55.281 -17.440 41.924 1.00 42.04 ? 463 ALA A CA 1 ATOM 1274 C C . ALA A 1 163 ? -54.883 -18.879 41.642 1.00 43.73 ? 463 ALA A C 1 ATOM 1275 O O . ALA A 1 163 ? -55.713 -19.783 41.744 1.00 43.38 ? 463 ALA A O 1 ATOM 1276 C CB . ALA A 1 163 ? -56.314 -17.398 43.026 1.00 40.35 ? 463 ALA A CB 1 ATOM 1277 N N . PRO A 1 164 ? -53.607 -19.097 41.283 1.00 43.09 ? 464 PRO A N 1 ATOM 1278 C CA . PRO A 1 164 ? -53.177 -20.419 40.820 1.00 43.98 ? 464 PRO A CA 1 ATOM 1279 C C . PRO A 1 164 ? -53.289 -21.452 41.934 1.00 50.00 ? 464 PRO A C 1 ATOM 1280 O O . PRO A 1 164 ? -52.896 -21.194 43.071 1.00 45.28 ? 464 PRO A O 1 ATOM 1281 C CB . PRO A 1 164 ? -51.707 -20.205 40.429 1.00 39.70 ? 464 PRO A CB 1 ATOM 1282 C CG . PRO A 1 164 ? -51.491 -18.699 40.435 1.00 34.57 ? 464 PRO A CG 1 ATOM 1283 C CD . PRO A 1 164 ? -52.478 -18.160 41.415 1.00 39.91 ? 464 PRO A CD 1 ATOM 1284 N N . THR A 1 165 ? -53.831 -22.614 41.598 1.00 54.18 ? 465 THR A N 1 ATOM 1285 C CA . THR A 1 165 ? -54.034 -23.684 42.565 1.00 59.60 ? 465 THR A CA 1 ATOM 1286 C C . THR A 1 165 ? -54.282 -24.990 41.835 1.00 63.54 ? 465 THR A C 1 ATOM 1287 O O . THR A 1 165 ? -55.327 -25.615 42.000 1.00 66.52 ? 465 THR A O 1 ATOM 1288 C CB . THR A 1 165 ? -55.228 -23.395 43.488 1.00 65.71 ? 465 THR A CB 1 ATOM 1289 O OG1 . THR A 1 165 ? -56.080 -22.416 42.877 1.00 64.71 ? 465 THR A OG1 1 ATOM 1290 C CG2 . THR A 1 165 ? -54.747 -22.873 44.834 1.00 59.08 ? 465 THR A CG2 1 ATOM 1291 N N . SER A 1 166 ? -53.306 -25.387 41.028 1.00 62.75 ? 466 SER A N 1 ATOM 1292 C CA . SER A 1 166 ? -53.402 -26.570 40.190 1.00 60.96 ? 466 SER A CA 1 ATOM 1293 C C . SER A 1 166 ? -52.491 -26.345 39.008 1.00 61.81 ? 466 SER A C 1 ATOM 1294 O O . SER A 1 166 ? -52.367 -25.217 38.536 1.00 60.67 ? 466 SER A O 1 ATOM 1295 C CB . SER A 1 166 ? -54.833 -26.772 39.689 1.00 62.34 ? 466 SER A CB 1 ATOM 1296 O OG . SER A 1 166 ? -54.880 -27.747 38.660 1.00 71.66 ? 466 SER A OG 1 ATOM 1297 N N . ASP A 1 167 ? -51.852 -27.407 38.523 1.00 62.03 ? 467 ASP A N 1 ATOM 1298 C CA . ASP A 1 167 ? -51.059 -27.288 37.308 1.00 66.93 ? 467 ASP A CA 1 ATOM 1299 C C . ASP A 1 167 ? -51.972 -27.049 36.100 1.00 68.41 ? 467 ASP A C 1 ATOM 1300 O O . ASP A 1 167 ? -51.523 -27.068 34.952 1.00 70.77 ? 467 ASP A O 1 ATOM 1301 C CB . ASP A 1 167 ? -50.164 -28.516 37.108 1.00 79.35 ? 467 ASP A CB 1 ATOM 1302 C CG . ASP A 1 167 ? -48.828 -28.399 37.843 1.00 80.13 ? 467 ASP A CG 1 ATOM 1303 O OD1 . ASP A 1 167 ? -48.109 -29.417 37.928 1.00 90.67 ? 467 ASP A OD1 1 ATOM 1304 O OD2 . ASP A 1 167 ? -48.490 -27.295 38.330 1.00 68.28 ? 467 ASP A OD2 1 ATOM 1305 N N . ASN A 1 168 ? -53.253 -26.813 36.373 1.00 66.15 ? 468 ASN A N 1 ATOM 1306 C CA . ASN A 1 168 ? -54.228 -26.522 35.326 1.00 65.86 ? 468 ASN A CA 1 ATOM 1307 C C . ASN A 1 168 ? -54.470 -25.020 35.152 1.00 59.90 ? 468 ASN A C 1 ATOM 1308 O O . ASN A 1 168 ? -54.866 -24.565 34.084 1.00 57.52 ? 468 ASN A O 1 ATOM 1309 C CB . ASN A 1 168 ? -55.551 -27.233 35.610 1.00 69.96 ? 468 ASN A CB 1 ATOM 1310 C CG . ASN A 1 168 ? -56.548 -27.074 34.482 1.00 77.33 ? 468 ASN A CG 1 ATOM 1311 O OD1 . ASN A 1 168 ? -57.612 -26.475 34.651 1.00 74.45 ? 468 ASN A OD1 1 ATOM 1312 N ND2 . ASN A 1 168 ? -56.199 -27.597 33.315 1.00 85.01 ? 468 ASN A ND2 1 ATOM 1313 N N . ASP A 1 169 ? -54.230 -24.255 36.210 1.00 55.22 ? 469 ASP A N 1 ATOM 1314 C CA . ASP A 1 169 ? -54.324 -22.804 36.138 1.00 48.50 ? 469 ASP A CA 1 ATOM 1315 C C . ASP A 1 169 ? -53.164 -22.217 35.334 1.00 50.51 ? 469 ASP A C 1 ATOM 1316 O O . ASP A 1 169 ? -53.150 -21.024 35.025 1.00 47.81 ? 469 ASP A O 1 ATOM 1317 C CB . ASP A 1 169 ? -54.347 -22.202 37.545 1.00 50.60 ? 469 ASP A CB 1 ATOM 1318 C CG . ASP A 1 169 ? -55.571 -22.614 38.332 1.00 54.01 ? 469 ASP A CG 1 ATOM 1319 O OD1 . ASP A 1 169 ? -56.647 -22.763 37.720 1.00 50.66 ? 469 ASP A OD1 1 ATOM 1320 O OD2 . ASP A 1 169 ? -55.461 -22.786 39.563 1.00 58.18 ? 469 ASP A OD2 1 ATOM 1321 N N . PHE A 1 170 ? -52.185 -23.056 35.011 1.00 50.89 ? 470 PHE A N 1 ATOM 1322 C CA . PHE A 1 170 ? -51.053 -22.625 34.204 1.00 45.63 ? 470 PHE A CA 1 ATOM 1323 C C . PHE A 1 170 ? -51.305 -23.020 32.767 1.00 47.34 ? 470 PHE A C 1 ATOM 1324 O O . PHE A 1 170 ? -51.943 -24.033 32.503 1.00 48.26 ? 470 PHE A O 1 ATOM 1325 C CB . PHE A 1 170 ? -49.751 -23.241 34.721 1.00 48.74 ? 470 PHE A CB 1 ATOM 1326 C CG . PHE A 1 170 ? -49.392 -22.792 36.108 1.00 44.88 ? 470 PHE A CG 1 ATOM 1327 C CD1 . PHE A 1 170 ? -48.619 -21.666 36.306 1.00 38.79 ? 470 PHE A CD1 1 ATOM 1328 C CD2 . PHE A 1 170 ? -49.866 -23.475 37.214 1.00 47.82 ? 470 PHE A CD2 1 ATOM 1329 C CE1 . PHE A 1 170 ? -48.310 -21.239 37.579 1.00 42.79 ? 470 PHE A CE1 1 ATOM 1330 C CE2 . PHE A 1 170 ? -49.565 -23.056 38.485 1.00 45.84 ? 470 PHE A CE2 1 ATOM 1331 C CZ . PHE A 1 170 ? -48.785 -21.936 38.674 1.00 45.23 ? 470 PHE A CZ 1 ATOM 1332 N N . GLY A 1 171 ? -50.820 -22.207 31.839 1.00 42.47 ? 471 GLY A N 1 ATOM 1333 C CA . GLY A 1 171 ? -51.027 -22.471 30.426 1.00 41.16 ? 471 GLY A CA 1 ATOM 1334 C C . GLY A 1 171 ? -51.450 -21.242 29.641 1.00 39.66 ? 471 GLY A C 1 ATOM 1335 O O . GLY A 1 171 ? -51.217 -20.106 30.067 1.00 35.14 ? 471 GLY A O 1 ATOM 1336 N N . ARG A 1 172 ? -52.085 -21.479 28.496 1.00 38.94 ? 472 ARG A N 1 ATOM 1337 C CA . ARG A 1 172 ? -52.442 -20.421 27.556 1.00 37.88 ? 472 ARG A CA 1 ATOM 1338 C C . ARG A 1 172 ? -53.824 -19.841 27.844 1.00 35.02 ? 472 ARG A C 1 ATOM 1339 O O . ARG A 1 172 ? -54.744 -20.573 28.195 1.00 30.20 ? 472 ARG A O 1 ATOM 1340 C CB . ARG A 1 172 ? -52.433 -20.973 26.132 1.00 40.59 ? 472 ARG A CB 1 ATOM 1341 C CG . ARG A 1 172 ? -51.285 -21.902 25.829 1.00 48.02 ? 472 ARG A CG 1 ATOM 1342 C CD . ARG A 1 172 ? -50.226 -21.246 24.970 1.00 54.16 ? 472 ARG A CD 1 ATOM 1343 N NE . ARG A 1 172 ? -49.282 -22.234 24.455 1.00 63.81 ? 472 ARG A NE 1 ATOM 1344 C CZ . ARG A 1 172 ? -49.578 -23.129 23.517 1.00 76.61 ? 472 ARG A CZ 1 ATOM 1345 N NH1 . ARG A 1 172 ? -50.796 -23.163 22.991 1.00 79.76 ? 472 ARG A NH1 1 ATOM 1346 N NH2 . ARG A 1 172 ? -48.660 -23.992 23.106 1.00 97.42 ? 472 ARG A NH2 1 ATOM 1347 N N . TYR A 1 173 ? -53.952 -18.525 27.685 1.00 37.96 ? 473 TYR A N 1 ATOM 1348 C CA . TYR A 1 173 ? -55.235 -17.828 27.761 1.00 34.52 ? 473 TYR A CA 1 ATOM 1349 C C . TYR A 1 173 ? -55.352 -16.874 26.567 1.00 36.13 ? 473 TYR A C 1 ATOM 1350 O O . TYR A 1 173 ? -54.389 -16.190 26.228 1.00 33.72 ? 473 TYR A O 1 ATOM 1351 C CB . TYR A 1 173 ? -55.332 -17.014 29.058 1.00 29.37 ? 473 TYR A CB 1 ATOM 1352 C CG . TYR A 1 173 ? -55.349 -17.841 30.319 1.00 28.16 ? 473 TYR A CG 1 ATOM 1353 C CD1 . TYR A 1 173 ? -56.532 -18.063 31.004 1.00 28.50 ? 473 TYR A CD1 1 ATOM 1354 C CD2 . TYR A 1 173 ? -54.183 -18.403 30.822 1.00 35.70 ? 473 TYR A CD2 1 ATOM 1355 C CE1 . TYR A 1 173 ? -56.559 -18.820 32.149 1.00 36.32 ? 473 TYR A CE1 1 ATOM 1356 C CE2 . TYR A 1 173 ? -54.199 -19.167 31.973 1.00 38.04 ? 473 TYR A CE2 1 ATOM 1357 C CZ . TYR A 1 173 ? -55.391 -19.371 32.629 1.00 37.74 ? 473 TYR A CZ 1 ATOM 1358 O OH . TYR A 1 173 ? -55.419 -20.130 33.768 1.00 32.34 ? 473 TYR A OH 1 ATOM 1359 N N . ASN A 1 174 ? -56.520 -16.826 25.929 1.00 33.59 ? 474 ASN A N 1 ATOM 1360 C CA . ASN A 1 174 ? -56.761 -15.861 24.856 1.00 29.86 ? 474 ASN A CA 1 ATOM 1361 C C . ASN A 1 174 ? -57.475 -14.621 25.365 1.00 31.35 ? 474 ASN A C 1 ATOM 1362 O O . ASN A 1 174 ? -58.435 -14.720 26.129 1.00 36.94 ? 474 ASN A O 1 ATOM 1363 C CB . ASN A 1 174 ? -57.626 -16.466 23.744 1.00 35.38 ? 474 ASN A CB 1 ATOM 1364 C CG . ASN A 1 174 ? -56.832 -17.284 22.751 1.00 36.35 ? 474 ASN A CG 1 ATOM 1365 O OD1 . ASN A 1 174 ? -55.611 -17.163 22.651 1.00 33.60 ? 474 ASN A OD1 1 ATOM 1366 N ND2 . ASN A 1 174 ? -57.535 -18.130 22.007 1.00 39.36 ? 474 ASN A ND2 1 ATOM 1367 N N . CYS A 1 175 ? -57.006 -13.455 24.940 1.00 25.03 ? 475 CYS A N 1 ATOM 1368 C CA . CYS A 1 175 ? -57.809 -12.248 25.045 1.00 31.59 ? 475 CYS A CA 1 ATOM 1369 C C . CYS A 1 175 ? -58.347 -11.987 23.646 1.00 30.47 ? 475 CYS A C 1 ATOM 1370 O O . CYS A 1 175 ? -57.578 -11.909 22.688 1.00 26.83 ? 475 CYS A O 1 ATOM 1371 C CB . CYS A 1 175 ? -56.964 -11.064 25.519 1.00 25.13 ? 475 CYS A CB 1 ATOM 1372 S SG . CYS A 1 175 ? -57.879 -9.536 25.879 1.00 37.04 ? 475 CYS A SG 1 ATOM 1373 N N . THR A 1 176 ? -59.665 -11.879 23.525 1.00 28.44 ? 476 THR A N 1 ATOM 1374 C CA . THR A 1 176 ? -60.291 -11.691 22.224 1.00 30.27 ? 476 THR A CA 1 ATOM 1375 C C . THR A 1 176 ? -61.077 -10.392 22.195 1.00 30.37 ? 476 THR A C 1 ATOM 1376 O O . THR A 1 176 ? -61.853 -10.097 23.099 1.00 31.66 ? 476 THR A O 1 ATOM 1377 C CB . THR A 1 176 ? -61.257 -12.840 21.871 1.00 35.88 ? 476 THR A CB 1 ATOM 1378 O OG1 . THR A 1 176 ? -62.517 -12.618 22.514 1.00 44.16 ? 476 THR A OG1 1 ATOM 1379 C CG2 . THR A 1 176 ? -60.692 -14.180 22.314 1.00 30.81 ? 476 THR A CG2 1 ATOM 1380 N N . ALA A 1 177 ? -60.878 -9.617 21.142 1.00 32.01 ? 477 ALA A N 1 ATOM 1381 C CA . ALA A 1 177 ? -61.583 -8.360 21.009 1.00 32.05 ? 477 ALA A CA 1 ATOM 1382 C C . ALA A 1 177 ? -62.328 -8.328 19.682 1.00 30.10 ? 477 ALA A C 1 ATOM 1383 O O . ALA A 1 177 ? -61.805 -8.755 18.658 1.00 29.05 ? 477 ALA A O 1 ATOM 1384 C CB . ALA A 1 177 ? -60.609 -7.210 21.107 1.00 26.27 ? 477 ALA A CB 1 ATOM 1385 N N . THR A 1 178 ? -63.560 -7.843 19.701 1.00 27.51 ? 478 THR A N 1 ATOM 1386 C CA . THR A 1 178 ? -64.289 -7.700 18.455 1.00 33.05 ? 478 THR A CA 1 ATOM 1387 C C . THR A 1 178 ? -65.038 -6.378 18.333 1.00 28.86 ? 478 THR A C 1 ATOM 1388 O O . THR A 1 178 ? -65.603 -5.873 19.302 1.00 31.57 ? 478 THR A O 1 ATOM 1389 C CB . THR A 1 178 ? -65.223 -8.904 18.182 1.00 37.94 ? 478 THR A CB 1 ATOM 1390 O OG1 . THR A 1 178 ? -66.416 -8.452 17.529 1.00 42.26 ? 478 THR A OG1 1 ATOM 1391 C CG2 . THR A 1 178 ? -65.599 -9.586 19.452 1.00 32.71 ? 478 THR A CG2 1 ATOM 1392 N N . ASN A 1 179 ? -64.990 -5.808 17.132 1.00 33.40 ? 479 ASN A N 1 ATOM 1393 C CA . ASN A 1 179 ? -65.875 -4.717 16.746 1.00 34.21 ? 479 ASN A CA 1 ATOM 1394 C C . ASN A 1 179 ? -66.448 -5.046 15.372 1.00 37.96 ? 479 ASN A C 1 ATOM 1395 O O . ASN A 1 179 ? -66.306 -6.177 14.908 1.00 36.09 ? 479 ASN A O 1 ATOM 1396 C CB . ASN A 1 179 ? -65.159 -3.359 16.780 1.00 30.91 ? 479 ASN A CB 1 ATOM 1397 C CG . ASN A 1 179 ? -64.026 -3.261 15.784 1.00 31.57 ? 479 ASN A CG 1 ATOM 1398 O OD1 . ASN A 1 179 ? -63.267 -2.285 15.793 1.00 31.57 ? 479 ASN A OD1 1 ATOM 1399 N ND2 . ASN A 1 179 ? -63.897 -4.266 14.917 1.00 27.87 ? 479 ASN A ND2 1 ATOM 1400 N N . HIS A 1 180 ? -67.088 -4.087 14.711 1.00 40.36 ? 480 HIS A N 1 ATOM 1401 C CA . HIS A 1 180 ? -67.804 -4.431 13.480 1.00 41.85 ? 480 HIS A CA 1 ATOM 1402 C C . HIS A 1 180 ? -66.867 -4.756 12.324 1.00 36.77 ? 480 HIS A C 1 ATOM 1403 O O . HIS A 1 180 ? -67.277 -5.376 11.348 1.00 40.31 ? 480 HIS A O 1 ATOM 1404 C CB . HIS A 1 180 ? -68.847 -3.375 13.088 1.00 47.16 ? 480 HIS A CB 1 ATOM 1405 C CG . HIS A 1 180 ? -68.282 -2.190 12.369 1.00 49.61 ? 480 HIS A CG 1 ATOM 1406 N ND1 . HIS A 1 180 ? -68.125 -0.960 12.972 1.00 49.56 ? 480 HIS A ND1 1 ATOM 1407 C CD2 . HIS A 1 180 ? -67.853 -2.042 11.093 1.00 50.40 ? 480 HIS A CD2 1 ATOM 1408 C CE1 . HIS A 1 180 ? -67.614 -0.108 12.102 1.00 48.89 ? 480 HIS A CE1 1 ATOM 1409 N NE2 . HIS A 1 180 ? -67.440 -0.739 10.954 1.00 51.13 ? 480 HIS A NE2 1 ATOM 1410 N N . ILE A 1 181 ? -65.603 -4.361 12.442 1.00 35.99 ? 481 ILE A N 1 ATOM 1411 C CA . ILE A 1 181 ? -64.611 -4.745 11.440 1.00 31.75 ? 481 ILE A CA 1 ATOM 1412 C C . ILE A 1 181 ? -64.209 -6.216 11.615 1.00 38.93 ? 481 ILE A C 1 ATOM 1413 O O . ILE A 1 181 ? -63.916 -6.903 10.638 1.00 37.52 ? 481 ILE A O 1 ATOM 1414 C CB . ILE A 1 181 ? -63.355 -3.841 11.486 1.00 35.99 ? 481 ILE A CB 1 ATOM 1415 C CG1 . ILE A 1 181 ? -63.752 -2.369 11.462 1.00 39.55 ? 481 ILE A CG1 1 ATOM 1416 C CG2 . ILE A 1 181 ? -62.416 -4.152 10.331 1.00 32.94 ? 481 ILE A CG2 1 ATOM 1417 C CD1 . ILE A 1 181 ? -64.465 -1.950 10.200 1.00 43.68 ? 481 ILE A CD1 1 ATOM 1418 N N . GLY A 1 182 ? -64.199 -6.705 12.854 1.00 35.47 ? 482 GLY A N 1 ATOM 1419 C CA . GLY A 1 182 ? -63.889 -8.106 13.094 1.00 37.92 ? 482 GLY A CA 1 ATOM 1420 C C . GLY A 1 182 ? -63.393 -8.499 14.478 1.00 35.70 ? 482 GLY A C 1 ATOM 1421 O O . GLY A 1 182 ? -63.318 -7.684 15.398 1.00 29.07 ? 482 GLY A O 1 ATOM 1422 N N . THR A 1 183 ? -63.058 -9.777 14.617 1.00 35.79 ? 483 THR A N 1 ATOM 1423 C CA . THR A 1 183 ? -62.556 -10.323 15.867 1.00 32.07 ? 483 THR A CA 1 ATOM 1424 C C . THR A 1 183 ? -61.064 -10.594 15.750 1.00 31.72 ? 483 THR A C 1 ATOM 1425 O O . THR A 1 183 ? -60.604 -11.203 14.780 1.00 29.58 ? 483 THR A O 1 ATOM 1426 C CB . THR A 1 183 ? -63.297 -11.626 16.238 1.00 37.37 ? 483 THR A CB 1 ATOM 1427 O OG1 . THR A 1 183 ? -64.607 -11.311 16.719 1.00 41.09 ? 483 THR A OG1 1 ATOM 1428 C CG2 . THR A 1 183 ? -62.557 -12.383 17.317 1.00 27.91 ? 483 THR A CG2 1 ATOM 1429 N N . ARG A 1 184 ? -60.304 -10.116 16.729 1.00 31.26 ? 484 ARG A N 1 ATOM 1430 C CA . ARG A 1 184 ? -58.875 -10.408 16.796 1.00 28.32 ? 484 ARG A CA 1 ATOM 1431 C C . ARG A 1 184 ? -58.538 -10.925 18.190 1.00 27.98 ? 484 ARG A C 1 ATOM 1432 O O . ARG A 1 184 ? -59.331 -10.772 19.126 1.00 27.71 ? 484 ARG A O 1 ATOM 1433 C CB . ARG A 1 184 ? -58.047 -9.176 16.444 1.00 28.71 ? 484 ARG A CB 1 ATOM 1434 C CG . ARG A 1 184 ? -58.335 -8.614 15.046 1.00 27.45 ? 484 ARG A CG 1 ATOM 1435 C CD . ARG A 1 184 ? -57.968 -9.604 13.945 1.00 33.54 ? 484 ARG A CD 1 ATOM 1436 N NE . ARG A 1 184 ? -58.040 -8.981 12.627 1.00 36.99 ? 484 ARG A NE 1 ATOM 1437 C CZ . ARG A 1 184 ? -59.153 -8.871 11.907 1.00 35.12 ? 484 ARG A CZ 1 ATOM 1438 N NH1 . ARG A 1 184 ? -59.122 -8.278 10.722 1.00 39.40 ? 484 ARG A NH1 1 ATOM 1439 N NH2 . ARG A 1 184 ? -60.300 -9.352 12.368 1.00 31.81 ? 484 ARG A NH2 1 ATOM 1440 N N . PHE A 1 185 ? -57.377 -11.553 18.330 1.00 29.20 ? 485 PHE A N 1 ATOM 1441 C CA . PHE A 1 185 ? -57.013 -12.134 19.616 1.00 33.60 ? 485 PHE A CA 1 ATOM 1442 C C . PHE A 1 185 ? -55.511 -12.128 19.864 1.00 32.79 ? 485 PHE A C 1 ATOM 1443 O O . PHE A 1 185 ? -54.705 -12.060 18.937 1.00 30.16 ? 485 PHE A O 1 ATOM 1444 C CB . PHE A 1 185 ? -57.544 -13.565 19.733 1.00 34.21 ? 485 PHE A CB 1 ATOM 1445 C CG . PHE A 1 185 ? -56.742 -14.567 18.952 1.00 36.18 ? 485 PHE A CG 1 ATOM 1446 C CD1 . PHE A 1 185 ? -56.981 -14.762 17.599 1.00 42.55 ? 485 PHE A CD1 1 ATOM 1447 C CD2 . PHE A 1 185 ? -55.743 -15.302 19.564 1.00 36.80 ? 485 PHE A CD2 1 ATOM 1448 C CE1 . PHE A 1 185 ? -56.243 -15.674 16.873 1.00 45.28 ? 485 PHE A CE1 1 ATOM 1449 C CE2 . PHE A 1 185 ? -54.995 -16.217 18.844 1.00 41.71 ? 485 PHE A CE2 1 ATOM 1450 C CZ . PHE A 1 185 ? -55.245 -16.403 17.495 1.00 43.91 ? 485 PHE A CZ 1 ATOM 1451 N N . GLN A 1 186 ? -55.149 -12.195 21.136 1.00 30.67 ? 486 GLN A N 1 ATOM 1452 C CA . GLN A 1 186 ? -53.757 -12.292 21.537 1.00 29.89 ? 486 GLN A CA 1 ATOM 1453 C C . GLN A 1 186 ? -53.641 -13.418 22.566 1.00 30.55 ? 486 GLN A C 1 ATOM 1454 O O . GLN A 1 186 ? -54.393 -13.456 23.543 1.00 30.94 ? 486 GLN A O 1 ATOM 1455 C CB . GLN A 1 186 ? -53.292 -10.963 22.141 1.00 33.79 ? 486 GLN A CB 1 ATOM 1456 C CG . GLN A 1 186 ? -51.946 -11.018 22.862 1.00 37.45 ? 486 GLN A CG 1 ATOM 1457 C CD . GLN A 1 186 ? -50.770 -11.130 21.910 1.00 41.89 ? 486 GLN A CD 1 ATOM 1458 O OE1 . GLN A 1 186 ? -50.329 -10.134 21.336 1.00 43.49 ? 486 GLN A OE1 1 ATOM 1459 N NE2 . GLN A 1 186 ? -50.246 -12.343 21.749 1.00 43.15 ? 486 GLN A NE2 1 ATOM 1460 N N . GLU A 1 187 ? -52.709 -14.335 22.343 1.00 27.38 ? 487 GLU A N 1 ATOM 1461 C CA . GLU A 1 187 ? -52.524 -15.451 23.256 1.00 36.07 ? 487 GLU A CA 1 ATOM 1462 C C . GLU A 1 187 ? -51.521 -15.100 24.352 1.00 33.90 ? 487 GLU A C 1 ATOM 1463 O O . GLU A 1 187 ? -50.427 -14.611 24.077 1.00 32.79 ? 487 GLU A O 1 ATOM 1464 C CB . GLU A 1 187 ? -52.109 -16.728 22.508 1.00 33.74 ? 487 GLU A CB 1 ATOM 1465 C CG . GLU A 1 187 ? -52.234 -18.000 23.367 1.00 35.18 ? 487 GLU A CG 1 ATOM 1466 C CD . GLU A 1 187 ? -52.081 -19.291 22.575 1.00 47.74 ? 487 GLU A CD 1 ATOM 1467 O OE1 . GLU A 1 187 ? -50.960 -19.580 22.106 1.00 51.51 ? 487 GLU A OE1 1 ATOM 1468 O OE2 . GLU A 1 187 ? -53.080 -20.033 22.443 1.00 47.52 ? 487 GLU A OE2 1 ATOM 1469 N N . TYR A 1 188 ? -51.919 -15.344 25.595 1.00 32.49 ? 488 TYR A N 1 ATOM 1470 C CA . TYR A 1 188 ? -51.056 -15.133 26.751 1.00 30.77 ? 488 TYR A CA 1 ATOM 1471 C C . TYR A 1 188 ? -50.635 -16.470 27.365 1.00 33.53 ? 488 TYR A C 1 ATOM 1472 O O . TYR A 1 188 ? -51.325 -17.476 27.217 1.00 34.79 ? 488 TYR A O 1 ATOM 1473 C CB . TYR A 1 188 ? -51.766 -14.263 27.801 1.00 28.12 ? 488 TYR A CB 1 ATOM 1474 C CG . TYR A 1 188 ? -51.922 -12.818 27.386 1.00 30.07 ? 488 TYR A CG 1 ATOM 1475 C CD1 . TYR A 1 188 ? -52.899 -12.434 26.469 1.00 31.87 ? 488 TYR A CD1 1 ATOM 1476 C CD2 . TYR A 1 188 ? -51.086 -11.836 27.899 1.00 29.30 ? 488 TYR A CD2 1 ATOM 1477 C CE1 . TYR A 1 188 ? -53.033 -11.103 26.078 1.00 29.59 ? 488 TYR A CE1 1 ATOM 1478 C CE2 . TYR A 1 188 ? -51.211 -10.506 27.515 1.00 32.61 ? 488 TYR A CE2 1 ATOM 1479 C CZ . TYR A 1 188 ? -52.186 -10.145 26.608 1.00 34.99 ? 488 TYR A CZ 1 ATOM 1480 O OH . TYR A 1 188 ? -52.303 -8.823 26.234 1.00 38.78 ? 488 TYR A OH 1 ATOM 1481 N N . ILE A 1 189 ? -49.497 -16.477 28.054 1.00 34.76 ? 489 ILE A N 1 ATOM 1482 C CA . ILE A 1 189 ? -49.054 -17.669 28.768 1.00 33.09 ? 489 ILE A CA 1 ATOM 1483 C C . ILE A 1 189 ? -48.840 -17.396 30.252 1.00 33.67 ? 489 ILE A C 1 ATOM 1484 O O . ILE A 1 189 ? -48.163 -16.435 30.618 1.00 30.69 ? 489 ILE A O 1 ATOM 1485 C CB . ILE A 1 189 ? -47.744 -18.221 28.183 1.00 33.17 ? 489 ILE A CB 1 ATOM 1486 C CG1 . ILE A 1 189 ? -47.965 -18.696 26.746 1.00 37.76 ? 489 ILE A CG1 1 ATOM 1487 C CG2 . ILE A 1 189 ? -47.223 -19.362 29.041 1.00 34.82 ? 489 ILE A CG2 1 ATOM 1488 C CD1 . ILE A 1 189 ? -46.700 -19.158 26.063 1.00 43.92 ? 489 ILE A CD1 1 ATOM 1489 N N . LEU A 1 190 ? -49.429 -18.232 31.104 1.00 36.56 ? 490 LEU A N 1 ATOM 1490 C CA . LEU A 1 190 ? -49.092 -18.216 32.524 1.00 34.26 ? 490 LEU A CA 1 ATOM 1491 C C . LEU A 1 190 ? -48.229 -19.427 32.797 1.00 36.16 ? 490 LEU A C 1 ATOM 1492 O O . LEU A 1 190 ? -48.676 -20.564 32.651 1.00 38.76 ? 490 LEU A O 1 ATOM 1493 C CB . LEU A 1 190 ? -50.334 -18.243 33.420 1.00 38.39 ? 490 LEU A CB 1 ATOM 1494 C CG . LEU A 1 190 ? -50.012 -18.272 34.923 1.00 36.44 ? 490 LEU A CG 1 ATOM 1495 C CD1 . LEU A 1 190 ? -49.171 -17.070 35.322 1.00 32.26 ? 490 LEU A CD1 1 ATOM 1496 C CD2 . LEU A 1 190 ? -51.266 -18.349 35.783 1.00 41.01 ? 490 LEU A CD2 1 ATOM 1497 N N . ALA A 1 191 ? -46.984 -19.189 33.179 1.00 34.72 ? 491 ALA A N 1 ATOM 1498 C CA . ALA A 1 191 ? -46.064 -20.299 33.397 1.00 35.24 ? 491 ALA A CA 1 ATOM 1499 C C . ALA A 1 191 ? -45.650 -20.440 34.860 1.00 31.79 ? 491 ALA A C 1 ATOM 1500 O O . ALA A 1 191 ? -45.649 -19.461 35.630 1.00 30.16 ? 491 ALA A O 1 ATOM 1501 C CB . ALA A 1 191 ? -44.843 -20.175 32.494 1.00 32.21 ? 491 ALA A CB 1 ATOM 1502 N N . LEU A 1 192 ? -45.313 -21.675 35.230 1.00 32.50 ? 492 LEU A N 1 ATOM 1503 C CA . LEU A 1 192 ? -44.870 -21.995 36.579 1.00 35.19 ? 492 LEU A CA 1 ATOM 1504 C C . LEU A 1 192 ? -43.453 -21.488 36.805 1.00 32.43 ? 492 LEU A C 1 ATOM 1505 O O . LEU A 1 192 ? -42.513 -21.920 36.137 1.00 27.26 ? 492 LEU A O 1 ATOM 1506 C CB . LEU A 1 192 ? -44.925 -23.506 36.818 1.00 33.51 ? 492 LEU A CB 1 ATOM 1507 C CG . LEU A 1 192 ? -44.398 -23.984 38.178 1.00 34.00 ? 492 LEU A CG 1 ATOM 1508 C CD1 . LEU A 1 192 ? -45.183 -23.372 39.335 1.00 31.31 ? 492 LEU A CD1 1 ATOM 1509 C CD2 . LEU A 1 192 ? -44.397 -25.509 38.282 1.00 25.10 ? 492 LEU A CD2 1 ATOM 1510 N N . ALA A 1 193 ? -43.309 -20.558 37.741 1.00 29.51 ? 493 ALA A N 1 ATOM 1511 C CA . ALA A 1 193 ? -41.993 -20.075 38.124 1.00 33.32 ? 493 ALA A CA 1 ATOM 1512 C C . ALA A 1 193 ? -41.219 -21.155 38.860 1.00 32.53 ? 493 ALA A C 1 ATOM 1513 O O . ALA A 1 193 ? -41.796 -22.095 39.412 1.00 30.92 ? 493 ALA A O 1 ATOM 1514 C CB . ALA A 1 193 ? -42.110 -18.837 38.989 1.00 30.30 ? 493 ALA A CB 1 ATOM 1515 N N . ASP A 1 194 ? -39.904 -20.997 38.874 1.00 33.56 ? 494 ASP A N 1 ATOM 1516 C CA . ASP A 1 194 ? -39.024 -21.922 39.556 1.00 31.85 ? 494 ASP A CA 1 ATOM 1517 C C . ASP A 1 194 ? -38.133 -21.094 40.457 1.00 29.80 ? 494 ASP A C 1 ATOM 1518 O O . ASP A 1 194 ? -38.042 -19.882 40.273 1.00 21.14 ? 494 ASP A O 1 ATOM 1519 C CB . ASP A 1 194 ? -38.176 -22.659 38.520 1.00 34.14 ? 494 ASP A CB 1 ATOM 1520 C CG . ASP A 1 194 ? -37.426 -23.843 39.108 1.00 35.60 ? 494 ASP A CG 1 ATOM 1521 O OD1 . ASP A 1 194 ? -37.724 -24.220 40.261 1.00 32.06 ? 494 ASP A OD1 1 ATOM 1522 O OD2 . ASP A 1 194 ? -36.545 -24.404 38.415 1.00 39.45 ? 494 ASP A OD2 1 ATOM 1523 N N . VAL A 1 195 ? -37.471 -21.728 41.425 1.00 29.44 ? 495 VAL A N 1 ATOM 1524 C CA . VAL A 1 195 ? -36.414 -21.036 42.172 1.00 25.42 ? 495 VAL A CA 1 ATOM 1525 C C . VAL A 1 195 ? -35.174 -20.909 41.279 1.00 27.54 ? 495 VAL A C 1 ATOM 1526 O O . VAL A 1 195 ? -35.037 -21.635 40.296 1.00 22.07 ? 495 VAL A O 1 ATOM 1527 C CB . VAL A 1 195 ? -36.064 -21.733 43.514 1.00 28.96 ? 495 VAL A CB 1 ATOM 1528 C CG1 . VAL A 1 195 ? -37.248 -21.681 44.459 1.00 29.14 ? 495 VAL A CG1 1 ATOM 1529 C CG2 . VAL A 1 195 ? -35.620 -23.179 43.290 1.00 28.10 ? 495 VAL A CG2 1 ATOM 1530 N N . PRO A 1 196 ? -34.279 -19.965 41.600 1.00 30.00 ? 496 PRO A N 1 ATOM 1531 C CA . PRO A 1 196 ? -33.074 -19.741 40.793 1.00 29.47 ? 496 PRO A CA 1 ATOM 1532 C C . PRO A 1 196 ? -32.142 -20.946 40.751 1.00 27.13 ? 496 PRO A C 1 ATOM 1533 O O . PRO A 1 196 ? -32.157 -21.780 41.658 1.00 26.75 ? 496 PRO A O 1 ATOM 1534 C CB . PRO A 1 196 ? -32.373 -18.590 41.524 1.00 26.71 ? 496 PRO A CB 1 ATOM 1535 C CG . PRO A 1 196 ? -33.443 -17.918 42.290 1.00 26.61 ? 496 PRO A CG 1 ATOM 1536 C CD . PRO A 1 196 ? -34.393 -18.992 42.698 1.00 24.06 ? 496 PRO A CD 1 ATOM 1537 N N . SER A 1 197 ? -31.334 -21.028 39.699 1.00 26.23 ? 497 SER A N 1 ATOM 1538 C CA . SER A 1 197 ? -30.316 -22.064 39.599 1.00 31.36 ? 497 SER A CA 1 ATOM 1539 C C . SER A 1 197 ? -29.083 -21.662 40.408 1.00 30.12 ? 497 SER A C 1 ATOM 1540 O O . SER A 1 197 ? -29.061 -20.607 41.043 1.00 28.47 ? 497 SER A O 1 ATOM 1541 C CB . SER A 1 197 ? -29.937 -22.320 38.137 1.00 28.71 ? 497 SER A CB 1 ATOM 1542 O OG . SER A 1 197 ? -29.305 -21.189 37.562 1.00 33.27 ? 497 SER A OG 1 ATOM 1543 N N . SER A 1 198 ? -28.054 -22.500 40.381 1.00 29.72 ? 498 SER A N 1 ATOM 1544 C CA . SER A 1 198 ? -26.865 -22.262 41.186 1.00 27.81 ? 498 SER A CA 1 ATOM 1545 C C . SER A 1 198 ? -26.082 -21.034 40.736 1.00 31.79 ? 498 SER A C 1 ATOM 1546 O O . SER A 1 198 ? -25.811 -20.870 39.551 1.00 36.26 ? 498 SER A O 1 ATOM 1547 C CB . SER A 1 198 ? -25.950 -23.484 41.154 1.00 28.43 ? 498 SER A CB 1 ATOM 1548 O OG . SER A 1 198 ? -26.596 -24.616 41.706 1.00 35.95 ? 498 SER A OG 1 ATOM 1549 N N . PRO A 1 199 ? -25.721 -20.159 41.690 1.00 30.25 ? 499 PRO A N 1 ATOM 1550 C CA . PRO A 1 199 ? -24.661 -19.187 41.417 1.00 33.73 ? 499 PRO A CA 1 ATOM 1551 C C . PRO A 1 199 ? -23.374 -19.979 41.188 1.00 32.16 ? 499 PRO A C 1 ATOM 1552 O O . PRO A 1 199 ? -23.282 -21.107 41.675 1.00 35.72 ? 499 PRO A O 1 ATOM 1553 C CB . PRO A 1 199 ? -24.567 -18.388 42.723 1.00 30.41 ? 499 PRO A CB 1 ATOM 1554 C CG . PRO A 1 199 ? -25.863 -18.626 43.425 1.00 28.70 ? 499 PRO A CG 1 ATOM 1555 C CD . PRO A 1 199 ? -26.261 -20.025 43.052 1.00 28.70 ? 499 PRO A CD 1 ATOM 1556 N N . TYR A 1 200 ? -22.418 -19.429 40.445 1.00 35.57 ? 500 TYR A N 1 ATOM 1557 C CA . TYR A 1 200 ? -21.183 -20.155 40.156 1.00 38.63 ? 500 TYR A CA 1 ATOM 1558 C C . TYR A 1 200 ? -19.965 -19.242 40.068 1.00 39.83 ? 500 TYR A C 1 ATOM 1559 O O . TYR A 1 200 ? -20.076 -18.020 40.209 1.00 37.26 ? 500 TYR A O 1 ATOM 1560 C CB . TYR A 1 200 ? -21.335 -20.987 38.878 1.00 39.29 ? 500 TYR A CB 1 ATOM 1561 C CG . TYR A 1 200 ? -21.612 -20.180 37.636 1.00 46.71 ? 500 TYR A CG 1 ATOM 1562 C CD1 . TYR A 1 200 ? -20.576 -19.749 36.821 1.00 46.99 ? 500 TYR A CD1 1 ATOM 1563 C CD2 . TYR A 1 200 ? -22.910 -19.854 37.270 1.00 45.41 ? 500 TYR A CD2 1 ATOM 1564 C CE1 . TYR A 1 200 ? -20.821 -19.015 35.679 1.00 50.36 ? 500 TYR A CE1 1 ATOM 1565 C CE2 . TYR A 1 200 ? -23.167 -19.118 36.129 1.00 46.64 ? 500 TYR A CE2 1 ATOM 1566 C CZ . TYR A 1 200 ? -22.118 -18.699 35.336 1.00 49.03 ? 500 TYR A CZ 1 ATOM 1567 O OH . TYR A 1 200 ? -22.362 -17.961 34.200 1.00 48.16 ? 500 TYR A OH 1 ATOM 1568 N N . GLY A 1 201 ? -18.798 -19.837 39.843 1.00 40.05 ? 501 GLY A N 1 ATOM 1569 C CA . GLY A 1 201 ? -17.570 -19.065 39.803 1.00 42.47 ? 501 GLY A CA 1 ATOM 1570 C C . GLY A 1 201 ? -17.381 -18.293 41.094 1.00 45.85 ? 501 GLY A C 1 ATOM 1571 O O . GLY A 1 201 ? -17.066 -17.099 41.083 1.00 42.37 ? 501 GLY A O 1 ATOM 1572 N N . VAL A 1 202 ? -17.578 -18.981 42.214 1.00 39.95 ? 502 VAL A N 1 ATOM 1573 C CA . VAL A 1 202 ? -17.489 -18.348 43.517 1.00 43.41 ? 502 VAL A CA 1 ATOM 1574 C C . VAL A 1 202 ? -16.035 -18.199 43.941 1.00 48.48 ? 502 VAL A C 1 ATOM 1575 O O . VAL A 1 202 ? -15.258 -19.141 43.861 1.00 51.89 ? 502 VAL A O 1 ATOM 1576 C CB . VAL A 1 202 ? -18.270 -19.139 44.577 1.00 47.37 ? 502 VAL A CB 1 ATOM 1577 C CG1 . VAL A 1 202 ? -17.907 -20.612 44.510 1.00 56.65 ? 502 VAL A CG1 1 ATOM 1578 C CG2 . VAL A 1 202 ? -17.999 -18.575 45.968 1.00 39.37 ? 502 VAL A CG2 1 ATOM 1579 N N . LYS A 1 203 ? -15.677 -17.005 44.397 1.00 46.75 ? 503 LYS A N 1 ATOM 1580 C CA . LYS A 1 203 ? -14.296 -16.706 44.746 1.00 47.42 ? 503 LYS A CA 1 ATOM 1581 C C . LYS A 1 203 ? -14.185 -15.893 46.030 1.00 45.65 ? 503 LYS A C 1 ATOM 1582 O O . LYS A 1 203 ? -15.035 -15.053 46.327 1.00 41.96 ? 503 LYS A O 1 ATOM 1583 C CB . LYS A 1 203 ? -13.617 -15.941 43.606 1.00 53.36 ? 503 LYS A CB 1 ATOM 1584 C CG . LYS A 1 203 ? -13.546 -16.693 42.284 1.00 58.39 ? 503 LYS A CG 1 ATOM 1585 C CD . LYS A 1 203 ? -12.745 -17.980 42.412 1.00 67.37 ? 503 LYS A CD 1 ATOM 1586 C CE . LYS A 1 203 ? -12.489 -18.618 41.052 1.00 72.10 ? 503 LYS A CE 1 ATOM 1587 N NZ . LYS A 1 203 ? -13.747 -18.844 40.282 1.00 65.35 ? 503 LYS A NZ 1 ATOM 1588 N N . ILE A 1 204 ? -13.127 -16.151 46.789 1.00 45.15 ? 504 ILE A N 1 ATOM 1589 C CA . ILE A 1 204 ? -12.784 -15.315 47.929 1.00 43.29 ? 504 ILE A CA 1 ATOM 1590 C C . ILE A 1 204 ? -11.801 -14.257 47.468 1.00 50.24 ? 504 ILE A C 1 ATOM 1591 O O . ILE A 1 204 ? -10.609 -14.517 47.356 1.00 53.29 ? 504 ILE A O 1 ATOM 1592 C CB . ILE A 1 204 ? -12.135 -16.128 49.044 1.00 45.55 ? 504 ILE A CB 1 ATOM 1593 C CG1 . ILE A 1 204 ? -13.109 -17.190 49.556 1.00 44.00 ? 504 ILE A CG1 1 ATOM 1594 C CG2 . ILE A 1 204 ? -11.707 -15.208 50.176 1.00 48.67 ? 504 ILE A CG2 1 ATOM 1595 C CD1 . ILE A 1 204 ? -14.382 -16.608 50.125 1.00 39.78 ? 504 ILE A CD1 1 ATOM 1596 N N . ILE A 1 205 ? -12.305 -13.060 47.195 1.00 54.11 ? 505 ILE A N 1 ATOM 1597 C CA . ILE A 1 205 ? -11.494 -12.043 46.537 1.00 56.24 ? 505 ILE A CA 1 ATOM 1598 C C . ILE A 1 205 ? -10.915 -10.994 47.485 1.00 59.62 ? 505 ILE A C 1 ATOM 1599 O O . ILE A 1 205 ? -10.229 -10.072 47.052 1.00 62.52 ? 505 ILE A O 1 ATOM 1600 C CB . ILE A 1 205 ? -12.253 -11.380 45.364 1.00 53.82 ? 505 ILE A CB 1 ATOM 1601 C CG1 . ILE A 1 205 ? -13.602 -10.830 45.825 1.00 55.82 ? 505 ILE A CG1 1 ATOM 1602 C CG2 . ILE A 1 205 ? -12.458 -12.384 44.239 1.00 52.68 ? 505 ILE A CG2 1 ATOM 1603 C CD1 . ILE A 1 205 ? -13.524 -9.453 46.434 1.00 65.08 ? 505 ILE A CD1 1 ATOM 1604 N N . GLU A 1 206 ? -11.191 -11.144 48.775 1.00 56.25 ? 506 GLU A N 1 ATOM 1605 C CA . GLU A 1 206 ? -10.537 -10.341 49.806 1.00 59.41 ? 506 GLU A CA 1 ATOM 1606 C C . GLU A 1 206 ? -10.565 -11.122 51.112 1.00 56.46 ? 506 GLU A C 1 ATOM 1607 O O . GLU A 1 206 ? -11.564 -11.765 51.431 1.00 55.12 ? 506 GLU A O 1 ATOM 1608 C CB . GLU A 1 206 ? -11.225 -8.985 49.983 1.00 64.70 ? 506 GLU A CB 1 ATOM 1609 C CG . GLU A 1 206 ? -10.970 -7.995 48.856 1.00 71.75 ? 506 GLU A CG 1 ATOM 1610 C CD . GLU A 1 206 ? -11.466 -6.601 49.180 1.00 82.30 ? 506 GLU A CD 1 ATOM 1611 O OE1 . GLU A 1 206 ? -11.698 -6.318 50.376 1.00 80.04 ? 506 GLU A OE1 1 ATOM 1612 O OE2 . GLU A 1 206 ? -11.619 -5.790 48.239 1.00 88.14 ? 506 GLU A OE2 1 ATOM 1613 N N . LEU A 1 207 ? -9.475 -11.064 51.868 1.00 49.33 ? 507 LEU A N 1 ATOM 1614 C CA . LEU A 1 207 ? -9.337 -11.894 53.054 1.00 49.47 ? 507 LEU A CA 1 ATOM 1615 C C . LEU A 1 207 ? -8.489 -11.230 54.137 1.00 51.38 ? 507 LEU A C 1 ATOM 1616 O O . LEU A 1 207 ? -7.436 -10.663 53.855 1.00 51.19 ? 507 LEU A O 1 ATOM 1617 C CB . LEU A 1 207 ? -8.738 -13.246 52.663 1.00 51.38 ? 507 LEU A CB 1 ATOM 1618 C CG . LEU A 1 207 ? -8.726 -14.347 53.723 1.00 48.75 ? 507 LEU A CG 1 ATOM 1619 C CD1 . LEU A 1 207 ? -10.055 -14.420 54.462 1.00 45.46 ? 507 LEU A CD1 1 ATOM 1620 C CD2 . LEU A 1 207 ? -8.391 -15.684 53.084 1.00 48.99 ? 507 LEU A CD2 1 ATOM 1621 N N . SER A 1 208 ? -8.952 -11.311 55.379 1.00 48.35 ? 508 SER A N 1 ATOM 1622 C CA . SER A 1 208 ? -8.241 -10.712 56.504 1.00 44.63 ? 508 SER A CA 1 ATOM 1623 C C . SER A 1 208 ? -8.221 -11.674 57.686 1.00 44.89 ? 508 SER A C 1 ATOM 1624 O O . SER A 1 208 ? -8.290 -12.890 57.506 1.00 42.58 ? 508 SER A O 1 ATOM 1625 C CB . SER A 1 208 ? -8.910 -9.401 56.921 1.00 45.17 ? 508 SER A CB 1 ATOM 1626 O OG . SER A 1 208 ? -10.163 -9.644 57.545 1.00 47.71 ? 508 SER A OG 1 ATOM 1627 N N . GLN A 1 209 ? -8.122 -11.135 58.898 1.00 43.28 ? 509 GLN A N 1 ATOM 1628 C CA . GLN A 1 209 ? -8.166 -11.987 60.079 1.00 40.23 ? 509 GLN A CA 1 ATOM 1629 C C . GLN A 1 209 ? -9.608 -12.325 60.458 1.00 41.55 ? 509 GLN A C 1 ATOM 1630 O O . GLN A 1 209 ? -9.902 -13.451 60.843 1.00 36.09 ? 509 GLN A O 1 ATOM 1631 C CB . GLN A 1 209 ? -7.431 -11.346 61.261 1.00 41.56 ? 509 GLN A CB 1 ATOM 1632 C CG . GLN A 1 209 ? -5.919 -11.211 61.075 1.00 44.47 ? 509 GLN A CG 1 ATOM 1633 C CD . GLN A 1 209 ? -5.202 -10.733 62.336 1.00 48.79 ? 509 GLN A CD 1 ATOM 1634 O OE1 . GLN A 1 209 ? -3.986 -10.554 62.339 1.00 48.13 ? 509 GLN A OE1 1 ATOM 1635 N NE2 . GLN A 1 209 ? -5.954 -10.531 63.411 1.00 48.11 ? 509 GLN A NE2 1 ATOM 1636 N N . THR A 1 210 ? -10.509 -11.354 60.335 1.00 41.30 ? 510 THR A N 1 ATOM 1637 C CA . THR A 1 210 ? -11.865 -11.539 60.832 1.00 39.93 ? 510 THR A CA 1 ATOM 1638 C C . THR A 1 210 ? -12.932 -11.260 59.781 1.00 41.94 ? 510 THR A C 1 ATOM 1639 O O . THR A 1 210 ? -14.127 -11.263 60.089 1.00 41.00 ? 510 THR A O 1 ATOM 1640 C CB . THR A 1 210 ? -12.133 -10.643 62.048 1.00 42.89 ? 510 THR A CB 1 ATOM 1641 O OG1 . THR A 1 210 ? -12.243 -9.281 61.619 1.00 46.54 ? 510 THR A OG1 1 ATOM 1642 C CG2 . THR A 1 210 ? -10.999 -10.772 63.065 1.00 43.54 ? 510 THR A CG2 1 ATOM 1643 N N . THR A 1 211 ? -12.503 -11.021 58.546 1.00 39.86 ? 511 THR A N 1 ATOM 1644 C CA . THR A 1 211 ? -13.436 -10.730 57.465 1.00 42.21 ? 511 THR A CA 1 ATOM 1645 C C . THR A 1 211 ? -13.000 -11.337 56.129 1.00 41.81 ? 511 THR A C 1 ATOM 1646 O O . THR A 1 211 ? -11.832 -11.680 55.937 1.00 43.11 ? 511 THR A O 1 ATOM 1647 C CB . THR A 1 211 ? -13.631 -9.209 57.270 1.00 41.67 ? 511 THR A CB 1 ATOM 1648 O OG1 . THR A 1 211 ? -12.486 -8.660 56.613 1.00 44.27 ? 511 THR A OG1 1 ATOM 1649 C CG2 . THR A 1 211 ? -13.832 -8.506 58.604 1.00 43.84 ? 511 THR A CG2 1 ATOM 1650 N N . ALA A 1 212 ? -13.955 -11.460 55.212 1.00 40.49 ? 512 ALA A N 1 ATOM 1651 C CA . ALA A 1 212 ? -13.683 -11.897 53.850 1.00 41.61 ? 512 ALA A CA 1 ATOM 1652 C C . ALA A 1 212 ? -14.818 -11.483 52.916 1.00 43.64 ? 512 ALA A C 1 ATOM 1653 O O . ALA A 1 212 ? -15.980 -11.451 53.310 1.00 43.89 ? 512 ALA A O 1 ATOM 1654 C CB . ALA A 1 212 ? -13.485 -13.396 53.801 1.00 40.86 ? 512 ALA A CB 1 ATOM 1655 N N . LYS A 1 213 ? -14.472 -11.166 51.676 1.00 43.98 ? 513 LYS A N 1 ATOM 1656 C CA . LYS A 1 213 ? -15.470 -10.799 50.683 1.00 45.66 ? 513 LYS A CA 1 ATOM 1657 C C . LYS A 1 213 ? -15.570 -11.901 49.648 1.00 43.98 ? 513 LYS A C 1 ATOM 1658 O O . LYS A 1 213 ? -14.567 -12.337 49.090 1.00 43.75 ? 513 LYS A O 1 ATOM 1659 C CB . LYS A 1 213 ? -15.124 -9.464 50.020 1.00 51.28 ? 513 LYS A CB 1 ATOM 1660 C CG . LYS A 1 213 ? -16.077 -9.069 48.910 1.00 52.23 ? 513 LYS A CG 1 ATOM 1661 C CD . LYS A 1 213 ? -16.266 -7.553 48.833 1.00 65.81 ? 513 LYS A CD 1 ATOM 1662 C CE . LYS A 1 213 ? -14.983 -6.834 48.456 1.00 76.34 ? 513 LYS A CE 1 ATOM 1663 N NZ . LYS A 1 213 ? -15.212 -5.376 48.236 1.00 83.58 ? 513 LYS A NZ 1 ATOM 1664 N N . VAL A 1 214 ? -16.784 -12.374 49.415 1.00 43.46 ? 514 VAL A N 1 ATOM 1665 C CA . VAL A 1 214 ? -16.990 -13.436 48.452 1.00 45.39 ? 514 VAL A CA 1 ATOM 1666 C C . VAL A 1 214 ? -17.605 -12.833 47.198 1.00 37.50 ? 514 VAL A C 1 ATOM 1667 O O . VAL A 1 214 ? -18.421 -11.922 47.272 1.00 37.57 ? 514 VAL A O 1 ATOM 1668 C CB . VAL A 1 214 ? -17.829 -14.600 49.050 1.00 45.07 ? 514 VAL A CB 1 ATOM 1669 C CG1 . VAL A 1 214 ? -18.785 -14.087 50.110 1.00 41.73 ? 514 VAL A CG1 1 ATOM 1670 C CG2 . VAL A 1 214 ? -18.561 -15.371 47.965 1.00 38.00 ? 514 VAL A CG2 1 ATOM 1671 N N . SER A 1 215 ? -17.156 -13.313 46.047 1.00 38.21 ? 515 SER A N 1 ATOM 1672 C CA . SER A 1 215 ? -17.613 -12.809 44.765 1.00 38.56 ? 515 SER A CA 1 ATOM 1673 C C . SER A 1 215 ? -18.094 -13.987 43.936 1.00 37.89 ? 515 SER A C 1 ATOM 1674 O O . SER A 1 215 ? -17.543 -15.084 44.036 1.00 39.87 ? 515 SER A O 1 ATOM 1675 C CB . SER A 1 215 ? -16.465 -12.099 44.041 1.00 43.20 ? 515 SER A CB 1 ATOM 1676 O OG . SER A 1 215 ? -16.931 -11.322 42.948 1.00 41.84 ? 515 SER A OG 1 ATOM 1677 N N . PHE A 1 216 ? -19.108 -13.766 43.106 1.00 37.08 ? 516 PHE A N 1 ATOM 1678 C CA . PHE A 1 216 ? -19.655 -14.859 42.318 1.00 35.92 ? 516 PHE A CA 1 ATOM 1679 C C . PHE A 1 216 ? -20.425 -14.362 41.093 1.00 36.47 ? 516 PHE A C 1 ATOM 1680 O O . PHE A 1 216 ? -20.714 -13.173 40.968 1.00 39.01 ? 516 PHE A O 1 ATOM 1681 C CB . PHE A 1 216 ? -20.556 -15.724 43.209 1.00 33.02 ? 516 PHE A CB 1 ATOM 1682 C CG . PHE A 1 216 ? -21.548 -14.927 44.001 1.00 32.58 ? 516 PHE A CG 1 ATOM 1683 C CD1 . PHE A 1 216 ? -21.219 -14.443 45.255 1.00 32.91 ? 516 PHE A CD1 1 ATOM 1684 C CD2 . PHE A 1 216 ? -22.796 -14.625 43.472 1.00 34.96 ? 516 PHE A CD2 1 ATOM 1685 C CE1 . PHE A 1 216 ? -22.124 -13.686 45.980 1.00 35.49 ? 516 PHE A CE1 1 ATOM 1686 C CE2 . PHE A 1 216 ? -23.710 -13.872 44.194 1.00 36.64 ? 516 PHE A CE2 1 ATOM 1687 C CZ . PHE A 1 216 ? -23.372 -13.404 45.449 1.00 37.04 ? 516 PHE A CZ 1 ATOM 1688 N N . ASN A 1 217 ? -20.749 -15.289 40.196 1.00 41.38 ? 517 ASN A N 1 ATOM 1689 C CA . ASN A 1 217 ? -21.609 -15.005 39.052 1.00 45.18 ? 517 ASN A CA 1 ATOM 1690 C C . ASN A 1 217 ? -23.067 -15.317 39.374 1.00 41.73 ? 517 ASN A C 1 ATOM 1691 O O . ASN A 1 217 ? -23.352 -16.246 40.131 1.00 37.29 ? 517 ASN A O 1 ATOM 1692 C CB . ASN A 1 217 ? -21.173 -15.832 37.843 1.00 44.27 ? 517 ASN A CB 1 ATOM 1693 C CG . ASN A 1 217 ? -19.814 -15.425 37.317 1.00 53.79 ? 517 ASN A CG 1 ATOM 1694 O OD1 . ASN A 1 217 ? -19.472 -14.242 37.293 1.00 65.57 ? 517 ASN A OD1 1 ATOM 1695 N ND2 . ASN A 1 217 ? -19.034 -16.404 36.883 1.00 52.39 ? 517 ASN A ND2 1 ATOM 1696 N N . LYS A 1 218 ? -23.988 -14.546 38.801 1.00 40.72 ? 518 LYS A N 1 ATOM 1697 C CA . LYS A 1 218 ? -25.409 -14.803 39.002 1.00 39.37 ? 518 LYS A CA 1 ATOM 1698 C C . LYS A 1 218 ? -25.857 -16.046 38.229 1.00 38.34 ? 518 LYS A C 1 ATOM 1699 O O . LYS A 1 218 ? -25.224 -16.446 37.252 1.00 36.63 ? 518 LYS A O 1 ATOM 1700 C CB . LYS A 1 218 ? -26.251 -13.579 38.622 1.00 43.43 ? 518 LYS A CB 1 ATOM 1701 C CG . LYS A 1 218 ? -26.230 -13.217 37.152 1.00 48.07 ? 518 LYS A CG 1 ATOM 1702 C CD . LYS A 1 218 ? -27.296 -12.172 36.845 1.00 54.40 ? 518 LYS A CD 1 ATOM 1703 C CE . LYS A 1 218 ? -27.209 -11.685 35.408 1.00 65.70 ? 518 LYS A CE 1 ATOM 1704 N NZ . LYS A 1 218 ? -27.313 -12.811 34.437 1.00 64.33 ? 518 LYS A NZ 1 ATOM 1705 N N . PRO A 1 219 ? -26.948 -16.679 38.673 1.00 39.60 ? 519 PRO A N 1 ATOM 1706 C CA . PRO A 1 219 ? -27.389 -17.909 38.007 1.00 35.85 ? 519 PRO A CA 1 ATOM 1707 C C . PRO A 1 219 ? -27.795 -17.665 36.548 1.00 35.64 ? 519 PRO A C 1 ATOM 1708 O O . PRO A 1 219 ? -28.203 -16.554 36.197 1.00 33.76 ? 519 PRO A O 1 ATOM 1709 C CB . PRO A 1 219 ? -28.599 -18.340 38.841 1.00 29.88 ? 519 PRO A CB 1 ATOM 1710 C CG . PRO A 1 219 ? -28.440 -17.633 40.152 1.00 29.13 ? 519 PRO A CG 1 ATOM 1711 C CD . PRO A 1 219 ? -27.795 -16.334 39.824 1.00 32.64 ? 519 PRO A CD 1 ATOM 1712 N N . ASP A 1 220 ? -27.677 -18.691 35.710 1.00 38.81 ? 520 ASP A N 1 ATOM 1713 C CA . ASP A 1 220 ? -28.062 -18.567 34.307 1.00 36.63 ? 520 ASP A CA 1 ATOM 1714 C C . ASP A 1 220 ? -29.575 -18.618 34.182 1.00 41.16 ? 520 ASP A C 1 ATOM 1715 O O . ASP A 1 220 ? -30.129 -18.351 33.116 1.00 42.89 ? 520 ASP A O 1 ATOM 1716 C CB . ASP A 1 220 ? -27.426 -19.674 33.461 1.00 38.11 ? 520 ASP A CB 1 ATOM 1717 C CG . ASP A 1 220 ? -25.920 -19.520 33.328 1.00 43.37 ? 520 ASP A CG 1 ATOM 1718 O OD1 . ASP A 1 220 ? -25.250 -20.516 32.993 1.00 45.51 ? 520 ASP A OD1 1 ATOM 1719 O OD2 . ASP A 1 220 ? -25.400 -18.409 33.560 1.00 41.59 ? 520 ASP A OD2 1 ATOM 1720 N N . SER A 1 221 ? -30.236 -18.977 35.279 1.00 37.92 ? 521 SER A N 1 ATOM 1721 C CA . SER A 1 221 ? -31.692 -19.001 35.324 1.00 35.69 ? 521 SER A CA 1 ATOM 1722 C C . SER A 1 221 ? -32.221 -18.368 36.609 1.00 35.67 ? 521 SER A C 1 ATOM 1723 O O . SER A 1 221 ? -31.868 -18.792 37.717 1.00 31.88 ? 521 SER A O 1 ATOM 1724 C CB . SER A 1 221 ? -32.207 -20.429 35.194 1.00 35.11 ? 521 SER A CB 1 ATOM 1725 O OG . SER A 1 221 ? -33.586 -20.484 35.507 1.00 36.73 ? 521 SER A OG 1 ATOM 1726 N N . HIS A 1 222 ? -33.069 -17.354 36.465 1.00 30.16 ? 522 HIS A N 1 ATOM 1727 C CA . HIS A 1 222 ? -33.680 -16.727 37.633 1.00 31.01 ? 522 HIS A CA 1 ATOM 1728 C C . HIS A 1 222 ? -35.006 -17.396 37.977 1.00 28.92 ? 522 HIS A C 1 ATOM 1729 O O . HIS A 1 222 ? -35.652 -17.048 38.960 1.00 31.04 ? 522 HIS A O 1 ATOM 1730 C CB . HIS A 1 222 ? -33.884 -15.232 37.408 1.00 32.49 ? 522 HIS A CB 1 ATOM 1731 C CG . HIS A 1 222 ? -34.610 -14.911 36.140 1.00 40.04 ? 522 HIS A CG 1 ATOM 1732 N ND1 . HIS A 1 222 ? -34.089 -14.077 35.176 1.00 43.93 ? 522 HIS A ND1 1 ATOM 1733 C CD2 . HIS A 1 222 ? -35.804 -15.336 35.667 1.00 32.54 ? 522 HIS A CD2 1 ATOM 1734 C CE1 . HIS A 1 222 ? -34.938 -13.990 34.168 1.00 36.95 ? 522 HIS A CE1 1 ATOM 1735 N NE2 . HIS A 1 222 ? -35.986 -14.746 34.440 1.00 37.52 ? 522 HIS A NE2 1 ATOM 1736 N N . GLY A 1 223 ? -35.413 -18.350 37.152 1.00 30.56 ? 523 GLY A N 1 ATOM 1737 C CA . GLY A 1 223 ? -36.622 -19.111 37.402 1.00 33.42 ? 523 GLY A CA 1 ATOM 1738 C C . GLY A 1 223 ? -37.915 -18.465 36.936 1.00 29.36 ? 523 GLY A C 1 ATOM 1739 O O . GLY A 1 223 ? -38.992 -19.015 37.163 1.00 30.54 ? 523 GLY A O 1 ATOM 1740 N N . GLY A 1 224 ? -37.823 -17.302 36.296 1.00 30.02 ? 524 GLY A N 1 ATOM 1741 C CA . GLY A 1 224 ? -39.000 -16.649 35.749 1.00 31.51 ? 524 GLY A CA 1 ATOM 1742 C C . GLY A 1 224 ? -39.480 -15.443 36.538 1.00 38.08 ? 524 GLY A C 1 ATOM 1743 O O . GLY A 1 224 ? -40.270 -14.653 36.024 1.00 39.61 ? 524 GLY A O 1 ATOM 1744 N N . VAL A 1 225 ? -39.035 -15.319 37.790 1.00 37.10 ? 525 VAL A N 1 ATOM 1745 C CA . VAL A 1 225 ? -39.267 -14.110 38.592 1.00 35.61 ? 525 VAL A CA 1 ATOM 1746 C C . VAL A 1 225 ? -37.944 -13.621 39.184 1.00 39.71 ? 525 VAL A C 1 ATOM 1747 O O . VAL A 1 225 ? -37.080 -14.423 39.522 1.00 36.50 ? 525 VAL A O 1 ATOM 1748 C CB . VAL A 1 225 ? -40.304 -14.317 39.730 1.00 35.01 ? 525 VAL A CB 1 ATOM 1749 C CG1 . VAL A 1 225 ? -41.700 -14.493 39.160 1.00 34.69 ? 525 VAL A CG1 1 ATOM 1750 C CG2 . VAL A 1 225 ? -39.922 -15.498 40.613 1.00 34.73 ? 525 VAL A CG2 1 ATOM 1751 N N . PRO A 1 226 ? -37.793 -12.298 39.331 1.00 38.91 ? 526 PRO A N 1 ATOM 1752 C CA . PRO A 1 226 ? -36.485 -11.684 39.593 1.00 35.97 ? 526 PRO A CA 1 ATOM 1753 C C . PRO A 1 226 ? -35.848 -12.122 40.914 1.00 39.35 ? 526 PRO A C 1 ATOM 1754 O O . PRO A 1 226 ? -36.535 -12.266 41.920 1.00 37.92 ? 526 PRO A O 1 ATOM 1755 C CB . PRO A 1 226 ? -36.804 -10.183 39.649 1.00 39.16 ? 526 PRO A CB 1 ATOM 1756 C CG . PRO A 1 226 ? -38.198 -10.041 39.094 1.00 39.29 ? 526 PRO A CG 1 ATOM 1757 C CD . PRO A 1 226 ? -38.887 -11.318 39.419 1.00 35.90 ? 526 PRO A CD 1 ATOM 1758 N N . ILE A 1 227 ? -34.536 -12.326 40.906 1.00 38.15 ? 527 ILE A N 1 ATOM 1759 C CA . ILE A 1 227 ? -33.809 -12.585 42.141 1.00 34.93 ? 527 ILE A CA 1 ATOM 1760 C C . ILE A 1 227 ? -33.965 -11.388 43.067 1.00 35.28 ? 527 ILE A C 1 ATOM 1761 O O . ILE A 1 227 ? -33.898 -10.246 42.622 1.00 39.35 ? 527 ILE A O 1 ATOM 1762 C CB . ILE A 1 227 ? -32.319 -12.836 41.869 1.00 38.01 ? 527 ILE A CB 1 ATOM 1763 C CG1 . ILE A 1 227 ? -32.144 -14.127 41.059 1.00 35.81 ? 527 ILE A CG1 1 ATOM 1764 C CG2 . ILE A 1 227 ? -31.546 -12.904 43.175 1.00 31.70 ? 527 ILE A CG2 1 ATOM 1765 C CD1 . ILE A 1 227 ? -30.725 -14.379 40.599 1.00 37.49 ? 527 ILE A CD1 1 ATOM 1766 N N . HIS A 1 228 ? -34.196 -11.646 44.349 1.00 38.63 ? 528 HIS A N 1 ATOM 1767 C CA . HIS A 1 228 ? -34.381 -10.563 45.310 1.00 41.09 ? 528 HIS A CA 1 ATOM 1768 C C . HIS A 1 228 ? -33.098 -10.282 46.091 1.00 43.25 ? 528 HIS A C 1 ATOM 1769 O O . HIS A 1 228 ? -32.734 -9.126 46.297 1.00 46.80 ? 528 HIS A O 1 ATOM 1770 C CB . HIS A 1 228 ? -35.539 -10.870 46.261 1.00 41.41 ? 528 HIS A CB 1 ATOM 1771 C CG . HIS A 1 228 ? -35.808 -9.784 47.259 1.00 50.25 ? 528 HIS A CG 1 ATOM 1772 N ND1 . HIS A 1 228 ? -35.535 -9.924 48.602 1.00 55.29 ? 528 HIS A ND1 1 ATOM 1773 C CD2 . HIS A 1 228 ? -36.321 -8.540 47.106 1.00 56.84 ? 528 HIS A CD2 1 ATOM 1774 C CE1 . HIS A 1 228 ? -35.871 -8.813 49.236 1.00 57.92 ? 528 HIS A CE1 1 ATOM 1775 N NE2 . HIS A 1 228 ? -36.350 -7.959 48.351 1.00 63.04 ? 528 HIS A NE2 1 ATOM 1776 N N . HIS A 1 229 ? -32.422 -11.344 46.522 1.00 36.88 ? 529 HIS A N 1 ATOM 1777 C CA . HIS A 1 229 ? -31.126 -11.221 47.182 1.00 37.75 ? 529 HIS A CA 1 ATOM 1778 C C . HIS A 1 229 ? -30.360 -12.542 47.126 1.00 33.94 ? 529 HIS A C 1 ATOM 1779 O O . HIS A 1 229 ? -30.806 -13.503 46.505 1.00 32.05 ? 529 HIS A O 1 ATOM 1780 C CB . HIS A 1 229 ? -31.292 -10.764 48.634 1.00 36.73 ? 529 HIS A CB 1 ATOM 1781 C CG . HIS A 1 229 ? -31.995 -11.756 49.508 1.00 35.92 ? 529 HIS A CG 1 ATOM 1782 N ND1 . HIS A 1 229 ? -33.371 -11.812 49.620 1.00 35.42 ? 529 HIS A ND1 1 ATOM 1783 C CD2 . HIS A 1 229 ? -31.516 -12.732 50.317 1.00 36.79 ? 529 HIS A CD2 1 ATOM 1784 C CE1 . HIS A 1 229 ? -33.704 -12.777 50.456 1.00 37.83 ? 529 HIS A CE1 1 ATOM 1785 N NE2 . HIS A 1 229 ? -32.596 -13.351 50.897 1.00 33.76 ? 529 HIS A NE2 1 ATOM 1786 N N . TYR A 1 230 ? -29.203 -12.578 47.774 1.00 31.58 ? 530 TYR A N 1 ATOM 1787 C CA . TYR A 1 230 ? -28.400 -13.791 47.842 1.00 32.00 ? 530 TYR A CA 1 ATOM 1788 C C . TYR A 1 230 ? -28.189 -14.213 49.273 1.00 30.76 ? 530 TYR A C 1 ATOM 1789 O O . TYR A 1 230 ? -28.211 -13.392 50.185 1.00 28.66 ? 530 TYR A O 1 ATOM 1790 C CB . TYR A 1 230 ? -27.044 -13.579 47.188 1.00 32.60 ? 530 TYR A CB 1 ATOM 1791 C CG . TYR A 1 230 ? -27.129 -13.518 45.697 1.00 30.75 ? 530 TYR A CG 1 ATOM 1792 C CD1 . TYR A 1 230 ? -27.101 -14.676 44.943 1.00 29.34 ? 530 TYR A CD1 1 ATOM 1793 C CD2 . TYR A 1 230 ? -27.257 -12.304 45.040 1.00 34.41 ? 530 TYR A CD2 1 ATOM 1794 C CE1 . TYR A 1 230 ? -27.192 -14.632 43.577 1.00 29.76 ? 530 TYR A CE1 1 ATOM 1795 C CE2 . TYR A 1 230 ? -27.345 -12.249 43.675 1.00 34.33 ? 530 TYR A CE2 1 ATOM 1796 C CZ . TYR A 1 230 ? -27.313 -13.416 42.946 1.00 29.55 ? 530 TYR A CZ 1 ATOM 1797 O OH . TYR A 1 230 ? -27.397 -13.375 41.579 1.00 35.48 ? 530 TYR A OH 1 ATOM 1798 N N . GLN A 1 231 ? -27.987 -15.508 49.466 1.00 30.52 ? 531 GLN A N 1 ATOM 1799 C CA . GLN A 1 231 ? -27.728 -16.038 50.791 1.00 27.47 ? 531 GLN A CA 1 ATOM 1800 C C . GLN A 1 231 ? -26.413 -16.785 50.766 1.00 26.60 ? 531 GLN A C 1 ATOM 1801 O O . GLN A 1 231 ? -26.227 -17.694 49.955 1.00 26.98 ? 531 GLN A O 1 ATOM 1802 C CB . GLN A 1 231 ? -28.858 -16.972 51.234 1.00 30.59 ? 531 GLN A CB 1 ATOM 1803 C CG . GLN A 1 231 ? -28.663 -17.571 52.616 1.00 37.29 ? 531 GLN A CG 1 ATOM 1804 C CD . GLN A 1 231 ? -29.932 -18.198 53.164 1.00 39.82 ? 531 GLN A CD 1 ATOM 1805 O OE1 . GLN A 1 231 ? -31.006 -17.597 53.124 1.00 43.77 ? 531 GLN A OE1 1 ATOM 1806 N NE2 . GLN A 1 231 ? -29.814 -19.413 53.678 1.00 35.87 ? 531 GLN A NE2 1 ATOM 1807 N N . VAL A 1 232 ? -25.499 -16.402 51.651 1.00 29.97 ? 532 VAL A N 1 ATOM 1808 C CA . VAL A 1 232 ? -24.265 -17.152 51.809 1.00 28.00 ? 532 VAL A CA 1 ATOM 1809 C C . VAL A 1 232 ? -24.279 -17.946 53.104 1.00 30.22 ? 532 VAL A C 1 ATOM 1810 O O . VAL A 1 232 ? -24.371 -17.373 54.184 1.00 31.08 ? 532 VAL A O 1 ATOM 1811 C CB . VAL A 1 232 ? -23.035 -16.233 51.814 1.00 32.01 ? 532 VAL A CB 1 ATOM 1812 C CG1 . VAL A 1 232 ? -21.766 -17.056 51.942 1.00 33.62 ? 532 VAL A CG1 1 ATOM 1813 C CG2 . VAL A 1 232 ? -22.994 -15.397 50.548 1.00 32.67 ? 532 VAL A CG2 1 ATOM 1814 N N . ASP A 1 233 ? -24.186 -19.268 52.997 1.00 32.28 ? 533 ASP A N 1 ATOM 1815 C CA . ASP A 1 233 ? -23.933 -20.105 54.170 1.00 30.80 ? 533 ASP A CA 1 ATOM 1816 C C . ASP A 1 233 ? -22.428 -20.181 54.446 1.00 30.42 ? 533 ASP A C 1 ATOM 1817 O O . ASP A 1 233 ? -21.631 -20.385 53.530 1.00 33.25 ? 533 ASP A O 1 ATOM 1818 C CB . ASP A 1 233 ? -24.481 -21.518 53.966 1.00 30.86 ? 533 ASP A CB 1 ATOM 1819 C CG . ASP A 1 233 ? -25.985 -21.544 53.759 1.00 39.48 ? 533 ASP A CG 1 ATOM 1820 O OD1 . ASP A 1 233 ? -26.602 -20.460 53.700 1.00 36.71 ? 533 ASP A OD1 1 ATOM 1821 O OD2 . ASP A 1 233 ? -26.547 -22.656 53.654 1.00 35.41 ? 533 ASP A OD2 1 ATOM 1822 N N . VAL A 1 234 ? -22.041 -20.006 55.705 1.00 29.09 ? 534 VAL A N 1 ATOM 1823 C CA . VAL A 1 234 ? -20.629 -20.058 56.082 1.00 31.92 ? 534 VAL A CA 1 ATOM 1824 C C . VAL A 1 234 ? -20.450 -20.906 57.345 1.00 30.90 ? 534 VAL A C 1 ATOM 1825 O O . VAL A 1 234 ? -21.164 -20.722 58.329 1.00 30.63 ? 534 VAL A O 1 ATOM 1826 C CB . VAL A 1 234 ? -20.025 -18.642 56.259 1.00 33.19 ? 534 VAL A CB 1 ATOM 1827 C CG1 . VAL A 1 234 ? -20.964 -17.743 57.023 1.00 31.89 ? 534 VAL A CG1 1 ATOM 1828 C CG2 . VAL A 1 234 ? -18.664 -18.710 56.943 1.00 34.59 ? 534 VAL A CG2 1 ATOM 1829 N N . LYS A 1 235 ? -19.525 -21.863 57.300 1.00 33.76 ? 535 LYS A N 1 ATOM 1830 C CA . LYS A 1 235 ? -19.346 -22.805 58.411 1.00 38.57 ? 535 LYS A CA 1 ATOM 1831 C C . LYS A 1 235 ? -17.883 -23.160 58.658 1.00 34.38 ? 535 LYS A C 1 ATOM 1832 O O . LYS A 1 235 ? -17.159 -23.507 57.723 1.00 35.85 ? 535 LYS A O 1 ATOM 1833 C CB . LYS A 1 235 ? -20.100 -24.108 58.134 1.00 34.91 ? 535 LYS A CB 1 ATOM 1834 C CG . LYS A 1 235 ? -20.777 -24.686 59.351 1.00 36.76 ? 535 LYS A CG 1 ATOM 1835 C CD . LYS A 1 235 ? -20.389 -26.126 59.567 1.00 39.04 ? 535 LYS A CD 1 ATOM 1836 C CE . LYS A 1 235 ? -20.384 -26.903 58.282 1.00 33.25 ? 535 LYS A CE 1 ATOM 1837 N NZ . LYS A 1 235 ? -19.516 -28.105 58.444 1.00 37.41 ? 535 LYS A NZ 1 ATOM 1838 N N . GLU A 1 236 ? -17.454 -23.093 59.913 1.00 36.87 ? 536 GLU A N 1 ATOM 1839 C CA . GLU A 1 236 ? -16.143 -23.625 60.277 1.00 42.75 ? 536 GLU A CA 1 ATOM 1840 C C . GLU A 1 236 ? -16.129 -25.102 59.915 1.00 39.01 ? 536 GLU A C 1 ATOM 1841 O O . GLU A 1 236 ? -17.084 -25.817 60.218 1.00 37.53 ? 536 GLU A O 1 ATOM 1842 C CB . GLU A 1 236 ? -15.892 -23.457 61.774 1.00 46.94 ? 536 GLU A CB 1 ATOM 1843 C CG . GLU A 1 236 ? -16.018 -22.025 62.264 1.00 52.88 ? 536 GLU A CG 1 ATOM 1844 C CD . GLU A 1 236 ? -16.099 -21.929 63.775 1.00 66.33 ? 536 GLU A CD 1 ATOM 1845 O OE1 . GLU A 1 236 ? -16.229 -22.982 64.432 1.00 71.58 ? 536 GLU A OE1 1 ATOM 1846 O OE2 . GLU A 1 236 ? -16.037 -20.801 64.306 1.00 64.07 ? 536 GLU A OE2 1 ATOM 1847 N N . VAL A 1 237 ? -15.074 -25.564 59.249 1.00 34.85 ? 537 VAL A N 1 ATOM 1848 C CA . VAL A 1 237 ? -15.005 -26.973 58.873 1.00 39.16 ? 537 VAL A CA 1 ATOM 1849 C C . VAL A 1 237 ? -15.211 -27.866 60.089 1.00 40.50 ? 537 VAL A C 1 ATOM 1850 O O . VAL A 1 237 ? -15.848 -28.916 60.003 1.00 44.04 ? 537 VAL A O 1 ATOM 1851 C CB . VAL A 1 237 ? -13.665 -27.338 58.224 1.00 42.11 ? 537 VAL A CB 1 ATOM 1852 C CG1 . VAL A 1 237 ? -13.543 -26.680 56.864 1.00 38.34 ? 537 VAL A CG1 1 ATOM 1853 C CG2 . VAL A 1 237 ? -12.504 -26.944 59.137 1.00 44.38 ? 537 VAL A CG2 1 ATOM 1854 N N . ALA A 1 238 ? -14.673 -27.430 61.223 1.00 39.03 ? 538 ALA A N 1 ATOM 1855 C CA . ALA A 1 238 ? -14.724 -28.206 62.455 1.00 43.72 ? 538 ALA A CA 1 ATOM 1856 C C . ALA A 1 238 ? -16.046 -28.043 63.194 1.00 44.35 ? 538 ALA A C 1 ATOM 1857 O O . ALA A 1 238 ? -16.225 -28.590 64.282 1.00 47.10 ? 538 ALA A O 1 ATOM 1858 C CB . ALA A 1 238 ? -13.554 -27.826 63.365 1.00 43.82 ? 538 ALA A CB 1 ATOM 1859 N N . SER A 1 239 ? -16.968 -27.285 62.609 1.00 45.27 ? 539 SER A N 1 ATOM 1860 C CA . SER A 1 239 ? -18.276 -27.068 63.220 1.00 44.09 ? 539 SER A CA 1 ATOM 1861 C C . SER A 1 239 ? -19.372 -27.734 62.401 1.00 43.61 ? 539 SER A C 1 ATOM 1862 O O . SER A 1 239 ? -19.140 -28.150 61.263 1.00 43.24 ? 539 SER A O 1 ATOM 1863 C CB . SER A 1 239 ? -18.561 -25.575 63.379 1.00 45.38 ? 539 SER A CB 1 ATOM 1864 O OG . SER A 1 239 ? -19.879 -25.351 63.848 1.00 43.72 ? 539 SER A OG 1 ATOM 1865 N N . GLU A 1 240 ? -20.559 -27.854 62.990 1.00 43.58 ? 540 GLU A N 1 ATOM 1866 C CA . GLU A 1 240 ? -21.692 -28.462 62.304 1.00 42.84 ? 540 GLU A CA 1 ATOM 1867 C C . GLU A 1 240 ? -22.780 -27.425 62.061 1.00 40.14 ? 540 GLU A C 1 ATOM 1868 O O . GLU A 1 240 ? -23.791 -27.708 61.425 1.00 36.23 ? 540 GLU A O 1 ATOM 1869 C CB . GLU A 1 240 ? -22.251 -29.640 63.111 1.00 35.60 ? 540 GLU A CB 1 ATOM 1870 C CG . GLU A 1 240 ? -23.152 -29.246 64.286 1.00 42.56 ? 540 GLU A CG 1 ATOM 1871 C CD . GLU A 1 240 ? -22.382 -28.717 65.493 1.00 61.17 ? 540 GLU A CD 1 ATOM 1872 O OE1 . GLU A 1 240 ? -21.133 -28.686 65.451 1.00 55.22 ? 540 GLU A OE1 1 ATOM 1873 O OE2 . GLU A 1 240 ? -23.031 -28.335 66.492 1.00 46.23 ? 540 GLU A OE2 1 ATOM 1874 N N . ILE A 1 241 ? -22.558 -26.218 62.567 1.00 35.80 ? 541 ILE A N 1 ATOM 1875 C CA . ILE A 1 241 ? -23.555 -25.161 62.483 1.00 39.31 ? 541 ILE A CA 1 ATOM 1876 C C . ILE A 1 241 ? -23.257 -24.165 61.380 1.00 38.73 ? 541 ILE A C 1 ATOM 1877 O O . ILE A 1 241 ? -22.242 -23.471 61.420 1.00 37.59 ? 541 ILE A O 1 ATOM 1878 C CB . ILE A 1 241 ? -23.615 -24.358 63.778 1.00 40.97 ? 541 ILE A CB 1 ATOM 1879 C CG1 . ILE A 1 241 ? -23.834 -25.289 64.971 1.00 43.85 ? 541 ILE A CG1 1 ATOM 1880 C CG2 . ILE A 1 241 ? -24.699 -23.297 63.679 1.00 36.86 ? 541 ILE A CG2 1 ATOM 1881 C CD1 . ILE A 1 241 ? -23.619 -24.613 66.305 1.00 38.03 ? 541 ILE A CD1 1 ATOM 1882 N N . TRP A 1 242 ? -24.151 -24.085 60.403 1.00 35.45 ? 542 TRP A N 1 ATOM 1883 C CA . TRP A 1 242 ? -24.054 -23.051 59.381 1.00 33.45 ? 542 TRP A CA 1 ATOM 1884 C C . TRP A 1 242 ? -24.610 -21.725 59.923 1.00 30.31 ? 542 TRP A C 1 ATOM 1885 O O . TRP A 1 242 ? -25.580 -21.701 60.684 1.00 33.83 ? 542 TRP A O 1 ATOM 1886 C CB . TRP A 1 242 ? -24.815 -23.454 58.106 1.00 32.09 ? 542 TRP A CB 1 ATOM 1887 C CG . TRP A 1 242 ? -24.289 -24.667 57.367 1.00 31.89 ? 542 TRP A CG 1 ATOM 1888 C CD1 . TRP A 1 242 ? -24.707 -25.959 57.515 1.00 31.40 ? 542 TRP A CD1 1 ATOM 1889 C CD2 . TRP A 1 242 ? -23.278 -24.690 56.343 1.00 27.52 ? 542 TRP A CD2 1 ATOM 1890 N NE1 . TRP A 1 242 ? -24.017 -26.785 56.658 1.00 28.82 ? 542 TRP A NE1 1 ATOM 1891 C CE2 . TRP A 1 242 ? -23.132 -26.032 55.931 1.00 31.00 ? 542 TRP A CE2 1 ATOM 1892 C CE3 . TRP A 1 242 ? -22.481 -23.711 55.743 1.00 27.74 ? 542 TRP A CE3 1 ATOM 1893 C CZ2 . TRP A 1 242 ? -22.224 -26.417 54.945 1.00 35.00 ? 542 TRP A CZ2 1 ATOM 1894 C CZ3 . TRP A 1 242 ? -21.580 -24.095 54.765 1.00 30.09 ? 542 TRP A CZ3 1 ATOM 1895 C CH2 . TRP A 1 242 ? -21.463 -25.435 54.370 1.00 32.54 ? 542 TRP A CH2 1 ATOM 1896 N N . LYS A 1 243 ? -23.974 -20.626 59.543 1.00 29.23 ? 543 LYS A N 1 ATOM 1897 C CA . LYS A 1 243 ? -24.487 -19.291 59.828 1.00 32.69 ? 543 LYS A CA 1 ATOM 1898 C C . LYS A 1 243 ? -24.878 -18.634 58.505 1.00 30.61 ? 543 LYS A C 1 ATOM 1899 O O . LYS A 1 243 ? -24.336 -18.975 57.447 1.00 28.39 ? 543 LYS A O 1 ATOM 1900 C CB . LYS A 1 243 ? -23.447 -18.448 60.584 1.00 34.66 ? 543 LYS A CB 1 ATOM 1901 C CG . LYS A 1 243 ? -23.168 -18.932 62.014 1.00 44.81 ? 543 LYS A CG 1 ATOM 1902 C CD . LYS A 1 243 ? -22.365 -17.922 62.831 1.00 72.36 ? 543 LYS A CD 1 ATOM 1903 C CE . LYS A 1 243 ? -22.009 -18.478 64.210 1.00 82.77 ? 543 LYS A CE 1 ATOM 1904 N NZ . LYS A 1 243 ? -21.380 -17.465 65.110 1.00 73.43 ? 543 LYS A NZ 1 ATOM 1905 N N . ILE A 1 244 ? -25.831 -17.710 58.561 1.00 37.02 ? 544 ILE A N 1 ATOM 1906 C CA . ILE A 1 244 ? -26.419 -17.152 57.349 1.00 31.81 ? 544 ILE A CA 1 ATOM 1907 C C . ILE A 1 244 ? -26.078 -15.689 57.171 1.00 34.78 ? 544 ILE A C 1 ATOM 1908 O O . ILE A 1 244 ? -26.157 -14.903 58.107 1.00 42.27 ? 544 ILE A O 1 ATOM 1909 C CB . ILE A 1 244 ? -27.954 -17.270 57.367 1.00 39.41 ? 544 ILE A CB 1 ATOM 1910 C CG1 . ILE A 1 244 ? -28.375 -18.720 57.586 1.00 34.16 ? 544 ILE A CG1 1 ATOM 1911 C CG2 . ILE A 1 244 ? -28.546 -16.734 56.072 1.00 45.69 ? 544 ILE A CG2 1 ATOM 1912 C CD1 . ILE A 1 244 ? -28.068 -19.614 56.412 1.00 38.31 ? 544 ILE A CD1 1 ATOM 1913 N N . VAL A 1 245 ? -25.721 -15.328 55.948 1.00 36.38 ? 545 VAL A N 1 ATOM 1914 C CA . VAL A 1 245 ? -25.479 -13.940 55.606 1.00 31.58 ? 545 VAL A CA 1 ATOM 1915 C C . VAL A 1 245 ? -26.257 -13.557 54.343 1.00 36.75 ? 545 VAL A C 1 ATOM 1916 O O . VAL A 1 245 ? -26.020 -14.098 53.263 1.00 31.03 ? 545 VAL A O 1 ATOM 1917 C CB . VAL A 1 245 ? -23.984 -13.671 55.382 1.00 31.91 ? 545 VAL A CB 1 ATOM 1918 C CG1 . VAL A 1 245 ? -23.739 -12.174 55.194 1.00 34.58 ? 545 VAL A CG1 1 ATOM 1919 C CG2 . VAL A 1 245 ? -23.168 -14.194 56.552 1.00 40.66 ? 545 VAL A CG2 1 ATOM 1920 N N . ARG A 1 246 ? -27.192 -12.625 54.487 1.00 43.06 ? 546 ARG A N 1 ATOM 1921 C CA . ARG A 1 246 ? -27.968 -12.143 53.350 1.00 42.37 ? 546 ARG A CA 1 ATOM 1922 C C . ARG A 1 246 ? -27.266 -10.970 52.683 1.00 36.43 ? 546 ARG A C 1 ATOM 1923 O O . ARG A 1 246 ? -26.867 -10.020 53.348 1.00 45.87 ? 546 ARG A O 1 ATOM 1924 C CB . ARG A 1 246 ? -29.387 -11.761 53.784 1.00 45.14 ? 546 ARG A CB 1 ATOM 1925 C CG . ARG A 1 246 ? -30.210 -12.967 54.205 1.00 53.66 ? 546 ARG A CG 1 ATOM 1926 C CD . ARG A 1 246 ? -31.553 -12.601 54.813 1.00 61.70 ? 546 ARG A CD 1 ATOM 1927 N NE . ARG A 1 246 ? -32.295 -13.808 55.176 1.00 72.30 ? 546 ARG A NE 1 ATOM 1928 C CZ . ARG A 1 246 ? -32.077 -14.520 56.279 1.00 79.42 ? 546 ARG A CZ 1 ATOM 1929 N NH1 . ARG A 1 246 ? -31.138 -14.144 57.139 1.00 78.77 ? 546 ARG A NH1 1 ATOM 1930 N NH2 . ARG A 1 246 ? -32.795 -15.608 56.527 1.00 70.45 ? 546 ARG A NH2 1 ATOM 1931 N N . SER A 1 247 ? -27.102 -11.051 51.365 1.00 40.39 ? 547 SER A N 1 ATOM 1932 C CA . SER A 1 247 ? -26.465 -9.980 50.602 1.00 43.68 ? 547 SER A CA 1 ATOM 1933 C C . SER A 1 247 ? -27.280 -8.698 50.675 1.00 44.61 ? 547 SER A C 1 ATOM 1934 O O . SER A 1 247 ? -28.436 -8.708 51.101 1.00 46.19 ? 547 SER A O 1 ATOM 1935 C CB . SER A 1 247 ? -26.308 -10.378 49.133 1.00 42.73 ? 547 SER A CB 1 ATOM 1936 O OG . SER A 1 247 ? -27.544 -10.284 48.445 1.00 37.04 ? 547 SER A OG 1 ATOM 1937 N N . HIS A 1 248 ? -26.672 -7.593 50.253 1.00 50.87 ? 548 HIS A N 1 ATOM 1938 C CA . HIS A 1 248 ? -27.402 -6.343 50.105 1.00 54.33 ? 548 HIS A CA 1 ATOM 1939 C C . HIS A 1 248 ? -27.943 -6.262 48.685 1.00 54.60 ? 548 HIS A C 1 ATOM 1940 O O . HIS A 1 248 ? -27.226 -5.880 47.757 1.00 54.37 ? 548 HIS A O 1 ATOM 1941 C CB . HIS A 1 248 ? -26.509 -5.136 50.395 1.00 59.13 ? 548 HIS A CB 1 ATOM 1942 C CG . HIS A 1 248 ? -27.249 -3.834 50.398 1.00 64.85 ? 548 HIS A CG 1 ATOM 1943 N ND1 . HIS A 1 248 ? -27.685 -3.228 51.557 1.00 62.32 ? 548 HIS A ND1 1 ATOM 1944 C CD2 . HIS A 1 248 ? -27.649 -3.035 49.381 1.00 69.07 ? 548 HIS A CD2 1 ATOM 1945 C CE1 . HIS A 1 248 ? -28.311 -2.104 51.254 1.00 65.31 ? 548 HIS A CE1 1 ATOM 1946 N NE2 . HIS A 1 248 ? -28.303 -1.964 49.941 1.00 74.35 ? 548 HIS A NE2 1 ATOM 1947 N N . GLY A 1 249 ? -29.206 -6.639 48.522 1.00 51.61 ? 549 GLY A N 1 ATOM 1948 C CA . GLY A 1 249 ? -29.841 -6.614 47.219 1.00 52.42 ? 549 GLY A CA 1 ATOM 1949 C C . GLY A 1 249 ? -29.190 -7.590 46.262 1.00 46.98 ? 549 GLY A C 1 ATOM 1950 O O . GLY A 1 249 ? -28.740 -8.663 46.666 1.00 44.29 ? 549 GLY A O 1 ATOM 1951 N N . VAL A 1 250 ? -29.123 -7.200 44.992 1.00 38.25 ? 550 VAL A N 1 ATOM 1952 C CA . VAL A 1 250 ? -28.700 -8.100 43.932 1.00 45.37 ? 550 VAL A CA 1 ATOM 1953 C C . VAL A 1 250 ? -27.200 -8.031 43.639 1.00 46.82 ? 550 VAL A C 1 ATOM 1954 O O . VAL A 1 250 ? -26.745 -8.502 42.595 1.00 41.61 ? 550 VAL A O 1 ATOM 1955 C CB . VAL A 1 250 ? -29.508 -7.850 42.643 1.00 48.29 ? 550 VAL A CB 1 ATOM 1956 C CG1 . VAL A 1 250 ? -30.958 -8.221 42.862 1.00 45.58 ? 550 VAL A CG1 1 ATOM 1957 C CG2 . VAL A 1 250 ? -29.398 -6.396 42.223 1.00 52.87 ? 550 VAL A CG2 1 ATOM 1958 N N . GLN A 1 251 ? -26.438 -7.459 44.567 1.00 51.23 ? 551 GLN A N 1 ATOM 1959 C CA . GLN A 1 251 ? -24.983 -7.435 44.448 1.00 52.55 ? 551 GLN A CA 1 ATOM 1960 C C . GLN A 1 251 ? -24.404 -8.850 44.461 1.00 46.05 ? 551 GLN A C 1 ATOM 1961 O O . GLN A 1 251 ? -24.726 -9.651 45.342 1.00 40.21 ? 551 GLN A O 1 ATOM 1962 C CB . GLN A 1 251 ? -24.358 -6.621 45.585 1.00 59.20 ? 551 GLN A CB 1 ATOM 1963 C CG . GLN A 1 251 ? -24.658 -5.131 45.546 1.00 70.35 ? 551 GLN A CG 1 ATOM 1964 C CD . GLN A 1 251 ? -23.704 -4.320 46.413 1.00 82.02 ? 551 GLN A CD 1 ATOM 1965 O OE1 . GLN A 1 251 ? -22.483 -4.378 46.239 1.00 67.42 ? 551 GLN A OE1 1 ATOM 1966 N NE2 . GLN A 1 251 ? -24.258 -3.552 47.346 1.00 69.63 ? 551 GLN A NE2 1 ATOM 1967 N N . THR A 1 252 ? -23.543 -9.155 43.492 1.00 44.39 ? 552 THR A N 1 ATOM 1968 C CA . THR A 1 252 ? -22.871 -10.454 43.462 1.00 45.10 ? 552 THR A CA 1 ATOM 1969 C C . THR A 1 252 ? -21.591 -10.455 44.297 1.00 43.09 ? 552 THR A C 1 ATOM 1970 O O . THR A 1 252 ? -20.614 -11.129 43.964 1.00 41.50 ? 552 THR A O 1 ATOM 1971 C CB . THR A 1 252 ? -22.564 -10.931 42.021 1.00 44.55 ? 552 THR A CB 1 ATOM 1972 O OG1 . THR A 1 252 ? -21.780 -9.948 41.333 1.00 46.87 ? 552 THR A OG1 1 ATOM 1973 C CG2 . THR A 1 252 ? -23.857 -11.184 41.257 1.00 42.65 ? 552 THR A CG2 1 ATOM 1974 N N . MET A 1 253 ? -21.603 -9.693 45.383 1.00 44.70 ? 553 MET A N 1 ATOM 1975 C CA . MET A 1 253 ? -20.499 -9.718 46.331 1.00 47.26 ? 553 MET A CA 1 ATOM 1976 C C . MET A 1 253 ? -21.006 -9.505 47.743 1.00 45.69 ? 553 MET A C 1 ATOM 1977 O O . MET A 1 253 ? -21.813 -8.616 47.995 1.00 46.20 ? 553 MET A O 1 ATOM 1978 C CB . MET A 1 253 ? -19.419 -8.693 45.975 1.00 48.73 ? 553 MET A CB 1 ATOM 1979 C CG . MET A 1 253 ? -19.832 -7.241 46.079 1.00 58.90 ? 553 MET A CG 1 ATOM 1980 S SD . MET A 1 253 ? -18.465 -6.160 45.596 1.00 97.55 ? 553 MET A SD 1 ATOM 1981 C CE . MET A 1 253 ? -17.720 -7.128 44.276 1.00 56.99 ? 553 MET A CE 1 ATOM 1982 N N . VAL A 1 254 ? -20.535 -10.344 48.657 1.00 42.59 ? 554 VAL A N 1 ATOM 1983 C CA . VAL A 1 254 ? -20.980 -10.298 50.038 1.00 39.80 ? 554 VAL A CA 1 ATOM 1984 C C . VAL A 1 254 ? -19.782 -10.275 50.965 1.00 41.42 ? 554 VAL A C 1 ATOM 1985 O O . VAL A 1 254 ? -18.817 -11.010 50.759 1.00 43.31 ? 554 VAL A O 1 ATOM 1986 C CB . VAL A 1 254 ? -21.857 -11.512 50.377 1.00 39.85 ? 554 VAL A CB 1 ATOM 1987 C CG1 . VAL A 1 254 ? -22.293 -11.467 51.833 1.00 32.97 ? 554 VAL A CG1 1 ATOM 1988 C CG2 . VAL A 1 254 ? -23.072 -11.561 49.454 1.00 39.20 ? 554 VAL A CG2 1 ATOM 1989 N N . VAL A 1 255 ? -19.838 -9.420 51.979 1.00 34.40 ? 555 VAL A N 1 ATOM 1990 C CA . VAL A 1 255 ? -18.765 -9.356 52.964 1.00 37.16 ? 555 VAL A CA 1 ATOM 1991 C C . VAL A 1 255 ? -19.090 -10.171 54.199 1.00 35.09 ? 555 VAL A C 1 ATOM 1992 O O . VAL A 1 255 ? -20.110 -9.956 54.850 1.00 39.87 ? 555 VAL A O 1 ATOM 1993 C CB . VAL A 1 255 ? -18.492 -7.929 53.422 1.00 42.46 ? 555 VAL A CB 1 ATOM 1994 C CG1 . VAL A 1 255 ? -17.428 -7.936 54.520 1.00 40.04 ? 555 VAL A CG1 1 ATOM 1995 C CG2 . VAL A 1 255 ? -18.067 -7.073 52.245 1.00 43.55 ? 555 VAL A CG2 1 ATOM 1996 N N . LEU A 1 256 ? -18.210 -11.101 54.531 1.00 38.84 ? 556 LEU A N 1 ATOM 1997 C CA . LEU A 1 256 ? -18.385 -11.892 55.732 1.00 39.52 ? 556 LEU A CA 1 ATOM 1998 C C . LEU A 1 256 ? -17.632 -11.224 56.873 1.00 39.60 ? 556 LEU A C 1 ATOM 1999 O O . LEU A 1 256 ? -16.441 -10.951 56.766 1.00 39.99 ? 556 LEU A O 1 ATOM 2000 C CB . LEU A 1 256 ? -17.891 -13.323 55.511 1.00 37.99 ? 556 LEU A CB 1 ATOM 2001 C CG . LEU A 1 256 ? -18.470 -14.064 54.302 1.00 35.90 ? 556 LEU A CG 1 ATOM 2002 C CD1 . LEU A 1 256 ? -17.878 -15.463 54.183 1.00 36.29 ? 556 LEU A CD1 1 ATOM 2003 C CD2 . LEU A 1 256 ? -19.987 -14.132 54.392 1.00 40.06 ? 556 LEU A CD2 1 ATOM 2004 N N . ASN A 1 257 ? -18.340 -10.952 57.960 1.00 37.66 ? 557 ASN A N 1 ATOM 2005 C CA . ASN A 1 257 ? -17.745 -10.306 59.117 1.00 39.38 ? 557 ASN A CA 1 ATOM 2006 C C . ASN A 1 257 ? -17.623 -11.276 60.292 1.00 42.03 ? 557 ASN A C 1 ATOM 2007 O O . ASN A 1 257 ? -18.190 -12.365 60.267 1.00 41.06 ? 557 ASN A O 1 ATOM 2008 C CB . ASN A 1 257 ? -18.577 -9.077 59.512 1.00 38.62 ? 557 ASN A CB 1 ATOM 2009 C CG . ASN A 1 257 ? -18.392 -7.918 58.550 1.00 44.05 ? 557 ASN A CG 1 ATOM 2010 O OD1 . ASN A 1 257 ? -17.436 -7.150 58.666 1.00 51.06 ? 557 ASN A OD1 1 ATOM 2011 N ND2 . ASN A 1 257 ? -19.307 -7.787 57.590 1.00 40.16 ? 557 ASN A ND2 1 ATOM 2012 N N . ASN A 1 258 ? -16.862 -10.888 61.308 1.00 38.27 ? 558 ASN A N 1 ATOM 2013 C CA . ASN A 1 258 ? -16.836 -11.620 62.573 1.00 38.40 ? 558 ASN A CA 1 ATOM 2014 C C . ASN A 1 258 ? -16.304 -13.045 62.503 1.00 38.18 ? 558 ASN A C 1 ATOM 2015 O O . ASN A 1 258 ? -16.645 -13.879 63.343 1.00 40.35 ? 558 ASN A O 1 ATOM 2016 C CB . ASN A 1 258 ? -18.226 -11.624 63.215 1.00 44.48 ? 558 ASN A CB 1 ATOM 2017 C CG . ASN A 1 258 ? -18.817 -10.232 63.329 1.00 49.70 ? 558 ASN A CG 1 ATOM 2018 O OD1 . ASN A 1 258 ? -20.008 -10.031 63.091 1.00 56.16 ? 558 ASN A OD1 1 ATOM 2019 N ND2 . ASN A 1 258 ? -17.983 -9.260 63.681 1.00 49.56 ? 558 ASN A ND2 1 ATOM 2020 N N . LEU A 1 259 ? -15.453 -13.328 61.525 1.00 40.23 ? 559 LEU A N 1 ATOM 2021 C CA . LEU A 1 259 ? -14.841 -14.650 61.444 1.00 39.49 ? 559 LEU A CA 1 ATOM 2022 C C . LEU A 1 259 ? -13.681 -14.760 62.440 1.00 41.88 ? 559 LEU A C 1 ATOM 2023 O O . LEU A 1 259 ? -13.123 -13.749 62.872 1.00 40.99 ? 559 LEU A O 1 ATOM 2024 C CB . LEU A 1 259 ? -14.356 -14.921 60.024 1.00 38.59 ? 559 LEU A CB 1 ATOM 2025 C CG . LEU A 1 259 ? -15.334 -14.505 58.922 1.00 40.07 ? 559 LEU A CG 1 ATOM 2026 C CD1 . LEU A 1 259 ? -14.686 -14.630 57.558 1.00 33.52 ? 559 LEU A CD1 1 ATOM 2027 C CD2 . LEU A 1 259 ? -16.619 -15.334 58.990 1.00 37.91 ? 559 LEU A CD2 1 ATOM 2028 N N . GLU A 1 260 ? -13.333 -15.987 62.818 1.00 43.93 ? 560 GLU A N 1 ATOM 2029 C CA . GLU A 1 260 ? -12.211 -16.225 63.725 1.00 42.93 ? 560 GLU A CA 1 ATOM 2030 C C . GLU A 1 260 ? -10.900 -16.349 62.953 1.00 40.10 ? 560 GLU A C 1 ATOM 2031 O O . GLU A 1 260 ? -10.859 -16.986 61.896 1.00 39.31 ? 560 GLU A O 1 ATOM 2032 C CB . GLU A 1 260 ? -12.454 -17.491 64.547 1.00 47.25 ? 560 GLU A CB 1 ATOM 2033 C CG . GLU A 1 260 ? -13.424 -17.298 65.695 1.00 56.11 ? 560 GLU A CG 1 ATOM 2034 C CD . GLU A 1 260 ? -12.856 -16.410 66.786 1.00 69.79 ? 560 GLU A CD 1 ATOM 2035 O OE1 . GLU A 1 260 ? -13.625 -15.623 67.379 1.00 71.22 ? 560 GLU A OE1 1 ATOM 2036 O OE2 . GLU A 1 260 ? -11.637 -16.497 67.047 1.00 71.66 ? 560 GLU A OE2 1 ATOM 2037 N N . PRO A 1 261 ? -9.822 -15.741 63.477 1.00 41.84 ? 561 PRO A N 1 ATOM 2038 C CA . PRO A 1 261 ? -8.510 -15.757 62.816 1.00 37.40 ? 561 PRO A CA 1 ATOM 2039 C C . PRO A 1 261 ? -7.960 -17.179 62.636 1.00 39.20 ? 561 PRO A C 1 ATOM 2040 O O . PRO A 1 261 ? -8.267 -18.069 63.432 1.00 38.47 ? 561 PRO A O 1 ATOM 2041 C CB . PRO A 1 261 ? -7.619 -14.971 63.786 1.00 43.78 ? 561 PRO A CB 1 ATOM 2042 C CG . PRO A 1 261 ? -8.558 -14.166 64.619 1.00 41.40 ? 561 PRO A CG 1 ATOM 2043 C CD . PRO A 1 261 ? -9.789 -15.007 64.752 1.00 45.50 ? 561 PRO A CD 1 ATOM 2044 N N . ASN A 1 262 ? -7.161 -17.386 61.593 1.00 39.47 ? 562 ASN A N 1 ATOM 2045 C CA . ASN A 1 262 ? -6.509 -18.675 61.364 1.00 39.25 ? 562 ASN A CA 1 ATOM 2046 C C . ASN A 1 262 ? -7.491 -19.845 61.370 1.00 42.45 ? 562 ASN A C 1 ATOM 2047 O O . ASN A 1 262 ? -7.195 -20.919 61.896 1.00 43.42 ? 562 ASN A O 1 ATOM 2048 C CB . ASN A 1 262 ? -5.408 -18.914 62.404 1.00 40.92 ? 562 ASN A CB 1 ATOM 2049 C CG . ASN A 1 262 ? -4.409 -19.964 61.957 1.00 38.83 ? 562 ASN A CG 1 ATOM 2050 O OD1 . ASN A 1 262 ? -4.018 -19.998 60.790 1.00 48.86 ? 562 ASN A OD1 1 ATOM 2051 N ND2 . ASN A 1 262 ? -3.994 -20.830 62.882 1.00 40.46 ? 562 ASN A ND2 1 ATOM 2052 N N . THR A 1 263 ? -8.658 -19.632 60.774 1.00 41.69 ? 563 THR A N 1 ATOM 2053 C CA . THR A 1 263 ? -9.728 -20.618 60.801 1.00 36.44 ? 563 THR A CA 1 ATOM 2054 C C . THR A 1 263 ? -10.148 -21.000 59.384 1.00 32.56 ? 563 THR A C 1 ATOM 2055 O O . THR A 1 263 ? -10.328 -20.141 58.521 1.00 34.15 ? 563 THR A O 1 ATOM 2056 C CB . THR A 1 263 ? -10.949 -20.080 61.578 1.00 38.22 ? 563 THR A CB 1 ATOM 2057 O OG1 . THR A 1 263 ? -10.548 -19.682 62.896 1.00 38.17 ? 563 THR A OG1 1 ATOM 2058 C CG2 . THR A 1 263 ? -12.042 -21.131 61.675 1.00 34.91 ? 563 THR A CG2 1 ATOM 2059 N N . THR A 1 264 ? -10.285 -22.294 59.144 1.00 36.42 ? 564 THR A N 1 ATOM 2060 C CA . THR A 1 264 ? -10.713 -22.777 57.844 1.00 37.06 ? 564 THR A CA 1 ATOM 2061 C C . THR A 1 264 ? -12.238 -22.765 57.785 1.00 39.09 ? 564 THR A C 1 ATOM 2062 O O . THR A 1 264 ? -12.908 -23.298 58.673 1.00 40.93 ? 564 THR A O 1 ATOM 2063 C CB . THR A 1 264 ? -10.184 -24.191 57.584 1.00 38.89 ? 564 THR A CB 1 ATOM 2064 O OG1 . THR A 1 264 ? -8.760 -24.199 57.738 1.00 37.39 ? 564 THR A OG1 1 ATOM 2065 C CG2 . THR A 1 264 ? -10.535 -24.642 56.175 1.00 35.39 ? 564 THR A CG2 1 ATOM 2066 N N . TYR A 1 265 ? -12.774 -22.141 56.740 1.00 34.34 ? 565 TYR A N 1 ATOM 2067 C CA . TYR A 1 265 ? -14.214 -21.988 56.570 1.00 30.80 ? 565 TYR A CA 1 ATOM 2068 C C . TYR A 1 265 ? -14.669 -22.611 55.266 1.00 34.10 ? 565 TYR A C 1 ATOM 2069 O O . TYR A 1 265 ? -13.931 -22.627 54.282 1.00 36.82 ? 565 TYR A O 1 ATOM 2070 C CB . TYR A 1 265 ? -14.590 -20.504 56.557 1.00 34.20 ? 565 TYR A CB 1 ATOM 2071 C CG . TYR A 1 265 ? -14.594 -19.841 57.919 1.00 37.49 ? 565 TYR A CG 1 ATOM 2072 C CD1 . TYR A 1 265 ? -15.709 -19.919 58.750 1.00 33.18 ? 565 TYR A CD1 1 ATOM 2073 C CD2 . TYR A 1 265 ? -13.490 -19.130 58.371 1.00 34.36 ? 565 TYR A CD2 1 ATOM 2074 C CE1 . TYR A 1 265 ? -15.722 -19.316 59.993 1.00 36.41 ? 565 TYR A CE1 1 ATOM 2075 C CE2 . TYR A 1 265 ? -13.494 -18.518 59.619 1.00 32.51 ? 565 TYR A CE2 1 ATOM 2076 C CZ . TYR A 1 265 ? -14.613 -18.616 60.424 1.00 38.00 ? 565 TYR A CZ 1 ATOM 2077 O OH . TYR A 1 265 ? -14.623 -18.015 61.661 1.00 37.13 ? 565 TYR A OH 1 ATOM 2078 N N . GLU A 1 266 ? -15.891 -23.127 55.265 1.00 35.04 ? 566 GLU A N 1 ATOM 2079 C CA . GLU A 1 266 ? -16.552 -23.516 54.029 1.00 37.39 ? 566 GLU A CA 1 ATOM 2080 C C . GLU A 1 266 ? -17.754 -22.608 53.792 1.00 37.23 ? 566 GLU A C 1 ATOM 2081 O O . GLU A 1 266 ? -18.375 -22.113 54.735 1.00 36.31 ? 566 GLU A O 1 ATOM 2082 C CB . GLU A 1 266 ? -16.959 -24.997 54.046 1.00 32.76 ? 566 GLU A CB 1 ATOM 2083 C CG . GLU A 1 266 ? -17.359 -25.547 55.407 1.00 40.02 ? 566 GLU A CG 1 ATOM 2084 C CD . GLU A 1 266 ? -17.544 -27.060 55.387 1.00 44.20 ? 566 GLU A CD 1 ATOM 2085 O OE1 . GLU A 1 266 ? -17.647 -27.680 56.473 1.00 44.20 ? 566 GLU A OE1 1 ATOM 2086 O OE2 . GLU A 1 266 ? -17.579 -27.631 54.279 1.00 43.59 ? 566 GLU A OE2 1 ATOM 2087 N N . ILE A 1 267 ? -18.066 -22.366 52.527 1.00 31.68 ? 567 ILE A N 1 ATOM 2088 C CA . ILE A 1 267 ? -19.181 -21.501 52.187 1.00 31.70 ? 567 ILE A CA 1 ATOM 2089 C C . ILE A 1 267 ? -19.898 -21.993 50.940 1.00 35.48 ? 567 ILE A C 1 ATOM 2090 O O . ILE A 1 267 ? -19.345 -22.740 50.143 1.00 31.52 ? 567 ILE A O 1 ATOM 2091 C CB . ILE A 1 267 ? -18.736 -20.041 51.962 1.00 33.58 ? 567 ILE A CB 1 ATOM 2092 C CG1 . ILE A 1 267 ? -17.768 -19.951 50.788 1.00 38.28 ? 567 ILE A CG1 1 ATOM 2093 C CG2 . ILE A 1 267 ? -18.100 -19.465 53.217 1.00 41.06 ? 567 ILE A CG2 1 ATOM 2094 C CD1 . ILE A 1 267 ? -17.435 -18.535 50.414 1.00 44.23 ? 567 ILE A CD1 1 ATOM 2095 N N . ARG A 1 268 ? -21.145 -21.576 50.790 1.00 34.53 ? 568 ARG A N 1 ATOM 2096 C CA . ARG A 1 268 ? -21.899 -21.838 49.575 1.00 34.08 ? 568 ARG A CA 1 ATOM 2097 C C . ARG A 1 268 ? -22.948 -20.745 49.438 1.00 29.22 ? 568 ARG A C 1 ATOM 2098 O O . ARG A 1 268 ? -23.381 -20.170 50.435 1.00 27.83 ? 568 ARG A O 1 ATOM 2099 C CB . ARG A 1 268 ? -22.537 -23.224 49.616 1.00 29.61 ? 568 ARG A CB 1 ATOM 2100 C CG . ARG A 1 268 ? -23.258 -23.519 50.920 1.00 36.05 ? 568 ARG A CG 1 ATOM 2101 C CD . ARG A 1 268 ? -23.886 -24.899 50.913 1.00 46.16 ? 568 ARG A CD 1 ATOM 2102 N NE . ARG A 1 268 ? -24.673 -25.136 52.120 1.00 64.73 ? 568 ARG A NE 1 ATOM 2103 C CZ . ARG A 1 268 ? -25.549 -26.125 52.258 1.00 60.51 ? 568 ARG A CZ 1 ATOM 2104 N NH1 . ARG A 1 268 ? -25.755 -26.968 51.256 1.00 55.84 ? 568 ARG A NH1 1 ATOM 2105 N NH2 . ARG A 1 268 ? -26.221 -26.268 53.392 1.00 57.57 ? 568 ARG A NH2 1 ATOM 2106 N N . VAL A 1 269 ? -23.336 -20.449 48.203 1.00 27.67 ? 569 VAL A N 1 ATOM 2107 C CA . VAL A 1 269 ? -24.179 -19.295 47.920 1.00 25.86 ? 569 VAL A CA 1 ATOM 2108 C C . VAL A 1 269 ? -25.414 -19.716 47.146 1.00 26.70 ? 569 VAL A C 1 ATOM 2109 O O . VAL A 1 269 ? -25.353 -20.598 46.290 1.00 26.67 ? 569 VAL A O 1 ATOM 2110 C CB . VAL A 1 269 ? -23.423 -18.229 47.090 1.00 25.72 ? 569 VAL A CB 1 ATOM 2111 C CG1 . VAL A 1 269 ? -24.255 -16.958 46.975 1.00 28.90 ? 569 VAL A CG1 1 ATOM 2112 C CG2 . VAL A 1 269 ? -22.086 -17.921 47.722 1.00 31.70 ? 569 VAL A CG2 1 ATOM 2113 N N . ALA A 1 270 ? -26.531 -19.069 47.443 1.00 26.33 ? 570 ALA A N 1 ATOM 2114 C CA . ALA A 1 270 ? -27.802 -19.433 46.849 1.00 23.29 ? 570 ALA A CA 1 ATOM 2115 C C . ALA A 1 270 ? -28.573 -18.158 46.582 1.00 28.17 ? 570 ALA A C 1 ATOM 2116 O O . ALA A 1 270 ? -28.580 -17.267 47.425 1.00 27.91 ? 570 ALA A O 1 ATOM 2117 C CB . ALA A 1 270 ? -28.573 -20.317 47.804 1.00 24.86 ? 570 ALA A CB 1 ATOM 2118 N N . ALA A 1 271 ? -29.207 -18.062 45.414 1.00 24.27 ? 571 ALA A N 1 ATOM 2119 C CA . ALA A 1 271 ? -30.063 -16.916 45.121 1.00 28.65 ? 571 ALA A CA 1 ATOM 2120 C C . ALA A 1 271 ? -31.474 -17.166 45.629 1.00 28.19 ? 571 ALA A C 1 ATOM 2121 O O . ALA A 1 271 ? -31.962 -18.300 45.604 1.00 27.36 ? 571 ALA A O 1 ATOM 2122 C CB . ALA A 1 271 ? -30.088 -16.618 43.632 1.00 27.31 ? 571 ALA A CB 1 ATOM 2123 N N . VAL A 1 272 ? -32.126 -16.100 46.081 1.00 27.78 ? 572 VAL A N 1 ATOM 2124 C CA . VAL A 1 272 ? -33.512 -16.174 46.532 1.00 24.74 ? 572 VAL A CA 1 ATOM 2125 C C . VAL A 1 272 ? -34.402 -15.314 45.638 1.00 29.19 ? 572 VAL A C 1 ATOM 2126 O O . VAL A 1 272 ? -34.141 -14.126 45.454 1.00 30.19 ? 572 VAL A O 1 ATOM 2127 C CB . VAL A 1 272 ? -33.654 -15.678 47.986 1.00 30.82 ? 572 VAL A CB 1 ATOM 2128 C CG1 . VAL A 1 272 ? -35.021 -16.019 48.540 1.00 27.30 ? 572 VAL A CG1 1 ATOM 2129 C CG2 . VAL A 1 272 ? -32.583 -16.292 48.857 1.00 31.46 ? 572 VAL A CG2 1 ATOM 2130 N N . ASN A 1 273 ? -35.446 -15.913 45.075 1.00 28.53 ? 573 ASN A N 1 ATOM 2131 C CA . ASN A 1 273 ? -36.461 -15.140 44.371 1.00 32.40 ? 573 ASN A CA 1 ATOM 2132 C C . ASN A 1 273 ? -37.804 -15.232 45.089 1.00 33.26 ? 573 ASN A C 1 ATOM 2133 O O . ASN A 1 273 ? -37.889 -15.802 46.173 1.00 30.29 ? 573 ASN A O 1 ATOM 2134 C CB . ASN A 1 273 ? -36.570 -15.556 42.899 1.00 29.24 ? 573 ASN A CB 1 ATOM 2135 C CG . ASN A 1 273 ? -37.259 -16.900 42.706 1.00 29.85 ? 573 ASN A CG 1 ATOM 2136 O OD1 . ASN A 1 273 ? -37.976 -17.388 43.578 1.00 25.38 ? 573 ASN A OD1 1 ATOM 2137 N ND2 . ASN A 1 273 ? -37.052 -17.495 41.541 1.00 30.61 ? 573 ASN A ND2 1 ATOM 2138 N N . GLY A 1 274 ? -38.849 -14.674 44.487 1.00 31.18 ? 574 GLY A N 1 ATOM 2139 C CA . GLY A 1 274 ? -40.146 -14.601 45.136 1.00 27.87 ? 574 GLY A CA 1 ATOM 2140 C C . GLY A 1 274 ? -40.739 -15.953 45.463 1.00 31.24 ? 574 GLY A C 1 ATOM 2141 O O . GLY A 1 274 ? -41.499 -16.088 46.417 1.00 35.71 ? 574 GLY A O 1 ATOM 2142 N N . LYS A 1 275 ? -40.407 -16.959 44.661 1.00 30.52 ? 575 LYS A N 1 ATOM 2143 C CA . LYS A 1 275 ? -40.890 -18.304 44.929 1.00 28.24 ? 575 LYS A CA 1 ATOM 2144 C C . LYS A 1 275 ? -40.129 -18.929 46.095 1.00 30.21 ? 575 LYS A C 1 ATOM 2145 O O . LYS A 1 275 ? -40.718 -19.623 46.912 1.00 34.94 ? 575 LYS A O 1 ATOM 2146 C CB . LYS A 1 275 ? -40.799 -19.203 43.690 1.00 25.51 ? 575 LYS A CB 1 ATOM 2147 C CG . LYS A 1 275 ? -41.508 -20.549 43.904 1.00 30.17 ? 575 LYS A CG 1 ATOM 2148 C CD . LYS A 1 275 ? -41.420 -21.493 42.707 1.00 33.59 ? 575 LYS A CD 1 ATOM 2149 C CE . LYS A 1 275 ? -42.366 -22.685 42.900 1.00 28.82 ? 575 LYS A CE 1 ATOM 2150 N NZ . LYS A 1 275 ? -42.280 -23.707 41.806 1.00 36.05 ? 575 LYS A NZ 1 ATOM 2151 N N . GLY A 1 276 ? -38.823 -18.679 46.169 1.00 31.47 ? 576 GLY A N 1 ATOM 2152 C CA . GLY A 1 276 ? -38.020 -19.165 47.282 1.00 31.96 ? 576 GLY A CA 1 ATOM 2153 C C . GLY A 1 276 ? -36.516 -19.179 47.061 1.00 28.98 ? 576 GLY A C 1 ATOM 2154 O O . GLY A 1 276 ? -35.979 -18.429 46.239 1.00 23.73 ? 576 GLY A O 1 ATOM 2155 N N . GLN A 1 277 ? -35.833 -20.046 47.803 1.00 33.64 ? 577 GLN A N 1 ATOM 2156 C CA . GLN A 1 277 ? -34.376 -20.159 47.740 1.00 29.07 ? 577 GLN A CA 1 ATOM 2157 C C . GLN A 1 277 ? -33.928 -21.099 46.632 1.00 24.89 ? 577 GLN A C 1 ATOM 2158 O O . GLN A 1 277 ? -34.431 -22.213 46.515 1.00 21.72 ? 577 GLN A O 1 ATOM 2159 C CB . GLN A 1 277 ? -33.831 -20.671 49.068 1.00 22.51 ? 577 GLN A CB 1 ATOM 2160 C CG . GLN A 1 277 ? -32.319 -20.701 49.147 1.00 23.01 ? 577 GLN A CG 1 ATOM 2161 C CD . GLN A 1 277 ? -31.839 -21.145 50.521 1.00 34.75 ? 577 GLN A CD 1 ATOM 2162 O OE1 . GLN A 1 277 ? -31.102 -22.117 50.651 1.00 38.30 ? 577 GLN A OE1 1 ATOM 2163 N NE2 . GLN A 1 277 ? -32.281 -20.446 51.552 1.00 28.42 ? 577 GLN A NE2 1 ATOM 2164 N N . GLY A 1 278 ? -32.960 -20.654 45.834 1.00 25.58 ? 578 GLY A N 1 ATOM 2165 C CA . GLY A 1 278 ? -32.455 -21.451 44.732 1.00 27.34 ? 578 GLY A CA 1 ATOM 2166 C C . GLY A 1 278 ? -31.451 -22.523 45.116 1.00 26.44 ? 578 GLY A C 1 ATOM 2167 O O . GLY A 1 278 ? -31.238 -22.811 46.290 1.00 27.92 ? 578 GLY A O 1 ATOM 2168 N N . ASP A 1 279 ? -30.839 -23.124 44.103 1.00 29.88 ? 579 ASP A N 1 ATOM 2169 C CA . ASP A 1 279 ? -29.846 -24.165 44.301 1.00 30.60 ? 579 ASP A CA 1 ATOM 2170 C C . ASP A 1 279 ? -28.541 -23.558 44.804 1.00 28.59 ? 579 ASP A C 1 ATOM 2171 O O . ASP A 1 279 ? -28.194 -22.435 44.444 1.00 25.13 ? 579 ASP A O 1 ATOM 2172 C CB . ASP A 1 279 ? -29.594 -24.915 42.989 1.00 27.37 ? 579 ASP A CB 1 ATOM 2173 C CG . ASP A 1 279 ? -30.874 -25.446 42.361 1.00 40.42 ? 579 ASP A CG 1 ATOM 2174 O OD1 . ASP A 1 279 ? -31.726 -25.989 43.097 1.00 41.43 ? 579 ASP A OD1 1 ATOM 2175 O OD2 . ASP A 1 279 ? -31.026 -25.327 41.126 1.00 40.06 ? 579 ASP A OD2 1 ATOM 2176 N N . TYR A 1 280 ? -27.829 -24.315 45.634 1.00 28.25 ? 580 TYR A N 1 ATOM 2177 C CA . TYR A 1 280 ? -26.560 -23.878 46.190 1.00 30.13 ? 580 TYR A CA 1 ATOM 2178 C C . TYR A 1 280 ? -25.447 -24.054 45.170 1.00 28.50 ? 580 TYR A C 1 ATOM 2179 O O . TYR A 1 280 ? -25.488 -24.960 44.343 1.00 30.71 ? 580 TYR A O 1 ATOM 2180 C CB . TYR A 1 280 ? -26.228 -24.673 47.465 1.00 31.83 ? 580 TYR A CB 1 ATOM 2181 C CG . TYR A 1 280 ? -26.917 -24.175 48.732 1.00 35.19 ? 580 TYR A CG 1 ATOM 2182 C CD1 . TYR A 1 280 ? -26.616 -22.927 49.274 1.00 35.62 ? 580 TYR A CD1 1 ATOM 2183 C CD2 . TYR A 1 280 ? -27.844 -24.964 49.397 1.00 40.73 ? 580 TYR A CD2 1 ATOM 2184 C CE1 . TYR A 1 280 ? -27.239 -22.471 50.429 1.00 42.49 ? 580 TYR A CE1 1 ATOM 2185 C CE2 . TYR A 1 280 ? -28.471 -24.517 50.558 1.00 44.84 ? 580 TYR A CE2 1 ATOM 2186 C CZ . TYR A 1 280 ? -28.166 -23.271 51.070 1.00 55.26 ? 580 TYR A CZ 1 ATOM 2187 O OH . TYR A 1 280 ? -28.789 -22.829 52.223 1.00 53.58 ? 580 TYR A OH 1 ATOM 2188 N N . SER A 1 281 ? -24.454 -23.177 45.232 1.00 33.46 ? 581 SER A N 1 ATOM 2189 C CA . SER A 1 281 ? -23.219 -23.352 44.475 1.00 32.51 ? 581 SER A CA 1 ATOM 2190 C C . SER A 1 281 ? -22.406 -24.485 45.088 1.00 31.23 ? 581 SER A C 1 ATOM 2191 O O . SER A 1 281 ? -22.725 -24.972 46.180 1.00 29.79 ? 581 SER A O 1 ATOM 2192 C CB . SER A 1 281 ? -22.386 -22.076 44.547 1.00 31.07 ? 581 SER A CB 1 ATOM 2193 O OG . SER A 1 281 ? -22.042 -21.792 45.893 1.00 23.27 ? 581 SER A OG 1 ATOM 2194 N N . LYS A 1 282 ? -21.352 -24.898 44.391 1.00 39.56 ? 582 LYS A N 1 ATOM 2195 C CA . LYS A 1 282 ? -20.358 -25.794 44.973 1.00 45.81 ? 582 LYS A CA 1 ATOM 2196 C C . LYS A 1 282 ? -19.765 -25.179 46.237 1.00 35.43 ? 582 LYS A C 1 ATOM 2197 O O . LYS A 1 282 ? -19.613 -23.965 46.329 1.00 35.30 ? 582 LYS A O 1 ATOM 2198 C CB . LYS A 1 282 ? -19.234 -26.069 43.974 1.00 51.35 ? 582 LYS A CB 1 ATOM 2199 C CG . LYS A 1 282 ? -19.256 -27.466 43.385 1.00 67.67 ? 582 LYS A CG 1 ATOM 2200 C CD . LYS A 1 282 ? -20.504 -27.699 42.559 1.00 87.75 ? 582 LYS A CD 1 ATOM 2201 C CE . LYS A 1 282 ? -20.449 -26.916 41.263 1.00 98.07 ? 582 LYS A CE 1 ATOM 2202 N NZ . LYS A 1 282 ? -19.238 -27.270 40.477 1.00 86.65 ? 582 LYS A NZ 1 ATOM 2203 N N . ILE A 1 283 ? -19.431 -26.013 47.211 1.00 40.76 ? 583 ILE A N 1 ATOM 2204 C CA . ILE A 1 283 ? -18.766 -25.514 48.407 1.00 41.55 ? 583 ILE A CA 1 ATOM 2205 C C . ILE A 1 283 ? -17.405 -24.935 48.052 1.00 41.98 ? 583 ILE A C 1 ATOM 2206 O O . ILE A 1 283 ? -16.750 -25.393 47.124 1.00 46.19 ? 583 ILE A O 1 ATOM 2207 C CB . ILE A 1 283 ? -18.635 -26.601 49.488 1.00 41.09 ? 583 ILE A CB 1 ATOM 2208 C CG1 . ILE A 1 283 ? -20.012 -26.892 50.088 1.00 42.67 ? 583 ILE A CG1 1 ATOM 2209 C CG2 . ILE A 1 283 ? -17.671 -26.164 50.592 1.00 33.09 ? 583 ILE A CG2 1 ATOM 2210 C CD1 . ILE A 1 283 ? -20.013 -27.987 51.114 1.00 52.22 ? 583 ILE A CD1 1 ATOM 2211 N N . GLU A 1 284 ? -17.002 -23.907 48.787 1.00 43.61 ? 584 GLU A N 1 ATOM 2212 C CA . GLU A 1 284 ? -15.730 -23.234 48.564 1.00 43.10 ? 584 GLU A CA 1 ATOM 2213 C C . GLU A 1 284 ? -15.038 -23.083 49.909 1.00 37.44 ? 584 GLU A C 1 ATOM 2214 O O . GLU A 1 284 ? -15.674 -22.758 50.910 1.00 38.50 ? 584 GLU A O 1 ATOM 2215 C CB . GLU A 1 284 ? -15.964 -21.860 47.933 1.00 46.37 ? 584 GLU A CB 1 ATOM 2216 C CG . GLU A 1 284 ? -14.699 -21.092 47.575 1.00 54.78 ? 584 GLU A CG 1 ATOM 2217 C CD . GLU A 1 284 ? -14.167 -21.451 46.196 1.00 98.59 ? 584 GLU A CD 1 ATOM 2218 O OE1 . GLU A 1 284 ? -14.606 -22.479 45.631 1.00 71.08 ? 584 GLU A OE1 1 ATOM 2219 O OE2 . GLU A 1 284 ? -13.309 -20.700 45.678 1.00 70.06 ? 584 GLU A OE2 1 ATOM 2220 N N . ILE A 1 285 ? -13.739 -23.335 49.942 1.00 41.33 ? 585 ILE A N 1 ATOM 2221 C CA . ILE A 1 285 ? -13.003 -23.310 51.199 1.00 35.74 ? 585 ILE A CA 1 ATOM 2222 C C . ILE A 1 285 ? -11.970 -22.193 51.230 1.00 36.77 ? 585 ILE A C 1 ATOM 2223 O O . ILE A 1 285 ? -11.335 -21.891 50.220 1.00 39.92 ? 585 ILE A O 1 ATOM 2224 C CB . ILE A 1 285 ? -12.299 -24.645 51.441 1.00 37.95 ? 585 ILE A CB 1 ATOM 2225 C CG1 . ILE A 1 285 ? -13.307 -25.786 51.358 1.00 36.70 ? 585 ILE A CG1 1 ATOM 2226 C CG2 . ILE A 1 285 ? -11.599 -24.645 52.788 1.00 38.12 ? 585 ILE A CG2 1 ATOM 2227 C CD1 . ILE A 1 285 ? -12.869 -27.037 52.101 1.00 41.69 ? 585 ILE A CD1 1 ATOM 2228 N N . PHE A 1 286 ? -11.817 -21.571 52.393 1.00 35.11 ? 586 PHE A N 1 ATOM 2229 C CA . PHE A 1 286 ? -10.772 -20.579 52.590 1.00 32.93 ? 586 PHE A CA 1 ATOM 2230 C C . PHE A 1 286 ? -10.394 -20.516 54.057 1.00 37.81 ? 586 PHE A C 1 ATOM 2231 O O . PHE A 1 286 ? -11.116 -21.017 54.919 1.00 38.32 ? 586 PHE A O 1 ATOM 2232 C CB . PHE A 1 286 ? -11.233 -19.209 52.127 1.00 34.48 ? 586 PHE A CB 1 ATOM 2233 C CG . PHE A 1 286 ? -12.227 -18.569 53.046 1.00 40.08 ? 586 PHE A CG 1 ATOM 2234 C CD1 . PHE A 1 286 ? -11.805 -17.831 54.131 1.00 35.86 ? 586 PHE A CD1 1 ATOM 2235 C CD2 . PHE A 1 286 ? -13.584 -18.703 52.822 1.00 34.98 ? 586 PHE A CD2 1 ATOM 2236 C CE1 . PHE A 1 286 ? -12.711 -17.241 54.974 1.00 38.22 ? 586 PHE A CE1 1 ATOM 2237 C CE2 . PHE A 1 286 ? -14.494 -18.113 53.664 1.00 33.45 ? 586 PHE A CE2 1 ATOM 2238 C CZ . PHE A 1 286 ? -14.059 -17.384 54.741 1.00 35.43 ? 586 PHE A CZ 1 ATOM 2239 N N . GLN A 1 287 ? -9.265 -19.884 54.338 1.00 35.73 ? 587 GLN A N 1 ATOM 2240 C CA . GLN A 1 287 ? -8.766 -19.793 55.701 1.00 38.71 ? 587 GLN A CA 1 ATOM 2241 C C . GLN A 1 287 ? -8.361 -18.363 56.045 1.00 37.66 ? 587 GLN A C 1 ATOM 2242 O O . GLN A 1 287 ? -7.599 -17.735 55.314 1.00 43.41 ? 587 GLN A O 1 ATOM 2243 C CB . GLN A 1 287 ? -7.585 -20.741 55.888 1.00 33.49 ? 587 GLN A CB 1 ATOM 2244 C CG . GLN A 1 287 ? -7.062 -20.792 57.312 1.00 40.41 ? 587 GLN A CG 1 ATOM 2245 C CD . GLN A 1 287 ? -5.777 -21.587 57.424 1.00 46.92 ? 587 GLN A CD 1 ATOM 2246 O OE1 . GLN A 1 287 ? -5.031 -21.719 56.453 1.00 52.98 ? 587 GLN A OE1 1 ATOM 2247 N NE2 . GLN A 1 287 ? -5.513 -22.122 58.611 1.00 48.46 ? 587 GLN A NE2 1 ATOM 2248 N N . THR A 1 288 ? -8.883 -17.845 57.152 1.00 38.10 ? 588 THR A N 1 ATOM 2249 C CA . THR A 1 288 ? -8.612 -16.466 57.550 1.00 40.48 ? 588 THR A CA 1 ATOM 2250 C C . THR A 1 288 ? -7.182 -16.328 58.039 1.00 40.76 ? 588 THR A C 1 ATOM 2251 O O . THR A 1 288 ? -6.614 -17.286 58.552 1.00 39.50 ? 588 THR A O 1 ATOM 2252 C CB . THR A 1 288 ? -9.539 -16.014 58.683 1.00 36.54 ? 588 THR A CB 1 ATOM 2253 O OG1 . THR A 1 288 ? -9.444 -16.948 59.765 1.00 33.20 ? 588 THR A OG1 1 ATOM 2254 C CG2 . THR A 1 288 ? -10.980 -15.936 58.202 1.00 34.40 ? 588 THR A CG2 1 ATOM 2255 N N . LEU A 1 289 ? -6.607 -15.136 57.892 1.00 44.46 ? 589 LEU A N 1 ATOM 2256 C CA . LEU A 1 289 ? -5.231 -14.901 58.327 1.00 40.47 ? 589 LEU A CA 1 ATOM 2257 C C . LEU A 1 289 ? -5.077 -15.127 59.817 1.00 40.94 ? 589 LEU A C 1 ATOM 2258 O O . LEU A 1 289 ? -6.050 -15.049 60.567 1.00 43.59 ? 589 LEU A O 1 ATOM 2259 C CB . LEU A 1 289 ? -4.770 -13.494 57.957 1.00 42.54 ? 589 LEU A CB 1 ATOM 2260 C CG . LEU A 1 289 ? -4.904 -13.165 56.470 1.00 45.58 ? 589 LEU A CG 1 ATOM 2261 C CD1 . LEU A 1 289 ? -4.246 -11.837 56.163 1.00 46.13 ? 589 LEU A CD1 1 ATOM 2262 C CD2 . LEU A 1 289 ? -4.296 -14.270 55.623 1.00 46.91 ? 589 LEU A CD2 1 ATOM 2263 N N . PRO A 1 290 ? -3.846 -15.429 60.250 1.00 45.91 ? 590 PRO A N 1 ATOM 2264 C CA . PRO A 1 290 ? -3.523 -15.657 61.662 1.00 44.74 ? 590 PRO A CA 1 ATOM 2265 C C . PRO A 1 290 ? -3.297 -14.360 62.421 1.00 45.74 ? 590 PRO A C 1 ATOM 2266 O O . PRO A 1 290 ? -2.982 -13.324 61.825 1.00 44.58 ? 590 PRO A O 1 ATOM 2267 C CB . PRO A 1 290 ? -2.190 -16.420 61.607 1.00 40.82 ? 590 PRO A CB 1 ATOM 2268 C CG . PRO A 1 290 ? -1.890 -16.648 60.151 1.00 42.96 ? 590 PRO A CG 1 ATOM 2269 C CD . PRO A 1 290 ? -2.685 -15.655 59.378 1.00 48.16 ? 590 PRO A CD 1 ATOM 2270 N N . VAL A 1 291 ? -3.469 -14.425 63.736 1.00 42.46 ? 591 VAL A N 1 ATOM 2271 C CA . VAL A 1 291 ? -2.969 -13.385 64.613 1.00 49.91 ? 591 VAL A CA 1 ATOM 2272 C C . VAL A 1 291 ? -1.454 -13.416 64.491 1.00 50.17 ? 591 VAL A C 1 ATOM 2273 O O . VAL A 1 291 ? -0.852 -14.489 64.394 1.00 45.40 ? 591 VAL A O 1 ATOM 2274 C CB . VAL A 1 291 ? -3.362 -13.640 66.076 1.00 50.13 ? 591 VAL A CB 1 ATOM 2275 C CG1 . VAL A 1 291 ? -2.888 -12.502 66.954 1.00 50.61 ? 591 VAL A CG1 1 ATOM 2276 C CG2 . VAL A 1 291 ? -4.868 -13.803 66.200 1.00 43.70 ? 591 VAL A CG2 1 ATOM 2277 N N . ARG A 1 292 ? -0.838 -12.242 64.485 1.00 51.99 ? 592 ARG A N 1 ATOM 2278 C CA . ARG A 1 292 ? 0.605 -12.148 64.319 1.00 53.79 ? 592 ARG A CA 1 ATOM 2279 C C . ARG A 1 292 ? 1.196 -11.104 65.253 1.00 51.42 ? 592 ARG A C 1 ATOM 2280 O O . ARG A 1 292 ? 0.485 -10.486 66.047 1.00 45.92 ? 592 ARG A O 1 ATOM 2281 C CB . ARG A 1 292 ? 0.940 -11.782 62.875 1.00 51.67 ? 592 ARG A CB 1 ATOM 2282 C CG . ARG A 1 292 ? 0.124 -10.611 62.350 1.00 48.03 ? 592 ARG A CG 1 ATOM 2283 C CD . ARG A 1 292 ? 0.784 -9.972 61.146 1.00 56.30 ? 592 ARG A CD 1 ATOM 2284 N NE . ARG A 1 292 ? -0.011 -8.872 60.610 1.00 58.18 ? 592 ARG A NE 1 ATOM 2285 C CZ . ARG A 1 292 ? 0.109 -7.606 60.994 1.00 62.56 ? 592 ARG A CZ 1 ATOM 2286 N NH1 . ARG A 1 292 ? 0.999 -7.271 61.925 1.00 53.32 ? 592 ARG A NH1 1 ATOM 2287 N NH2 . ARG A 1 292 ? -0.661 -6.673 60.446 1.00 63.11 ? 592 ARG A NH2 1 ATOM 2288 N N . GLU A 1 293 ? 2.506 -10.915 65.146 1.00 54.18 ? 593 GLU A N 1 ATOM 2289 C CA . GLU A 1 293 ? 3.208 -9.873 65.883 1.00 54.14 ? 593 GLU A CA 1 ATOM 2290 C C . GLU A 1 293 ? 2.758 -8.499 65.389 1.00 51.62 ? 593 GLU A C 1 ATOM 2291 O O . GLU A 1 293 ? 2.199 -8.382 64.297 1.00 53.07 ? 593 GLU A O 1 ATOM 2292 C CB . GLU A 1 293 ? 4.719 -10.024 65.692 1.00 53.65 ? 593 GLU A CB 1 ATOM 2293 C CG . GLU A 1 293 ? 5.219 -9.589 64.314 1.00 56.30 ? 593 GLU A CG 1 ATOM 2294 C CD . GLU A 1 293 ? 4.799 -10.534 63.189 1.00 62.83 ? 593 GLU A CD 1 ATOM 2295 O OE1 . GLU A 1 293 ? 4.431 -11.694 63.476 1.00 64.41 ? 593 GLU A OE1 1 ATOM 2296 O OE2 . GLU A 1 293 ? 4.846 -10.116 62.012 1.00 66.37 ? 593 GLU A OE2 1 ATOM 2297 N N . PRO A 1 294 ? 3.004 -7.449 66.188 1.00 48.70 ? 594 PRO A N 1 ATOM 2298 C CA . PRO A 1 294 ? 2.571 -6.117 65.760 1.00 47.18 ? 594 PRO A CA 1 ATOM 2299 C C . PRO A 1 294 ? 3.381 -5.651 64.565 1.00 46.72 ? 594 PRO A C 1 ATOM 2300 O O . PRO A 1 294 ? 4.512 -6.092 64.384 1.00 47.54 ? 594 PRO A O 1 ATOM 2301 C CB . PRO A 1 294 ? 2.894 -5.225 66.971 1.00 48.98 ? 594 PRO A CB 1 ATOM 2302 C CG . PRO A 1 294 ? 3.214 -6.170 68.108 1.00 50.85 ? 594 PRO A CG 1 ATOM 2303 C CD . PRO A 1 294 ? 3.737 -7.413 67.465 1.00 49.48 ? 594 PRO A CD 1 ATOM 2304 N N . SER A 1 295 ? 2.803 -4.764 63.766 1.00 44.83 ? 595 SER A N 1 ATOM 2305 C CA . SER A 1 295 ? 3.530 -4.105 62.691 1.00 44.73 ? 595 SER A CA 1 ATOM 2306 C C . SER A 1 295 ? 4.536 -3.111 63.272 1.00 47.59 ? 595 SER A C 1 ATOM 2307 O O . SER A 1 295 ? 4.364 -2.646 64.394 1.00 45.90 ? 595 SER A O 1 ATOM 2308 C CB . SER A 1 295 ? 2.543 -3.372 61.789 1.00 48.55 ? 595 SER A CB 1 ATOM 2309 O OG . SER A 1 295 ? 1.466 -4.221 61.442 1.00 50.83 ? 595 SER A OG 1 ATOM 2310 N N . PRO A 1 296 ? 5.585 -2.775 62.503 1.00 48.99 ? 596 PRO A N 1 ATOM 2311 C CA . PRO A 1 296 ? 6.621 -1.823 62.939 1.00 48.08 ? 596 PRO A CA 1 ATOM 2312 C C . PRO A 1 296 ? 6.040 -0.492 63.436 1.00 47.71 ? 596 PRO A C 1 ATOM 2313 O O . PRO A 1 296 ? 5.180 0.076 62.764 1.00 50.89 ? 596 PRO A O 1 ATOM 2314 C CB . PRO A 1 296 ? 7.435 -1.586 61.661 1.00 47.66 ? 596 PRO A CB 1 ATOM 2315 C CG . PRO A 1 296 ? 7.226 -2.820 60.840 1.00 48.10 ? 596 PRO A CG 1 ATOM 2316 C CD . PRO A 1 296 ? 5.835 -3.295 61.146 1.00 46.57 ? 596 PRO A CD 1 ATOM 2317 N N . PRO A 1 297 ? 6.518 0.006 64.593 1.00 44.14 ? 597 PRO A N 1 ATOM 2318 C CA . PRO A 1 297 ? 5.994 1.242 65.192 1.00 46.16 ? 597 PRO A CA 1 ATOM 2319 C C . PRO A 1 297 ? 6.257 2.447 64.310 1.00 47.93 ? 597 PRO A C 1 ATOM 2320 O O . PRO A 1 297 ? 7.156 2.426 63.466 1.00 45.61 ? 597 PRO A O 1 ATOM 2321 C CB . PRO A 1 297 ? 6.810 1.393 66.483 1.00 47.61 ? 597 PRO A CB 1 ATOM 2322 C CG . PRO A 1 297 ? 7.431 0.054 66.727 1.00 50.27 ? 597 PRO A CG 1 ATOM 2323 C CD . PRO A 1 297 ? 7.631 -0.555 65.374 1.00 49.25 ? 597 PRO A CD 1 ATOM 2324 N N . SER A 1 298 ? 5.482 3.501 64.515 1.00 48.11 ? 598 SER A N 1 ATOM 2325 C CA . SER A 1 298 ? 5.698 4.736 63.789 1.00 52.71 ? 598 SER A CA 1 ATOM 2326 C C . SER A 1 298 ? 5.900 5.879 64.772 1.00 55.41 ? 598 SER A C 1 ATOM 2327 O O . SER A 1 298 ? 5.062 6.119 65.641 1.00 54.62 ? 598 SER A O 1 ATOM 2328 C CB . SER A 1 298 ? 4.516 5.028 62.870 1.00 53.79 ? 598 SER A CB 1 ATOM 2329 O OG . SER A 1 298 ? 4.670 6.294 62.258 1.00 60.04 ? 598 SER A OG 1 ATOM 2330 N N . ILE A 1 299 ? 7.013 6.588 64.636 1.00 55.34 ? 599 ILE A N 1 ATOM 2331 C CA . ILE A 1 299 ? 7.356 7.608 65.612 1.00 61.35 ? 599 ILE A CA 1 ATOM 2332 C C . ILE A 1 299 ? 7.897 8.876 64.978 1.00 61.85 ? 599 ILE A C 1 ATOM 2333 O O . ILE A 1 299 ? 8.437 8.853 63.873 1.00 64.19 ? 599 ILE A O 1 ATOM 2334 C CB . ILE A 1 299 ? 8.423 7.094 66.589 1.00 67.91 ? 599 ILE A CB 1 ATOM 2335 C CG1 . ILE A 1 299 ? 9.687 6.708 65.818 1.00 64.40 ? 599 ILE A CG1 1 ATOM 2336 C CG2 . ILE A 1 299 ? 7.894 5.911 67.383 1.00 68.80 ? 599 ILE A CG2 1 ATOM 2337 C CD1 . ILE A 1 299 ? 10.892 6.472 66.687 1.00 58.61 ? 599 ILE A CD1 1 ATOM 2338 N N . HIS A 1 300 ? 7.733 9.980 65.697 1.00 61.32 ? 600 HIS A N 1 ATOM 2339 C CA . HIS A 1 300 ? 8.431 11.224 65.403 1.00 59.67 ? 600 HIS A CA 1 ATOM 2340 C C . HIS A 1 300 ? 8.707 11.949 66.718 1.00 57.27 ? 600 HIS A C 1 ATOM 2341 O O . HIS A 1 300 ? 8.189 11.558 67.765 1.00 58.48 ? 600 HIS A O 1 ATOM 2342 C CB . HIS A 1 300 ? 7.643 12.086 64.414 1.00 59.23 ? 600 HIS A CB 1 ATOM 2343 C CG . HIS A 1 300 ? 7.671 11.555 63.014 1.00 60.29 ? 600 HIS A CG 1 ATOM 2344 N ND1 . HIS A 1 300 ? 8.772 11.682 62.194 1.00 58.59 ? 600 HIS A ND1 1 ATOM 2345 C CD2 . HIS A 1 300 ? 6.744 10.875 62.299 1.00 62.65 ? 600 HIS A CD2 1 ATOM 2346 C CE1 . HIS A 1 300 ? 8.519 11.109 61.030 1.00 58.82 ? 600 HIS A CE1 1 ATOM 2347 N NE2 . HIS A 1 300 ? 7.295 10.614 61.068 1.00 62.05 ? 600 HIS A NE2 1 ATOM 2348 N N . GLY A 1 301 ? 9.532 12.988 66.681 1.00 51.57 ? 601 GLY A N 1 ATOM 2349 C CA . GLY A 1 301 ? 10.001 13.571 67.919 1.00 56.38 ? 601 GLY A CA 1 ATOM 2350 C C . GLY A 1 301 ? 10.086 15.077 67.960 1.00 59.19 ? 601 GLY A C 1 ATOM 2351 O O . GLY A 1 301 ? 9.793 15.764 66.981 1.00 61.81 ? 601 GLY A O 1 ATOM 2352 N N . GLN A 1 302 ? 10.486 15.579 69.123 1.00 64.61 ? 602 GLN A N 1 ATOM 2353 C CA . GLN A 1 302 ? 10.702 16.998 69.332 1.00 67.63 ? 602 GLN A CA 1 ATOM 2354 C C . GLN A 1 302 ? 11.643 17.143 70.516 1.00 69.81 ? 602 GLN A C 1 ATOM 2355 O O . GLN A 1 302 ? 11.824 16.205 71.290 1.00 68.15 ? 602 GLN A O 1 ATOM 2356 C CB . GLN A 1 302 ? 9.383 17.716 69.614 1.00 69.62 ? 602 GLN A CB 1 ATOM 2357 C CG . GLN A 1 302 ? 8.956 17.677 71.067 1.00 77.22 ? 602 GLN A CG 1 ATOM 2358 C CD . GLN A 1 302 ? 7.515 18.100 71.262 1.00 84.47 ? 602 GLN A CD 1 ATOM 2359 O OE1 . GLN A 1 302 ? 6.591 17.423 70.809 1.00 82.91 ? 602 GLN A OE1 1 ATOM 2360 N NE2 . GLN A 1 302 ? 7.313 19.221 71.948 1.00 83.15 ? 602 GLN A NE2 1 ATOM 2361 N N . PRO A 1 303 ? 12.265 18.317 70.647 1.00 72.00 ? 603 PRO A N 1 ATOM 2362 C CA . PRO A 1 303 ? 13.151 18.592 71.779 1.00 77.80 ? 603 PRO A CA 1 ATOM 2363 C C . PRO A 1 303 ? 12.398 18.554 73.108 1.00 78.38 ? 603 PRO A C 1 ATOM 2364 O O . PRO A 1 303 ? 11.279 19.064 73.201 1.00 78.31 ? 603 PRO A O 1 ATOM 2365 C CB . PRO A 1 303 ? 13.633 20.020 71.492 1.00 85.74 ? 603 PRO A CB 1 ATOM 2366 C CG . PRO A 1 303 ? 12.591 20.585 70.546 1.00 89.14 ? 603 PRO A CG 1 ATOM 2367 C CD . PRO A 1 303 ? 12.270 19.423 69.677 1.00 75.96 ? 603 PRO A CD 1 ATOM 2368 N N . SER A 1 304 ? 13.009 17.937 74.116 1.00 79.03 ? 604 SER A N 1 ATOM 2369 C CA . SER A 1 304 ? 12.505 17.979 75.486 1.00 81.94 ? 604 SER A CA 1 ATOM 2370 C C . SER A 1 304 ? 13.653 18.354 76.411 1.00 85.99 ? 604 SER A C 1 ATOM 2371 O O . SER A 1 304 ? 14.672 17.667 76.445 1.00 98.96 ? 604 SER A O 1 ATOM 2372 C CB . SER A 1 304 ? 11.934 16.623 75.902 1.00 82.29 ? 604 SER A CB 1 ATOM 2373 O OG . SER A 1 304 ? 11.623 16.601 77.287 1.00 80.65 ? 604 SER A OG 1 ATOM 2374 N N . SER A 1 305 ? 13.493 19.436 77.164 1.00 83.81 ? 605 SER A N 1 ATOM 2375 C CA . SER A 1 305 ? 14.574 19.933 78.014 1.00 83.84 ? 605 SER A CA 1 ATOM 2376 C C . SER A 1 305 ? 14.954 18.965 79.139 1.00 81.88 ? 605 SER A C 1 ATOM 2377 O O . SER A 1 305 ? 14.113 18.232 79.660 1.00 82.33 ? 605 SER A O 1 ATOM 2378 C CB . SER A 1 305 ? 14.218 21.305 78.586 1.00 80.69 ? 605 SER A CB 1 ATOM 2379 O OG . SER A 1 305 ? 13.959 22.230 77.543 1.00 82.89 ? 605 SER A OG 1 ATOM 2380 N N . GLY A 1 306 ? 16.232 18.967 79.502 1.00 81.32 ? 606 GLY A N 1 ATOM 2381 C CA . GLY A 1 306 ? 17.205 19.830 78.858 1.00 82.66 ? 606 GLY A CA 1 ATOM 2382 C C . GLY A 1 306 ? 17.931 19.099 77.749 1.00 85.37 ? 606 GLY A C 1 ATOM 2383 O O . GLY A 1 306 ? 17.656 19.313 76.567 1.00 84.47 ? 606 GLY A O 1 ATOM 2384 N N . LYS A 1 307 ? 18.862 18.231 78.133 1.00 87.12 ? 607 LYS A N 1 ATOM 2385 C CA . LYS A 1 307 ? 19.578 17.403 77.171 1.00 82.31 ? 607 LYS A CA 1 ATOM 2386 C C . LYS A 1 307 ? 18.827 16.086 76.957 1.00 74.03 ? 607 LYS A C 1 ATOM 2387 O O . LYS A 1 307 ? 19.367 15.000 77.182 1.00 76.30 ? 607 LYS A O 1 ATOM 2388 C CB . LYS A 1 307 ? 21.019 17.150 77.633 1.00 82.44 ? 607 LYS A CB 1 ATOM 2389 C CG . LYS A 1 307 ? 21.851 18.423 77.833 1.00 81.43 ? 607 LYS A CG 1 ATOM 2390 C CD . LYS A 1 307 ? 23.351 18.131 77.893 1.00 79.55 ? 607 LYS A CD 1 ATOM 2391 C CE . LYS A 1 307 ? 23.678 17.079 78.946 1.00 89.34 ? 607 LYS A CE 1 ATOM 2392 N NZ . LYS A 1 307 ? 25.111 16.669 78.917 1.00 87.73 ? 607 LYS A NZ 1 ATOM 2393 N N . SER A 1 308 ? 17.573 16.202 76.530 1.00 71.82 ? 608 SER A N 1 ATOM 2394 C CA . SER A 1 308 ? 16.724 15.045 76.275 1.00 73.08 ? 608 SER A CA 1 ATOM 2395 C C . SER A 1 308 ? 15.843 15.260 75.042 1.00 71.23 ? 608 SER A C 1 ATOM 2396 O O . SER A 1 308 ? 15.757 16.370 74.513 1.00 71.82 ? 608 SER A O 1 ATOM 2397 C CB . SER A 1 308 ? 15.867 14.727 77.506 1.00 77.21 ? 608 SER A CB 1 ATOM 2398 O OG . SER A 1 308 ? 15.335 15.904 78.088 1.00 79.27 ? 608 SER A OG 1 ATOM 2399 N N . PHE A 1 309 ? 15.194 14.193 74.588 1.00 68.92 ? 609 PHE A N 1 ATOM 2400 C CA . PHE A 1 309 ? 14.383 14.240 73.375 1.00 65.83 ? 609 PHE A CA 1 ATOM 2401 C C . PHE A 1 309 ? 13.149 13.366 73.572 1.00 64.71 ? 609 PHE A C 1 ATOM 2402 O O . PHE A 1 309 ? 13.240 12.299 74.175 1.00 66.91 ? 609 PHE A O 1 ATOM 2403 C CB . PHE A 1 309 ? 15.214 13.733 72.192 1.00 61.74 ? 609 PHE A CB 1 ATOM 2404 C CG . PHE A 1 309 ? 14.635 14.063 70.843 1.00 58.11 ? 609 PHE A CG 1 ATOM 2405 C CD1 . PHE A 1 309 ? 14.716 15.349 70.339 1.00 60.76 ? 609 PHE A CD1 1 ATOM 2406 C CD2 . PHE A 1 309 ? 14.036 13.078 70.068 1.00 54.04 ? 609 PHE A CD2 1 ATOM 2407 C CE1 . PHE A 1 309 ? 14.196 15.654 69.094 1.00 56.31 ? 609 PHE A CE1 1 ATOM 2408 C CE2 . PHE A 1 309 ? 13.516 13.375 68.825 1.00 54.12 ? 609 PHE A CE2 1 ATOM 2409 C CZ . PHE A 1 309 ? 13.594 14.665 68.337 1.00 54.95 ? 609 PHE A CZ 1 ATOM 2410 N N . LYS A 1 310 ? 11.994 13.805 73.075 1.00 67.13 ? 610 LYS A N 1 ATOM 2411 C CA . LYS A 1 310 ? 10.775 13.013 73.253 1.00 66.04 ? 610 LYS A CA 1 ATOM 2412 C C . LYS A 1 310 ? 10.214 12.400 71.968 1.00 60.65 ? 610 LYS A C 1 ATOM 2413 O O . LYS A 1 310 ? 9.854 13.101 71.024 1.00 60.95 ? 610 LYS A O 1 ATOM 2414 C CB . LYS A 1 310 ? 9.690 13.807 73.990 1.00 74.55 ? 610 LYS A CB 1 ATOM 2415 C CG . LYS A 1 310 ? 9.076 14.941 73.193 1.00 85.13 ? 610 LYS A CG 1 ATOM 2416 C CD . LYS A 1 310 ? 7.898 15.548 73.940 1.00 90.84 ? 610 LYS A CD 1 ATOM 2417 C CE . LYS A 1 310 ? 6.841 14.498 74.244 1.00 82.80 ? 610 LYS A CE 1 ATOM 2418 N NZ . LYS A 1 310 ? 5.712 15.057 75.043 1.00 85.77 ? 610 LYS A NZ 1 ATOM 2419 N N . LEU A 1 311 ? 10.142 11.076 71.948 1.00 56.82 ? 611 LEU A N 1 ATOM 2420 C CA . LEU A 1 311 ? 9.533 10.361 70.839 1.00 56.91 ? 611 LEU A CA 1 ATOM 2421 C C . LEU A 1 311 ? 8.041 10.157 71.100 1.00 57.82 ? 611 LEU A C 1 ATOM 2422 O O . LEU A 1 311 ? 7.647 9.704 72.175 1.00 60.07 ? 611 LEU A O 1 ATOM 2423 C CB . LEU A 1 311 ? 10.217 9.009 70.651 1.00 54.10 ? 611 LEU A CB 1 ATOM 2424 C CG . LEU A 1 311 ? 11.745 9.034 70.657 1.00 54.86 ? 611 LEU A CG 1 ATOM 2425 C CD1 . LEU A 1 311 ? 12.301 7.635 70.460 1.00 59.38 ? 611 LEU A CD1 1 ATOM 2426 C CD2 . LEU A 1 311 ? 12.255 9.965 69.582 1.00 53.34 ? 611 LEU A CD2 1 ATOM 2427 N N . SER A 1 312 ? 7.213 10.494 70.117 1.00 56.33 ? 612 SER A N 1 ATOM 2428 C CA . SER A 1 312 ? 5.775 10.258 70.224 1.00 58.82 ? 612 SER A CA 1 ATOM 2429 C C . SER A 1 312 ? 5.319 9.094 69.345 1.00 55.53 ? 612 SER A C 1 ATOM 2430 O O . SER A 1 312 ? 5.712 8.976 68.183 1.00 55.17 ? 612 SER A O 1 ATOM 2431 C CB . SER A 1 312 ? 4.987 11.522 69.879 1.00 58.04 ? 612 SER A CB 1 ATOM 2432 O OG . SER A 1 312 ? 5.280 12.556 70.799 1.00 62.37 ? 612 SER A OG 1 ATOM 2433 N N . ILE A 1 313 ? 4.480 8.239 69.913 1.00 50.51 ? 613 ILE A N 1 ATOM 2434 C CA . ILE A 1 313 ? 4.006 7.065 69.213 1.00 55.97 ? 613 ILE A CA 1 ATOM 2435 C C . ILE A 1 313 ? 2.705 7.315 68.471 1.00 56.79 ? 613 ILE A C 1 ATOM 2436 O O . ILE A 1 313 ? 1.703 7.716 69.061 1.00 59.31 ? 613 ILE A O 1 ATOM 2437 C CB . ILE A 1 313 ? 3.817 5.878 70.163 1.00 56.58 ? 613 ILE A CB 1 ATOM 2438 C CG1 . ILE A 1 313 ? 5.049 5.721 71.059 1.00 57.44 ? 613 ILE A CG1 1 ATOM 2439 C CG2 . ILE A 1 313 ? 3.545 4.612 69.361 1.00 55.35 ? 613 ILE A CG2 1 ATOM 2440 C CD1 . ILE A 1 313 ? 5.093 4.426 71.831 1.00 56.10 ? 613 ILE A CD1 1 ATOM 2441 N N . THR A 1 314 ? 2.745 7.081 67.165 1.00 55.30 ? 614 THR A N 1 ATOM 2442 C CA . THR A 1 314 ? 1.560 7.120 66.331 1.00 63.95 ? 614 THR A CA 1 ATOM 2443 C C . THR A 1 314 ? 1.037 5.694 66.173 1.00 66.29 ? 614 THR A C 1 ATOM 2444 O O . THR A 1 314 ? 1.559 4.921 65.369 1.00 64.87 ? 614 THR A O 1 ATOM 2445 C CB . THR A 1 314 ? 1.880 7.707 64.949 1.00 64.88 ? 614 THR A CB 1 ATOM 2446 O OG1 . THR A 1 314 ? 2.569 8.957 65.104 1.00 60.75 ? 614 THR A OG1 1 ATOM 2447 C CG2 . THR A 1 314 ? 0.602 7.918 64.152 1.00 69.95 ? 614 THR A CG2 1 ATOM 2448 N N . LYS A 1 315 ? 0.016 5.353 66.955 1.00 70.15 ? 615 LYS A N 1 ATOM 2449 C CA . LYS A 1 315 ? -0.525 3.994 67.001 1.00 72.65 ? 615 LYS A CA 1 ATOM 2450 C C . LYS A 1 315 ? -0.541 3.291 65.642 1.00 67.31 ? 615 LYS A C 1 ATOM 2451 O O . LYS A 1 315 ? -0.981 3.856 64.638 1.00 69.78 ? 615 LYS A O 1 ATOM 2452 C CB . LYS A 1 315 ? -1.927 3.987 67.624 1.00 86.23 ? 615 LYS A CB 1 ATOM 2453 C CG . LYS A 1 315 ? -1.966 4.458 69.074 1.00 92.77 ? 615 LYS A CG 1 ATOM 2454 C CD . LYS A 1 315 ? -3.295 4.128 69.756 1.00 102.21 ? 615 LYS A CD 1 ATOM 2455 C CE . LYS A 1 315 ? -4.441 5.007 69.265 1.00 98.43 ? 615 LYS A CE 1 ATOM 2456 N NZ . LYS A 1 315 ? -4.993 4.563 67.954 1.00 94.08 ? 615 LYS A NZ 1 ATOM 2457 N N . GLN A 1 316 ? -0.060 2.051 65.631 1.00 61.69 ? 616 GLN A N 1 ATOM 2458 C CA . GLN A 1 316 ? 0.079 1.268 64.408 1.00 58.05 ? 616 GLN A CA 1 ATOM 2459 C C . GLN A 1 316 ? -0.589 -0.095 64.571 1.00 56.34 ? 616 GLN A C 1 ATOM 2460 O O . GLN A 1 316 ? -1.077 -0.432 65.650 1.00 56.47 ? 616 GLN A O 1 ATOM 2461 C CB . GLN A 1 316 ? 1.560 1.086 64.060 1.00 57.66 ? 616 GLN A CB 1 ATOM 2462 C CG . GLN A 1 316 ? 1.859 1.019 62.581 1.00 56.91 ? 616 GLN A CG 1 ATOM 2463 C CD . GLN A 1 316 ? 1.489 2.300 61.857 1.00 59.13 ? 616 GLN A CD 1 ATOM 2464 O OE1 . GLN A 1 316 ? 1.627 3.396 62.398 1.00 62.13 ? 616 GLN A OE1 1 ATOM 2465 N NE2 . GLN A 1 316 ? 1.018 2.166 60.626 1.00 55.57 ? 616 GLN A NE2 1 ATOM 2466 N N . ASP A 1 317 ? -0.587 -0.879 63.499 1.00 55.93 ? 617 ASP A N 1 ATOM 2467 C CA . ASP A 1 317 ? -1.307 -2.152 63.457 1.00 54.52 ? 617 ASP A CA 1 ATOM 2468 C C . ASP A 1 317 ? -0.939 -3.123 64.594 1.00 52.71 ? 617 ASP A C 1 ATOM 2469 O O . ASP A 1 317 ? 0.210 -3.542 64.738 1.00 48.67 ? 617 ASP A O 1 ATOM 2470 C CB . ASP A 1 317 ? -1.128 -2.808 62.081 1.00 57.00 ? 617 ASP A CB 1 ATOM 2471 C CG . ASP A 1 317 ? -2.186 -3.858 61.787 1.00 57.54 ? 617 ASP A CG 1 ATOM 2472 O OD1 . ASP A 1 317 ? -2.630 -4.537 62.737 1.00 52.39 ? 617 ASP A OD1 1 ATOM 2473 O OD2 . ASP A 1 317 ? -2.564 -4.009 60.603 1.00 67.56 ? 617 ASP A OD2 1 ATOM 2474 N N . ASP A 1 318 ? -1.954 -3.483 65.375 1.00 53.26 ? 618 ASP A N 1 ATOM 2475 C CA . ASP A 1 318 ? -1.832 -4.335 66.557 1.00 55.23 ? 618 ASP A CA 1 ATOM 2476 C C . ASP A 1 318 ? -1.424 -5.772 66.233 1.00 53.50 ? 618 ASP A C 1 ATOM 2477 O O . ASP A 1 318 ? -0.602 -6.366 66.930 1.00 53.73 ? 618 ASP A O 1 ATOM 2478 C CB . ASP A 1 318 ? -3.181 -4.362 67.283 1.00 56.56 ? 618 ASP A CB 1 ATOM 2479 C CG . ASP A 1 318 ? -3.067 -4.836 68.701 1.00 63.56 ? 618 ASP A CG 1 ATOM 2480 O OD1 . ASP A 1 318 ? -1.938 -4.838 69.229 1.00 64.31 ? 618 ASP A OD1 1 ATOM 2481 O OD2 . ASP A 1 318 ? -4.108 -5.197 69.289 1.00 66.81 ? 618 ASP A OD2 1 ATOM 2482 N N . GLY A 1 319 ? -2.025 -6.337 65.190 1.00 56.26 ? 619 GLY A N 1 ATOM 2483 C CA . GLY A 1 319 ? -1.751 -7.712 64.809 1.00 53.23 ? 619 GLY A CA 1 ATOM 2484 C C . GLY A 1 319 ? -2.697 -8.740 65.413 1.00 51.02 ? 619 GLY A C 1 ATOM 2485 O O . GLY A 1 319 ? -2.545 -9.942 65.187 1.00 47.47 ? 619 GLY A O 1 ATOM 2486 N N . GLY A 1 320 ? -3.668 -8.278 66.193 1.00 52.29 ? 620 GLY A N 1 ATOM 2487 C CA . GLY A 1 320 ? -4.666 -9.174 66.753 1.00 53.00 ? 620 GLY A CA 1 ATOM 2488 C C . GLY A 1 320 ? -4.513 -9.464 68.232 1.00 55.62 ? 620 GLY A C 1 ATOM 2489 O O . GLY A 1 320 ? -5.389 -10.069 68.851 1.00 55.31 ? 620 GLY A O 1 ATOM 2490 N N . ALA A 1 321 ? -3.391 -9.042 68.800 1.00 55.82 ? 621 ALA A N 1 ATOM 2491 C CA . ALA A 1 321 ? -3.154 -9.197 70.227 1.00 59.44 ? 621 ALA A CA 1 ATOM 2492 C C . ALA A 1 321 ? -2.571 -7.900 70.757 1.00 59.64 ? 621 ALA A C 1 ATOM 2493 O O . ALA A 1 321 ? -1.807 -7.232 70.063 1.00 57.28 ? 621 ALA A O 1 ATOM 2494 C CB . ALA A 1 321 ? -2.215 -10.359 70.495 1.00 56.03 ? 621 ALA A CB 1 ATOM 2495 N N . PRO A 1 322 ? -2.930 -7.542 71.994 1.00 62.74 ? 622 PRO A N 1 ATOM 2496 C CA . PRO A 1 322 ? -2.562 -6.244 72.565 1.00 64.18 ? 622 PRO A CA 1 ATOM 2497 C C . PRO A 1 322 ? -1.049 -6.010 72.571 1.00 61.45 ? 622 PRO A C 1 ATOM 2498 O O . PRO A 1 322 ? -0.281 -6.912 72.903 1.00 62.20 ? 622 PRO A O 1 ATOM 2499 C CB . PRO A 1 322 ? -3.084 -6.335 74.007 1.00 67.86 ? 622 PRO A CB 1 ATOM 2500 C CG . PRO A 1 322 ? -4.107 -7.426 73.989 1.00 64.97 ? 622 PRO A CG 1 ATOM 2501 C CD . PRO A 1 322 ? -3.626 -8.400 72.967 1.00 61.42 ? 622 PRO A CD 1 ATOM 2502 N N . ILE A 1 323 ? -0.630 -4.809 72.188 1.00 60.58 ? 623 ILE A N 1 ATOM 2503 C CA . ILE A 1 323 ? 0.748 -4.392 72.386 1.00 61.13 ? 623 ILE A CA 1 ATOM 2504 C C . ILE A 1 323 ? 0.908 -4.165 73.875 1.00 59.59 ? 623 ILE A C 1 ATOM 2505 O O . ILE A 1 323 ? 0.106 -3.454 74.481 1.00 58.64 ? 623 ILE A O 1 ATOM 2506 C CB . ILE A 1 323 ? 1.055 -3.060 71.673 1.00 57.65 ? 623 ILE A CB 1 ATOM 2507 C CG1 . ILE A 1 323 ? 0.844 -3.192 70.168 1.00 51.36 ? 623 ILE A CG1 1 ATOM 2508 C CG2 . ILE A 1 323 ? 2.483 -2.598 71.973 1.00 53.29 ? 623 ILE A CG2 1 ATOM 2509 C CD1 . ILE A 1 323 ? 0.728 -1.856 69.457 1.00 50.52 ? 623 ILE A CD1 1 ATOM 2510 N N . LEU A 1 324 ? 1.937 -4.757 74.467 1.00 62.37 ? 624 LEU A N 1 ATOM 2511 C CA . LEU A 1 324 ? 2.166 -4.593 75.899 1.00 67.07 ? 624 LEU A CA 1 ATOM 2512 C C . LEU A 1 324 ? 3.542 -4.022 76.231 1.00 70.54 ? 624 LEU A C 1 ATOM 2513 O O . LEU A 1 324 ? 3.910 -3.926 77.401 1.00 76.11 ? 624 LEU A O 1 ATOM 2514 C CB . LEU A 1 324 ? 1.962 -5.923 76.634 1.00 72.90 ? 624 LEU A CB 1 ATOM 2515 C CG . LEU A 1 324 ? 2.562 -7.217 76.067 1.00 65.95 ? 624 LEU A CG 1 ATOM 2516 C CD1 . LEU A 1 324 ? 1.591 -7.912 75.125 1.00 61.93 ? 624 LEU A CD1 1 ATOM 2517 C CD2 . LEU A 1 324 ? 3.910 -6.984 75.395 1.00 64.89 ? 624 LEU A CD2 1 ATOM 2518 N N . GLU A 1 325 ? 4.295 -3.634 75.207 1.00 66.95 ? 625 GLU A N 1 ATOM 2519 C CA . GLU A 1 325 ? 5.696 -3.289 75.407 1.00 69.95 ? 625 GLU A CA 1 ATOM 2520 C C . GLU A 1 325 ? 6.347 -2.671 74.165 1.00 63.43 ? 625 GLU A C 1 ATOM 2521 O O . GLU A 1 325 ? 6.402 -3.292 73.105 1.00 59.90 ? 625 GLU A O 1 ATOM 2522 C CB . GLU A 1 325 ? 6.454 -4.551 75.835 1.00 74.65 ? 625 GLU A CB 1 ATOM 2523 C CG . GLU A 1 325 ? 7.927 -4.376 76.160 1.00 78.19 ? 625 GLU A CG 1 ATOM 2524 C CD . GLU A 1 325 ? 8.610 -5.710 76.431 1.00 90.58 ? 625 GLU A CD 1 ATOM 2525 O OE1 . GLU A 1 325 ? 7.902 -6.738 76.481 1.00 102.86 ? 625 GLU A OE1 1 ATOM 2526 O OE2 . GLU A 1 325 ? 9.850 -5.737 76.589 1.00 90.41 ? 625 GLU A OE2 1 ATOM 2527 N N . TYR A 1 326 ? 6.832 -1.441 74.301 1.00 62.54 ? 626 TYR A N 1 ATOM 2528 C CA . TYR A 1 326 ? 7.681 -0.840 73.279 1.00 59.81 ? 626 TYR A CA 1 ATOM 2529 C C . TYR A 1 326 ? 9.154 -0.888 73.687 1.00 61.09 ? 626 TYR A C 1 ATOM 2530 O O . TYR A 1 326 ? 9.509 -0.553 74.818 1.00 59.39 ? 626 TYR A O 1 ATOM 2531 C CB . TYR A 1 326 ? 7.262 0.603 73.009 1.00 54.38 ? 626 TYR A CB 1 ATOM 2532 C CG . TYR A 1 326 ? 5.944 0.722 72.286 1.00 56.21 ? 626 TYR A CG 1 ATOM 2533 C CD1 . TYR A 1 326 ? 5.869 0.564 70.906 1.00 53.70 ? 626 TYR A CD1 1 ATOM 2534 C CD2 . TYR A 1 326 ? 4.774 0.989 72.981 1.00 56.80 ? 626 TYR A CD2 1 ATOM 2535 C CE1 . TYR A 1 326 ? 4.661 0.676 70.237 1.00 49.19 ? 626 TYR A CE1 1 ATOM 2536 C CE2 . TYR A 1 326 ? 3.564 1.101 72.323 1.00 54.16 ? 626 TYR A CE2 1 ATOM 2537 C CZ . TYR A 1 326 ? 3.512 0.945 70.952 1.00 50.37 ? 626 TYR A CZ 1 ATOM 2538 O OH . TYR A 1 326 ? 2.307 1.059 70.301 1.00 51.45 ? 626 TYR A OH 1 ATOM 2539 N N . ILE A 1 327 ? 10.011 -1.304 72.764 1.00 58.44 ? 627 ILE A N 1 ATOM 2540 C CA . ILE A 1 327 ? 11.444 -1.362 73.035 1.00 61.20 ? 627 ILE A CA 1 ATOM 2541 C C . ILE A 1 327 ? 12.229 -0.363 72.187 1.00 59.43 ? 627 ILE A C 1 ATOM 2542 O O . ILE A 1 327 ? 12.462 -0.586 71.000 1.00 57.91 ? 627 ILE A O 1 ATOM 2543 C CB . ILE A 1 327 ? 12.000 -2.772 72.807 1.00 60.76 ? 627 ILE A CB 1 ATOM 2544 C CG1 . ILE A 1 327 ? 11.122 -3.799 73.519 1.00 65.01 ? 627 ILE A CG1 1 ATOM 2545 C CG2 . ILE A 1 327 ? 13.449 -2.863 73.287 1.00 63.87 ? 627 ILE A CG2 1 ATOM 2546 C CD1 . ILE A 1 327 ? 11.598 -5.206 73.340 1.00 66.55 ? 627 ILE A CD1 1 ATOM 2547 N N . VAL A 1 328 ? 12.634 0.737 72.816 1.00 60.85 ? 628 VAL A N 1 ATOM 2548 C CA . VAL A 1 328 ? 13.433 1.762 72.159 1.00 62.76 ? 628 VAL A CA 1 ATOM 2549 C C . VAL A 1 328 ? 14.923 1.590 72.434 1.00 64.92 ? 628 VAL A C 1 ATOM 2550 O O . VAL A 1 328 ? 15.377 1.734 73.570 1.00 63.07 ? 628 VAL A O 1 ATOM 2551 C CB . VAL A 1 328 ? 13.023 3.159 72.632 1.00 60.67 ? 628 VAL A CB 1 ATOM 2552 C CG1 . VAL A 1 328 ? 13.998 4.204 72.111 1.00 63.03 ? 628 VAL A CG1 1 ATOM 2553 C CG2 . VAL A 1 328 ? 11.614 3.465 72.185 1.00 61.52 ? 628 VAL A CG2 1 ATOM 2554 N N . LYS A 1 329 ? 15.681 1.280 71.388 1.00 67.02 ? 629 LYS A N 1 ATOM 2555 C CA . LYS A 1 329 ? 17.135 1.239 71.482 1.00 70.13 ? 629 LYS A CA 1 ATOM 2556 C C . LYS A 1 329 ? 17.722 2.382 70.669 1.00 68.41 ? 629 LYS A C 1 ATOM 2557 O O . LYS A 1 329 ? 17.278 2.645 69.549 1.00 65.23 ? 629 LYS A O 1 ATOM 2558 C CB . LYS A 1 329 ? 17.687 -0.096 70.979 1.00 75.61 ? 629 LYS A CB 1 ATOM 2559 C CG . LYS A 1 329 ? 17.291 -1.302 71.813 1.00 81.49 ? 629 LYS A CG 1 ATOM 2560 C CD . LYS A 1 329 ? 17.918 -2.572 71.253 1.00 98.08 ? 629 LYS A CD 1 ATOM 2561 C CE . LYS A 1 329 ? 17.196 -3.818 71.738 1.00 108.82 ? 629 LYS A CE 1 ATOM 2562 N NZ . LYS A 1 329 ? 17.923 -5.058 71.345 1.00 110.37 ? 629 LYS A NZ 1 ATOM 2563 N N . TYR A 1 330 ? 18.721 3.057 71.232 1.00 72.70 ? 630 TYR A N 1 ATOM 2564 C CA . TYR A 1 330 ? 19.301 4.231 70.591 1.00 72.04 ? 630 TYR A CA 1 ATOM 2565 C C . TYR A 1 330 ? 20.793 4.390 70.868 1.00 76.09 ? 630 TYR A C 1 ATOM 2566 O O . TYR A 1 330 ? 21.286 4.014 71.932 1.00 78.19 ? 630 TYR A O 1 ATOM 2567 C CB . TYR A 1 330 ? 18.554 5.490 71.027 1.00 68.00 ? 630 TYR A CB 1 ATOM 2568 C CG . TYR A 1 330 ? 18.630 5.762 72.512 1.00 71.91 ? 630 TYR A CG 1 ATOM 2569 C CD1 . TYR A 1 330 ? 19.441 6.770 73.010 1.00 75.56 ? 630 TYR A CD1 1 ATOM 2570 C CD2 . TYR A 1 330 ? 17.890 5.012 73.416 1.00 72.88 ? 630 TYR A CD2 1 ATOM 2571 C CE1 . TYR A 1 330 ? 19.512 7.027 74.364 1.00 75.79 ? 630 TYR A CE1 1 ATOM 2572 C CE2 . TYR A 1 330 ? 17.955 5.261 74.773 1.00 73.81 ? 630 TYR A CE2 1 ATOM 2573 C CZ . TYR A 1 330 ? 18.768 6.271 75.242 1.00 74.86 ? 630 TYR A CZ 1 ATOM 2574 O OH . TYR A 1 330 ? 18.841 6.532 76.593 1.00 72.95 ? 630 TYR A OH 1 ATOM 2575 N N . ARG A 1 331 ? 21.504 4.951 69.896 1.00 74.22 ? 631 ARG A N 1 ATOM 2576 C CA . ARG A 1 331 ? 22.935 5.197 70.023 1.00 72.67 ? 631 ARG A CA 1 ATOM 2577 C C . ARG A 1 331 ? 23.313 6.476 69.287 1.00 67.65 ? 631 ARG A C 1 ATOM 2578 O O . ARG A 1 331 ? 22.444 7.251 68.892 1.00 61.05 ? 631 ARG A O 1 ATOM 2579 C CB . ARG A 1 331 ? 23.738 4.022 69.461 1.00 78.85 ? 631 ARG A CB 1 ATOM 2580 C CG . ARG A 1 331 ? 23.705 3.926 67.939 1.00 84.94 ? 631 ARG A CG 1 ATOM 2581 C CD . ARG A 1 331 ? 24.512 2.739 67.423 1.00 91.96 ? 631 ARG A CD 1 ATOM 2582 N NE . ARG A 1 331 ? 24.578 2.721 65.961 1.00 109.60 ? 631 ARG A NE 1 ATOM 2583 C CZ . ARG A 1 331 ? 25.089 1.724 65.244 1.00 113.69 ? 631 ARG A CZ 1 ATOM 2584 N NH1 . ARG A 1 331 ? 25.581 0.652 65.850 1.00 113.00 ? 631 ARG A NH1 1 ATOM 2585 N NH2 . ARG A 1 331 ? 25.105 1.796 63.918 1.00 99.71 ? 631 ARG A NH2 1 ATOM 2586 N N . SER A 1 332 ? 24.615 6.670 69.095 1.00 67.39 ? 632 SER A N 1 ATOM 2587 C CA . SER A 1 332 ? 25.174 7.859 68.449 1.00 60.39 ? 632 SER A CA 1 ATOM 2588 C C . SER A 1 332 ? 25.117 9.063 69.371 1.00 59.92 ? 632 SER A C 1 ATOM 2589 O O . SER A 1 332 ? 26.056 9.307 70.125 1.00 58.09 ? 632 SER A O 1 ATOM 2590 C CB . SER A 1 332 ? 24.491 8.167 67.113 1.00 63.99 ? 632 SER A CB 1 ATOM 2591 O OG . SER A 1 332 ? 25.163 9.216 66.430 1.00 57.73 ? 632 SER A OG 1 ATOM 2592 N N . GLN A 1 338 ? 28.165 1.918 69.952 1.00 81.74 ? 638 GLN A N 1 ATOM 2593 C CA . GLN A 1 338 ? 27.348 0.868 70.560 1.00 87.25 ? 638 GLN A CA 1 ATOM 2594 C C . GLN A 1 338 ? 26.013 1.393 71.120 1.00 92.34 ? 638 GLN A C 1 ATOM 2595 O O . GLN A 1 338 ? 25.869 2.584 71.404 1.00 87.37 ? 638 GLN A O 1 ATOM 2596 C CB . GLN A 1 338 ? 28.162 0.090 71.606 1.00 83.49 ? 638 GLN A CB 1 ATOM 2597 C CG . GLN A 1 338 ? 27.458 -0.169 72.928 1.00 88.32 ? 638 GLN A CG 1 ATOM 2598 C CD . GLN A 1 338 ? 27.794 0.882 73.973 1.00 98.22 ? 638 GLN A CD 1 ATOM 2599 O OE1 . GLN A 1 338 ? 28.674 1.721 73.765 1.00 97.80 ? 638 GLN A OE1 1 ATOM 2600 N NE2 . GLN A 1 338 ? 27.101 0.836 75.107 1.00 86.44 ? 638 GLN A NE2 1 ATOM 2601 N N . TRP A 1 339 ? 25.041 0.493 71.259 1.00 106.11 ? 639 TRP A N 1 ATOM 2602 C CA . TRP A 1 339 ? 23.658 0.866 71.568 1.00 89.76 ? 639 TRP A CA 1 ATOM 2603 C C . TRP A 1 339 ? 23.276 0.824 73.043 1.00 88.29 ? 639 TRP A C 1 ATOM 2604 O O . TRP A 1 339 ? 24.018 0.327 73.887 1.00 92.85 ? 639 TRP A O 1 ATOM 2605 C CB . TRP A 1 339 ? 22.683 -0.023 70.792 1.00 87.14 ? 639 TRP A CB 1 ATOM 2606 C CG . TRP A 1 339 ? 22.026 0.658 69.630 1.00 87.42 ? 639 TRP A CG 1 ATOM 2607 C CD1 . TRP A 1 339 ? 21.167 1.717 69.682 1.00 83.20 ? 639 TRP A CD1 1 ATOM 2608 C CD2 . TRP A 1 339 ? 22.156 0.315 68.243 1.00 90.04 ? 639 TRP A CD2 1 ATOM 2609 N NE1 . TRP A 1 339 ? 20.762 2.063 68.415 1.00 81.88 ? 639 TRP A NE1 1 ATOM 2610 C CE2 . TRP A 1 339 ? 21.353 1.217 67.513 1.00 85.54 ? 639 TRP A CE2 1 ATOM 2611 C CE3 . TRP A 1 339 ? 22.875 -0.663 67.547 1.00 88.89 ? 639 TRP A CE3 1 ATOM 2612 C CZ2 . TRP A 1 339 ? 21.250 1.170 66.122 1.00 91.18 ? 639 TRP A CZ2 1 ATOM 2613 C CZ3 . TRP A 1 339 ? 22.772 -0.709 66.166 1.00 93.49 ? 639 TRP A CZ3 1 ATOM 2614 C CH2 . TRP A 1 339 ? 21.965 0.202 65.469 1.00 96.61 ? 639 TRP A CH2 1 ATOM 2615 N N . LEU A 1 340 ? 22.091 1.355 73.326 1.00 83.84 ? 640 LEU A N 1 ATOM 2616 C CA . LEU A 1 340 ? 21.486 1.294 74.648 1.00 82.15 ? 640 LEU A CA 1 ATOM 2617 C C . LEU A 1 340 ? 20.023 0.935 74.456 1.00 83.23 ? 640 LEU A C 1 ATOM 2618 O O . LEU A 1 340 ? 19.403 1.358 73.485 1.00 78.54 ? 640 LEU A O 1 ATOM 2619 C CB . LEU A 1 340 ? 21.579 2.650 75.342 1.00 81.05 ? 640 LEU A CB 1 ATOM 2620 C CG . LEU A 1 340 ? 22.959 3.304 75.395 1.00 89.50 ? 640 LEU A CG 1 ATOM 2621 C CD1 . LEU A 1 340 ? 22.836 4.760 75.812 1.00 88.18 ? 640 LEU A CD1 1 ATOM 2622 C CD2 . LEU A 1 340 ? 23.878 2.540 76.338 1.00 84.85 ? 640 LEU A CD2 1 ATOM 2623 N N . GLU A 1 341 ? 19.469 0.159 75.379 1.00 85.76 ? 641 GLU A N 1 ATOM 2624 C CA . GLU A 1 341 ? 18.073 -0.243 75.280 1.00 84.09 ? 641 GLU A CA 1 ATOM 2625 C C . GLU A 1 341 ? 17.191 0.555 76.226 1.00 77.21 ? 641 GLU A C 1 ATOM 2626 O O . GLU A 1 341 ? 17.679 1.346 77.032 1.00 80.72 ? 641 GLU A O 1 ATOM 2627 C CB . GLU A 1 341 ? 17.924 -1.735 75.571 1.00 92.04 ? 641 GLU A CB 1 ATOM 2628 C CG . GLU A 1 341 ? 18.655 -2.636 74.593 1.00 104.33 ? 641 GLU A CG 1 ATOM 2629 C CD . GLU A 1 341 ? 18.470 -4.107 74.915 1.00 126.50 ? 641 GLU A CD 1 ATOM 2630 O OE1 . GLU A 1 341 ? 18.270 -4.435 76.106 1.00 141.95 ? 641 GLU A OE1 1 ATOM 2631 O OE2 . GLU A 1 341 ? 18.528 -4.935 73.979 1.00 122.96 ? 641 GLU A OE2 1 ATOM 2632 N N . LYS A 1 342 ? 15.886 0.340 76.112 1.00 73.22 ? 642 LYS A N 1 ATOM 2633 C CA . LYS A 1 342 ? 14.914 0.954 77.006 1.00 71.95 ? 642 LYS A CA 1 ATOM 2634 C C . LYS A 1 342 ? 13.520 0.479 76.637 1.00 71.78 ? 642 LYS A C 1 ATOM 2635 O O . LYS A 1 342 ? 13.148 0.483 75.466 1.00 85.34 ? 642 LYS A O 1 ATOM 2636 C CB . LYS A 1 342 ? 14.979 2.477 76.926 1.00 72.41 ? 642 LYS A CB 1 ATOM 2637 C CG . LYS A 1 342 ? 13.941 3.175 77.785 1.00 70.87 ? 642 LYS A CG 1 ATOM 2638 C CD . LYS A 1 342 ? 13.980 4.680 77.573 1.00 70.84 ? 642 LYS A CD 1 ATOM 2639 C CE . LYS A 1 342 ? 12.792 5.362 78.236 1.00 76.78 ? 642 LYS A CE 1 ATOM 2640 N NZ . LYS A 1 342 ? 12.879 5.292 79.719 1.00 89.18 ? 642 LYS A NZ 1 ATOM 2641 N N . LYS A 1 343 ? 12.749 0.076 77.638 1.00 67.80 ? 643 LYS A N 1 ATOM 2642 C CA . LYS A 1 343 ? 11.421 -0.465 77.397 1.00 68.42 ? 643 LYS A CA 1 ATOM 2643 C C . LYS A 1 343 ? 10.359 0.388 78.082 1.00 68.75 ? 643 LYS A C 1 ATOM 2644 O O . LYS A 1 343 ? 10.603 0.947 79.147 1.00 69.42 ? 643 LYS A O 1 ATOM 2645 C CB . LYS A 1 343 ? 11.345 -1.921 77.867 1.00 70.89 ? 643 LYS A CB 1 ATOM 2646 C CG . LYS A 1 343 ? 12.566 -2.752 77.475 1.00 69.40 ? 643 LYS A CG 1 ATOM 2647 C CD . LYS A 1 343 ? 12.250 -4.237 77.393 1.00 74.39 ? 643 LYS A CD 1 ATOM 2648 C CE . LYS A 1 343 ? 11.981 -4.834 78.764 1.00 84.91 ? 643 LYS A CE 1 ATOM 2649 N NZ . LYS A 1 343 ? 13.225 -4.951 79.571 1.00 80.85 ? 643 LYS A NZ 1 ATOM 2650 N N . VAL A 1 344 ? 9.193 0.509 77.451 1.00 67.76 ? 644 VAL A N 1 ATOM 2651 C CA . VAL A 1 344 ? 8.064 1.233 78.037 1.00 67.59 ? 644 VAL A CA 1 ATOM 2652 C C . VAL A 1 344 ? 6.776 0.468 77.734 1.00 71.02 ? 644 VAL A C 1 ATOM 2653 O O . VAL A 1 344 ? 6.768 -0.431 76.896 1.00 69.35 ? 644 VAL A O 1 ATOM 2654 C CB . VAL A 1 344 ? 7.969 2.677 77.524 1.00 64.83 ? 644 VAL A CB 1 ATOM 2655 C CG1 . VAL A 1 344 ? 7.172 2.733 76.229 1.00 62.59 ? 644 VAL A CG1 1 ATOM 2656 C CG2 . VAL A 1 344 ? 7.331 3.576 78.574 1.00 70.26 ? 644 VAL A CG2 1 ATOM 2657 N N . GLN A 1 345 ? 5.688 0.820 78.413 1.00 71.65 ? 645 GLN A N 1 ATOM 2658 C CA . GLN A 1 345 ? 4.475 0.004 78.363 1.00 75.25 ? 645 GLN A CA 1 ATOM 2659 C C . GLN A 1 345 ? 3.545 0.340 77.203 1.00 70.03 ? 645 GLN A C 1 ATOM 2660 O O . GLN A 1 345 ? 3.530 1.467 76.717 1.00 66.15 ? 645 GLN A O 1 ATOM 2661 C CB . GLN A 1 345 ? 3.720 0.054 79.698 1.00 76.99 ? 645 GLN A CB 1 ATOM 2662 C CG . GLN A 1 345 ? 4.489 -0.564 80.870 1.00 87.66 ? 645 GLN A CG 1 ATOM 2663 C CD . GLN A 1 345 ? 4.842 -2.036 80.658 1.00 102.40 ? 645 GLN A CD 1 ATOM 2664 O OE1 . GLN A 1 345 ? 5.988 -2.374 80.359 1.00 112.89 ? 645 GLN A OE1 1 ATOM 2665 N NE2 . GLN A 1 345 ? 3.856 -2.915 80.816 1.00 102.05 ? 645 GLN A NE2 1 ATOM 2666 N N . GLY A 1 346 ? 2.765 -0.655 76.779 1.00 70.59 ? 646 GLY A N 1 ATOM 2667 C CA . GLY A 1 346 ? 1.899 -0.545 75.615 1.00 66.74 ? 646 GLY A CA 1 ATOM 2668 C C . GLY A 1 346 ? 0.918 0.609 75.641 1.00 68.39 ? 646 GLY A C 1 ATOM 2669 O O . GLY A 1 346 ? 0.697 1.274 74.628 1.00 67.97 ? 646 GLY A O 1 ATOM 2670 N N . ASN A 1 347 ? 0.322 0.849 76.801 1.00 72.84 ? 647 ASN A N 1 ATOM 2671 C CA . ASN A 1 347 ? -0.659 1.917 76.938 1.00 75.90 ? 647 ASN A CA 1 ATOM 2672 C C . ASN A 1 347 ? -0.041 3.300 76.768 1.00 73.35 ? 647 ASN A C 1 ATOM 2673 O O . ASN A 1 347 ? -0.759 4.300 76.682 1.00 73.04 ? 647 ASN A O 1 ATOM 2674 C CB . ASN A 1 347 ? -1.343 1.831 78.299 1.00 87.27 ? 647 ASN A CB 1 ATOM 2675 C CG . ASN A 1 347 ? -0.397 2.135 79.447 1.00 79.99 ? 647 ASN A CG 1 ATOM 2676 O OD1 . ASN A 1 347 ? -0.829 2.514 80.534 1.00 82.52 ? 647 ASN A OD1 1 ATOM 2677 N ND2 . ASN A 1 347 ? 0.902 1.974 79.209 1.00 77.93 ? 647 ASN A ND2 1 ATOM 2678 N N . LYS A 1 348 ? 1.289 3.347 76.720 1.00 72.56 ? 648 LYS A N 1 ATOM 2679 C CA . LYS A 1 348 ? 2.021 4.615 76.707 1.00 72.99 ? 648 LYS A CA 1 ATOM 2680 C C . LYS A 1 348 ? 1.820 5.447 75.435 1.00 73.84 ? 648 LYS A C 1 ATOM 2681 O O . LYS A 1 348 ? 1.470 4.931 74.374 1.00 70.72 ? 648 LYS A O 1 ATOM 2682 C CB . LYS A 1 348 ? 3.518 4.388 76.963 1.00 72.29 ? 648 LYS A CB 1 ATOM 2683 C CG . LYS A 1 348 ? 3.855 3.851 78.352 1.00 72.35 ? 648 LYS A CG 1 ATOM 2684 C CD . LYS A 1 348 ? 3.730 4.926 79.418 1.00 73.92 ? 648 LYS A CD 1 ATOM 2685 C CE . LYS A 1 348 ? 3.784 4.329 80.815 1.00 83.09 ? 648 LYS A CE 1 ATOM 2686 N NZ . LYS A 1 348 ? 2.556 3.551 81.143 1.00 81.37 ? 648 LYS A NZ 1 ATOM 2687 N N . ASP A 1 349 ? 2.067 6.744 75.565 1.00 72.86 ? 649 ASP A N 1 ATOM 2688 C CA . ASP A 1 349 ? 1.800 7.708 74.510 1.00 74.64 ? 649 ASP A CA 1 ATOM 2689 C C . ASP A 1 349 ? 3.104 8.245 73.926 1.00 68.74 ? 649 ASP A C 1 ATOM 2690 O O . ASP A 1 349 ? 3.136 8.785 72.820 1.00 65.94 ? 649 ASP A O 1 ATOM 2691 C CB . ASP A 1 349 ? 0.967 8.855 75.091 1.00 78.28 ? 649 ASP A CB 1 ATOM 2692 C CG . ASP A 1 349 ? 0.813 10.017 74.134 1.00 84.26 ? 649 ASP A CG 1 ATOM 2693 O OD1 . ASP A 1 349 ? 0.453 9.781 72.962 1.00 89.01 ? 649 ASP A OD1 1 ATOM 2694 O OD2 . ASP A 1 349 ? 1.037 11.171 74.564 1.00 79.90 ? 649 ASP A OD2 1 ATOM 2695 N N . HIS A 1 350 ? 4.184 8.089 74.678 1.00 68.31 ? 650 HIS A N 1 ATOM 2696 C CA . HIS A 1 350 ? 5.465 8.654 74.287 1.00 65.41 ? 650 HIS A CA 1 ATOM 2697 C C . HIS A 1 350 ? 6.592 8.104 75.140 1.00 65.12 ? 650 HIS A C 1 ATOM 2698 O O . HIS A 1 350 ? 6.363 7.421 76.135 1.00 67.46 ? 650 HIS A O 1 ATOM 2699 C CB . HIS A 1 350 ? 5.438 10.175 74.416 1.00 71.74 ? 650 HIS A CB 1 ATOM 2700 C CG . HIS A 1 350 ? 5.202 10.655 75.814 1.00 79.23 ? 650 HIS A CG 1 ATOM 2701 N ND1 . HIS A 1 350 ? 6.143 10.528 76.813 1.00 89.24 ? 650 HIS A ND1 1 ATOM 2702 C CD2 . HIS A 1 350 ? 4.134 11.267 76.379 1.00 83.93 ? 650 HIS A CD2 1 ATOM 2703 C CE1 . HIS A 1 350 ? 5.664 11.037 77.934 1.00 88.90 ? 650 HIS A CE1 1 ATOM 2704 N NE2 . HIS A 1 350 ? 4.447 11.493 77.698 1.00 96.37 ? 650 HIS A NE2 1 ATOM 2705 N N . ILE A 1 351 ? 7.816 8.413 74.735 1.00 62.38 ? 651 ILE A N 1 ATOM 2706 C CA . ILE A 1 351 ? 9.000 7.939 75.426 1.00 64.13 ? 651 ILE A CA 1 ATOM 2707 C C . ILE A 1 351 ? 10.001 9.065 75.455 1.00 65.82 ? 651 ILE A C 1 ATOM 2708 O O . ILE A 1 351 ? 10.247 9.709 74.438 1.00 64.06 ? 651 ILE A O 1 ATOM 2709 C CB . ILE A 1 351 ? 9.632 6.766 74.686 1.00 59.72 ? 651 ILE A CB 1 ATOM 2710 C CG1 . ILE A 1 351 ? 8.637 5.613 74.604 1.00 59.01 ? 651 ILE A CG1 1 ATOM 2711 C CG2 . ILE A 1 351 ? 10.925 6.336 75.369 1.00 61.65 ? 651 ILE A CG2 1 ATOM 2712 C CD1 . ILE A 1 351 ? 8.921 4.668 73.490 1.00 53.75 ? 651 ILE A CD1 1 ATOM 2713 N N . ILE A 1 352 ? 10.578 9.309 76.622 1.00 70.82 ? 652 ILE A N 1 ATOM 2714 C CA . ILE A 1 352 ? 11.571 10.359 76.750 1.00 71.43 ? 652 ILE A CA 1 ATOM 2715 C C . ILE A 1 352 ? 12.970 9.786 76.930 1.00 71.56 ? 652 ILE A C 1 ATOM 2716 O O . ILE A 1 352 ? 13.276 9.157 77.942 1.00 74.66 ? 652 ILE A O 1 ATOM 2717 C CB . ILE A 1 352 ? 11.240 11.305 77.907 1.00 72.72 ? 652 ILE A CB 1 ATOM 2718 C CG1 . ILE A 1 352 ? 9.844 11.897 77.704 1.00 72.39 ? 652 ILE A CG1 1 ATOM 2719 C CG2 . ILE A 1 352 ? 12.289 12.400 78.002 1.00 75.36 ? 652 ILE A CG2 1 ATOM 2720 C CD1 . ILE A 1 352 ? 9.274 12.566 78.930 1.00 66.75 ? 652 ILE A CD1 1 ATOM 2721 N N . LEU A 1 353 ? 13.807 9.992 75.921 1.00 72.13 ? 653 LEU A N 1 ATOM 2722 C CA . LEU A 1 353 ? 15.216 9.652 76.010 1.00 72.75 ? 653 LEU A CA 1 ATOM 2723 C C . LEU A 1 353 ? 15.910 10.816 76.707 1.00 75.82 ? 653 LEU A C 1 ATOM 2724 O O . LEU A 1 353 ? 15.563 11.975 76.470 1.00 72.47 ? 653 LEU A O 1 ATOM 2725 C CB . LEU A 1 353 ? 15.794 9.428 74.612 1.00 68.73 ? 653 LEU A CB 1 ATOM 2726 C CG . LEU A 1 353 ? 15.012 8.450 73.728 1.00 64.81 ? 653 LEU A CG 1 ATOM 2727 C CD1 . LEU A 1 353 ? 15.515 8.471 72.283 1.00 61.44 ? 653 LEU A CD1 1 ATOM 2728 C CD2 . LEU A 1 353 ? 15.073 7.042 74.307 1.00 67.61 ? 653 LEU A CD2 1 ATOM 2729 N N . GLU A 1 354 ? 16.871 10.512 77.575 1.00 80.89 ? 654 GLU A N 1 ATOM 2730 C CA . GLU A 1 354 ? 17.513 11.544 78.389 1.00 83.66 ? 654 GLU A CA 1 ATOM 2731 C C . GLU A 1 354 ? 19.040 11.444 78.389 1.00 79.19 ? 654 GLU A C 1 ATOM 2732 O O . GLU A 1 354 ? 19.608 10.467 77.899 1.00 76.33 ? 654 GLU A O 1 ATOM 2733 C CB . GLU A 1 354 ? 16.975 11.505 79.825 1.00 88.76 ? 654 GLU A CB 1 ATOM 2734 C CG . GLU A 1 354 ? 15.542 12.009 79.966 1.00 88.85 ? 654 GLU A CG 1 ATOM 2735 C CD . GLU A 1 354 ? 14.989 11.854 81.375 1.00 103.35 ? 654 GLU A CD 1 ATOM 2736 O OE1 . GLU A 1 354 ? 15.358 10.879 82.065 1.00 97.30 ? 654 GLU A OE1 1 ATOM 2737 O OE2 . GLU A 1 354 ? 14.174 12.706 81.789 1.00 104.37 ? 654 GLU A OE2 1 ATOM 2738 N N . HIS A 1 355 ? 19.691 12.466 78.942 1.00 80.08 ? 655 HIS A N 1 ATOM 2739 C CA . HIS A 1 355 ? 21.151 12.520 79.021 1.00 79.88 ? 655 HIS A CA 1 ATOM 2740 C C . HIS A 1 355 ? 21.805 12.418 77.650 1.00 74.99 ? 655 HIS A C 1 ATOM 2741 O O . HIS A 1 355 ? 22.507 11.454 77.347 1.00 74.01 ? 655 HIS A O 1 ATOM 2742 C CB . HIS A 1 355 ? 21.692 11.431 79.948 1.00 86.39 ? 655 HIS A CB 1 ATOM 2743 C CG . HIS A 1 355 ? 21.093 11.457 81.320 1.00 84.88 ? 655 HIS A CG 1 ATOM 2744 N ND1 . HIS A 1 355 ? 21.096 12.584 82.109 1.00 92.91 ? 655 HIS A ND1 1 ATOM 2745 C CD2 . HIS A 1 355 ? 20.478 10.488 82.040 1.00 80.96 ? 655 HIS A CD2 1 ATOM 2746 C CE1 . HIS A 1 355 ? 20.502 12.312 83.260 1.00 103.00 ? 655 HIS A CE1 1 ATOM 2747 N NE2 . HIS A 1 355 ? 20.118 11.050 83.242 1.00 89.28 ? 655 HIS A NE2 1 ATOM 2748 N N . LEU A 1 356 ? 21.568 13.423 76.821 1.00 73.65 ? 656 LEU A N 1 ATOM 2749 C CA . LEU A 1 356 ? 22.134 13.447 75.485 1.00 70.89 ? 656 LEU A CA 1 ATOM 2750 C C . LEU A 1 356 ? 23.134 14.596 75.390 1.00 71.76 ? 656 LEU A C 1 ATOM 2751 O O . LEU A 1 356 ? 23.312 15.350 76.344 1.00 74.61 ? 656 LEU A O 1 ATOM 2752 C CB . LEU A 1 356 ? 21.019 13.589 74.442 1.00 69.28 ? 656 LEU A CB 1 ATOM 2753 C CG . LEU A 1 356 ? 19.890 12.546 74.509 1.00 65.84 ? 656 LEU A CG 1 ATOM 2754 C CD1 . LEU A 1 356 ? 18.740 12.881 73.552 1.00 61.39 ? 656 LEU A CD1 1 ATOM 2755 C CD2 . LEU A 1 356 ? 20.418 11.134 74.249 1.00 63.95 ? 656 LEU A CD2 1 ATOM 2756 N N . GLN A 1 357 ? 23.801 14.714 74.248 1.00 69.42 ? 657 GLN A N 1 ATOM 2757 C CA . GLN A 1 357 ? 24.718 15.821 74.020 1.00 70.39 ? 657 GLN A CA 1 ATOM 2758 C C . GLN A 1 357 ? 24.085 16.808 73.046 1.00 70.47 ? 657 GLN A C 1 ATOM 2759 O O . GLN A 1 357 ? 23.332 16.411 72.160 1.00 66.97 ? 657 GLN A O 1 ATOM 2760 C CB . GLN A 1 357 ? 26.048 15.309 73.466 1.00 68.45 ? 657 GLN A CB 1 ATOM 2761 C CG . GLN A 1 357 ? 26.515 13.999 74.088 1.00 73.69 ? 657 GLN A CG 1 ATOM 2762 C CD . GLN A 1 357 ? 26.606 14.064 75.602 1.00 78.85 ? 657 GLN A CD 1 ATOM 2763 O OE1 . GLN A 1 357 ? 27.028 15.073 76.169 1.00 76.79 ? 657 GLN A OE1 1 ATOM 2764 N NE2 . GLN A 1 357 ? 26.213 12.980 76.265 1.00 78.42 ? 657 GLN A NE2 1 ATOM 2765 N N . TRP A 1 358 ? 24.383 18.091 73.218 1.00 71.44 ? 658 TRP A N 1 ATOM 2766 C CA . TRP A 1 358 ? 23.902 19.116 72.295 1.00 75.08 ? 658 TRP A CA 1 ATOM 2767 C C . TRP A 1 358 ? 24.542 18.951 70.919 1.00 67.95 ? 658 TRP A C 1 ATOM 2768 O O . TRP A 1 358 ? 25.657 18.434 70.802 1.00 68.80 ? 658 TRP A O 1 ATOM 2769 C CB . TRP A 1 358 ? 24.201 20.517 72.838 1.00 93.53 ? 658 TRP A CB 1 ATOM 2770 C CG . TRP A 1 358 ? 23.406 20.886 74.057 1.00 83.56 ? 658 TRP A CG 1 ATOM 2771 C CD1 . TRP A 1 358 ? 23.856 20.949 75.345 1.00 86.38 ? 658 TRP A CD1 1 ATOM 2772 C CD2 . TRP A 1 358 ? 22.020 21.246 74.097 1.00 86.42 ? 658 TRP A CD2 1 ATOM 2773 N NE1 . TRP A 1 358 ? 22.835 21.327 76.184 1.00 89.71 ? 658 TRP A NE1 1 ATOM 2774 C CE2 . TRP A 1 358 ? 21.698 21.513 75.443 1.00 87.23 ? 658 TRP A CE2 1 ATOM 2775 C CE3 . TRP A 1 358 ? 21.022 21.365 73.127 1.00 79.49 ? 658 TRP A CE3 1 ATOM 2776 C CZ2 . TRP A 1 358 ? 20.418 21.892 75.840 1.00 86.55 ? 658 TRP A CZ2 1 ATOM 2777 C CZ3 . TRP A 1 358 ? 19.755 21.743 73.522 1.00 78.42 ? 658 TRP A CZ3 1 ATOM 2778 C CH2 . TRP A 1 358 ? 19.463 22.002 74.867 1.00 83.57 ? 658 TRP A CH2 1 ATOM 2779 N N . THR A 1 359 ? 23.828 19.383 69.882 1.00 69.21 ? 659 THR A N 1 ATOM 2780 C CA . THR A 1 359 ? 24.356 19.385 68.517 1.00 65.42 ? 659 THR A CA 1 ATOM 2781 C C . THR A 1 359 ? 24.659 17.974 67.992 1.00 61.48 ? 659 THR A C 1 ATOM 2782 O O . THR A 1 359 ? 25.299 17.810 66.953 1.00 57.09 ? 659 THR A O 1 ATOM 2783 C CB . THR A 1 359 ? 25.624 20.272 68.406 1.00 67.82 ? 659 THR A CB 1 ATOM 2784 O OG1 . THR A 1 359 ? 25.434 21.481 69.152 1.00 77.29 ? 659 THR A OG1 1 ATOM 2785 C CG2 . THR A 1 359 ? 25.914 20.623 66.953 1.00 65.84 ? 659 THR A CG2 1 ATOM 2786 N N . MET A 1 360 ? 24.189 16.959 68.711 1.00 59.55 ? 660 MET A N 1 ATOM 2787 C CA . MET A 1 360 ? 24.464 15.573 68.344 1.00 59.84 ? 660 MET A CA 1 ATOM 2788 C C . MET A 1 360 ? 23.267 14.901 67.661 1.00 56.57 ? 660 MET A C 1 ATOM 2789 O O . MET A 1 360 ? 22.116 15.249 67.918 1.00 55.89 ? 660 MET A O 1 ATOM 2790 C CB . MET A 1 360 ? 24.897 14.771 69.575 1.00 61.87 ? 660 MET A CB 1 ATOM 2791 C CG . MET A 1 360 ? 25.400 13.373 69.254 1.00 61.04 ? 660 MET A CG 1 ATOM 2792 S SD . MET A 1 360 ? 26.775 13.385 68.083 1.00 72.53 ? 660 MET A SD 1 ATOM 2793 C CE . MET A 1 360 ? 28.011 14.269 69.035 1.00 54.99 ? 660 MET A CE 1 ATOM 2794 N N . GLY A 1 361 ? 23.555 13.941 66.785 1.00 54.58 ? 661 GLY A N 1 ATOM 2795 C CA . GLY A 1 361 ? 22.529 13.195 66.078 1.00 56.91 ? 661 GLY A CA 1 ATOM 2796 C C . GLY A 1 361 ? 22.441 11.758 66.563 1.00 57.02 ? 661 GLY A C 1 ATOM 2797 O O . GLY A 1 361 ? 23.462 11.121 66.841 1.00 59.59 ? 661 GLY A O 1 ATOM 2798 N N . TYR A 1 362 ? 21.219 11.242 66.657 1.00 54.82 ? 662 TYR A N 1 ATOM 2799 C CA . TYR A 1 362 ? 21.003 9.924 67.239 1.00 55.75 ? 662 TYR A CA 1 ATOM 2800 C C . TYR A 1 362 ? 20.367 8.903 66.305 1.00 57.52 ? 662 TYR A C 1 ATOM 2801 O O . TYR A 1 362 ? 19.603 9.251 65.408 1.00 49.62 ? 662 TYR A O 1 ATOM 2802 C CB . TYR A 1 362 ? 20.196 10.048 68.530 1.00 53.56 ? 662 TYR A CB 1 ATOM 2803 C CG . TYR A 1 362 ? 20.984 10.740 69.609 1.00 57.51 ? 662 TYR A CG 1 ATOM 2804 C CD1 . TYR A 1 362 ? 21.958 10.056 70.320 1.00 59.62 ? 662 TYR A CD1 1 ATOM 2805 C CD2 . TYR A 1 362 ? 20.785 12.082 69.891 1.00 57.42 ? 662 TYR A CD2 1 ATOM 2806 C CE1 . TYR A 1 362 ? 22.694 10.679 71.296 1.00 58.09 ? 662 TYR A CE1 1 ATOM 2807 C CE2 . TYR A 1 362 ? 21.519 12.716 70.867 1.00 59.63 ? 662 TYR A CE2 1 ATOM 2808 C CZ . TYR A 1 362 ? 22.474 12.008 71.567 1.00 61.22 ? 662 TYR A CZ 1 ATOM 2809 O OH . TYR A 1 362 ? 23.215 12.627 72.543 1.00 61.91 ? 662 TYR A OH 1 ATOM 2810 N N . GLU A 1 363 ? 20.709 7.640 66.538 1.00 62.46 ? 663 GLU A N 1 ATOM 2811 C CA . GLU A 1 363 ? 20.164 6.511 65.799 1.00 65.20 ? 663 GLU A CA 1 ATOM 2812 C C . GLU A 1 363 ? 19.215 5.765 66.734 1.00 62.96 ? 663 GLU A C 1 ATOM 2813 O O . GLU A 1 363 ? 19.554 5.514 67.890 1.00 63.40 ? 663 GLU A O 1 ATOM 2814 C CB . GLU A 1 363 ? 21.306 5.595 65.343 1.00 73.52 ? 663 GLU A CB 1 ATOM 2815 C CG . GLU A 1 363 ? 20.943 4.592 64.257 1.00 88.41 ? 663 GLU A CG 1 ATOM 2816 C CD . GLU A 1 363 ? 22.165 3.899 63.674 1.00 99.30 ? 663 GLU A CD 1 ATOM 2817 O OE1 . GLU A 1 363 ? 23.299 4.334 63.971 1.00 99.05 ? 663 GLU A OE1 1 ATOM 2818 O OE2 . GLU A 1 363 ? 21.992 2.921 62.917 1.00 102.31 ? 663 GLU A OE2 1 ATOM 2819 N N . VAL A 1 364 ? 18.024 5.429 66.244 1.00 61.57 ? 664 VAL A N 1 ATOM 2820 C CA . VAL A 1 364 ? 16.991 4.839 67.093 1.00 59.21 ? 664 VAL A CA 1 ATOM 2821 C C . VAL A 1 364 ? 16.249 3.697 66.403 1.00 59.84 ? 664 VAL A C 1 ATOM 2822 O O . VAL A 1 364 ? 15.948 3.766 65.209 1.00 58.50 ? 664 VAL A O 1 ATOM 2823 C CB . VAL A 1 364 ? 15.955 5.900 67.536 1.00 55.98 ? 664 VAL A CB 1 ATOM 2824 C CG1 . VAL A 1 364 ? 14.956 5.301 68.496 1.00 57.72 ? 664 VAL A CG1 1 ATOM 2825 C CG2 . VAL A 1 364 ? 16.646 7.101 68.167 1.00 56.74 ? 664 VAL A CG2 1 ATOM 2826 N N . GLN A 1 365 ? 15.959 2.646 67.163 1.00 60.14 ? 665 GLN A N 1 ATOM 2827 C CA . GLN A 1 365 ? 15.142 1.545 66.674 1.00 60.15 ? 665 GLN A CA 1 ATOM 2828 C C . GLN A 1 365 ? 14.028 1.242 67.673 1.00 59.06 ? 665 GLN A C 1 ATOM 2829 O O . GLN A 1 365 ? 14.282 1.108 68.873 1.00 56.40 ? 665 GLN A O 1 ATOM 2830 C CB . GLN A 1 365 ? 15.999 0.302 66.413 1.00 61.58 ? 665 GLN A CB 1 ATOM 2831 C CG . GLN A 1 365 ? 16.975 0.465 65.251 1.00 61.95 ? 665 GLN A CG 1 ATOM 2832 C CD . GLN A 1 365 ? 17.756 -0.801 64.942 1.00 68.91 ? 665 GLN A CD 1 ATOM 2833 O OE1 . GLN A 1 365 ? 17.479 -1.867 65.492 1.00 68.62 ? 665 GLN A OE1 1 ATOM 2834 N NE2 . GLN A 1 365 ? 18.739 -0.687 64.055 1.00 74.84 ? 665 GLN A NE2 1 ATOM 2835 N N . ILE A 1 366 ? 12.794 1.159 67.177 1.00 59.93 ? 666 ILE A N 1 ATOM 2836 C CA . ILE A 1 366 ? 11.642 0.905 68.036 1.00 57.34 ? 666 ILE A CA 1 ATOM 2837 C C . ILE A 1 366 ? 10.987 -0.410 67.660 1.00 53.78 ? 666 ILE A C 1 ATOM 2838 O O . ILE A 1 366 ? 10.808 -0.714 66.481 1.00 54.80 ? 666 ILE A O 1 ATOM 2839 C CB . ILE A 1 366 ? 10.582 2.019 67.934 1.00 56.25 ? 666 ILE A CB 1 ATOM 2840 C CG1 . ILE A 1 366 ? 11.244 3.364 67.648 1.00 61.75 ? 666 ILE A CG1 1 ATOM 2841 C CG2 . ILE A 1 366 ? 9.737 2.085 69.213 1.00 50.11 ? 666 ILE A CG2 1 ATOM 2842 C CD1 . ILE A 1 366 ? 12.001 3.926 68.820 1.00 68.35 ? 666 ILE A CD1 1 ATOM 2843 N N . THR A 1 367 ? 10.639 -1.192 68.673 1.00 54.21 ? 667 THR A N 1 ATOM 2844 C CA . THR A 1 367 ? 9.928 -2.439 68.459 1.00 52.36 ? 667 THR A CA 1 ATOM 2845 C C . THR A 1 367 ? 8.669 -2.451 69.317 1.00 50.19 ? 667 THR A C 1 ATOM 2846 O O . THR A 1 367 ? 8.652 -1.908 70.417 1.00 50.62 ? 667 THR A O 1 ATOM 2847 C CB . THR A 1 367 ? 10.808 -3.663 68.783 1.00 55.29 ? 667 THR A CB 1 ATOM 2848 O OG1 . THR A 1 367 ? 12.003 -3.614 67.994 1.00 54.71 ? 667 THR A OG1 1 ATOM 2849 C CG2 . THR A 1 367 ? 10.065 -4.954 68.469 1.00 55.27 ? 667 THR A CG2 1 ATOM 2850 N N . ALA A 1 368 ? 7.605 -3.041 68.786 1.00 50.96 ? 668 ALA A N 1 ATOM 2851 C CA . ALA A 1 368 ? 6.375 -3.234 69.535 1.00 51.17 ? 668 ALA A CA 1 ATOM 2852 C C . ALA A 1 368 ? 6.225 -4.727 69.789 1.00 50.60 ? 668 ALA A C 1 ATOM 2853 O O . ALA A 1 368 ? 6.626 -5.545 68.960 1.00 50.60 ? 668 ALA A O 1 ATOM 2854 C CB . ALA A 1 368 ? 5.181 -2.695 68.753 1.00 45.44 ? 668 ALA A CB 1 ATOM 2855 N N . ALA A 1 369 ? 5.663 -5.086 70.938 1.00 52.18 ? 669 ALA A N 1 ATOM 2856 C CA . ALA A 1 369 ? 5.499 -6.496 71.280 1.00 56.63 ? 669 ALA A CA 1 ATOM 2857 C C . ALA A 1 369 ? 4.082 -6.833 71.724 1.00 55.54 ? 669 ALA A C 1 ATOM 2858 O O . ALA A 1 369 ? 3.411 -6.025 72.380 1.00 56.59 ? 669 ALA A O 1 ATOM 2859 C CB . ALA A 1 369 ? 6.489 -6.898 72.348 1.00 60.88 ? 669 ALA A CB 1 ATOM 2860 N N . ASN A 1 370 ? 3.634 -8.028 71.341 1.00 57.10 ? 670 ASN A N 1 ATOM 2861 C CA . ASN A 1 370 ? 2.398 -8.609 71.859 1.00 59.54 ? 670 ASN A CA 1 ATOM 2862 C C . ASN A 1 370 ? 2.640 -10.054 72.301 1.00 58.32 ? 670 ASN A C 1 ATOM 2863 O O . ASN A 1 370 ? 3.761 -10.558 72.176 1.00 57.87 ? 670 ASN A O 1 ATOM 2864 C CB . ASN A 1 370 ? 1.263 -8.517 70.833 1.00 57.45 ? 670 ASN A CB 1 ATOM 2865 C CG . ASN A 1 370 ? 1.542 -9.312 69.567 1.00 52.46 ? 670 ASN A CG 1 ATOM 2866 O OD1 . ASN A 1 370 ? 2.326 -10.263 69.567 1.00 50.66 ? 670 ASN A OD1 1 ATOM 2867 N ND2 . ASN A 1 370 ? 0.887 -8.928 68.480 1.00 54.48 ? 670 ASN A ND2 1 ATOM 2868 N N . ARG A 1 371 ? 1.599 -10.715 72.808 1.00 60.88 ? 671 ARG A N 1 ATOM 2869 C CA B ARG A 1 371 ? 1.718 -12.084 73.312 0.55 61.10 ? 671 ARG A CA 1 ATOM 2870 C CA C ARG A 1 371 ? 1.723 -12.081 73.314 0.45 60.98 ? 671 ARG A CA 1 ATOM 2871 C C . ARG A 1 371 ? 2.339 -13.029 72.286 1.00 57.22 ? 671 ARG A C 1 ATOM 2872 O O . ARG A 1 371 ? 2.709 -14.158 72.608 1.00 58.71 ? 671 ARG A O 1 ATOM 2873 C CB B ARG A 1 371 ? 0.352 -12.624 73.751 0.55 60.47 ? 671 ARG A CB 1 ATOM 2874 C CB C ARG A 1 371 ? 0.365 -12.613 73.793 0.45 58.45 ? 671 ARG A CB 1 ATOM 2875 C CG B ARG A 1 371 ? -0.557 -13.013 72.593 0.55 55.99 ? 671 ARG A CG 1 ATOM 2876 C CG C ARG A 1 371 ? -0.741 -12.591 72.742 0.45 55.84 ? 671 ARG A CG 1 ATOM 2877 C CD B ARG A 1 371 ? -1.734 -13.868 73.043 0.55 54.89 ? 671 ARG A CD 1 ATOM 2878 C CD C ARG A 1 371 ? -2.005 -13.282 73.247 0.45 54.84 ? 671 ARG A CD 1 ATOM 2879 N NE B ARG A 1 371 ? -2.510 -14.336 71.897 0.55 52.44 ? 671 ARG A NE 1 ATOM 2880 N NE C ARG A 1 371 ? -3.061 -13.321 72.236 0.45 53.90 ? 671 ARG A NE 1 ATOM 2881 C CZ B ARG A 1 371 ? -2.253 -15.455 71.229 0.55 51.44 ? 671 ARG A CZ 1 ATOM 2882 C CZ C ARG A 1 371 ? -4.177 -12.600 72.287 0.45 53.22 ? 671 ARG A CZ 1 ATOM 2883 N NH1 B ARG A 1 371 ? -1.246 -16.233 71.601 0.55 50.86 ? 671 ARG A NH1 1 ATOM 2884 N NH1 C ARG A 1 371 ? -4.395 -11.783 73.309 0.45 54.51 ? 671 ARG A NH1 1 ATOM 2885 N NH2 B ARG A 1 371 ? -3.004 -15.797 70.191 0.55 51.43 ? 671 ARG A NH2 1 ATOM 2886 N NH2 C ARG A 1 371 ? -5.080 -12.700 71.319 0.45 53.02 ? 671 ARG A NH2 1 ATOM 2887 N N . LEU A 1 372 ? 2.454 -12.567 71.048 1.00 57.80 ? 672 LEU A N 1 ATOM 2888 C CA . LEU A 1 372 ? 3.017 -13.393 69.992 1.00 59.61 ? 672 LEU A CA 1 ATOM 2889 C C . LEU A 1 372 ? 4.495 -13.115 69.738 1.00 61.18 ? 672 LEU A C 1 ATOM 2890 O O . LEU A 1 372 ? 5.214 -13.974 69.230 1.00 62.50 ? 672 LEU A O 1 ATOM 2891 C CB . LEU A 1 372 ? 2.213 -13.230 68.703 1.00 58.11 ? 672 LEU A CB 1 ATOM 2892 C CG . LEU A 1 372 ? 0.843 -13.910 68.717 1.00 55.93 ? 672 LEU A CG 1 ATOM 2893 C CD1 . LEU A 1 372 ? 0.122 -13.637 67.423 1.00 52.96 ? 672 LEU A CD1 1 ATOM 2894 C CD2 . LEU A 1 372 ? 0.996 -15.405 68.941 1.00 51.87 ? 672 LEU A CD2 1 ATOM 2895 N N . GLY A 1 373 ? 4.946 -11.916 70.084 1.00 61.19 ? 673 GLY A N 1 ATOM 2896 C CA . GLY A 1 373 ? 6.340 -11.569 69.887 1.00 63.15 ? 673 GLY A CA 1 ATOM 2897 C C . GLY A 1 373 ? 6.596 -10.135 69.462 1.00 57.84 ? 673 GLY A C 1 ATOM 2898 O O . GLY A 1 373 ? 5.789 -9.236 69.709 1.00 52.20 ? 673 GLY A O 1 ATOM 2899 N N . TYR A 1 374 ? 7.737 -9.927 68.815 1.00 61.90 ? 674 TYR A N 1 ATOM 2900 C CA . TYR A 1 374 ? 8.188 -8.584 68.491 1.00 59.09 ? 674 TYR A CA 1 ATOM 2901 C C . TYR A 1 374 ? 7.980 -8.263 67.031 1.00 55.87 ? 674 TYR A C 1 ATOM 2902 O O . TYR A 1 374 ? 7.982 -9.148 66.175 1.00 52.99 ? 674 TYR A O 1 ATOM 2903 C CB . TYR A 1 374 ? 9.670 -8.409 68.826 1.00 60.03 ? 674 TYR A CB 1 ATOM 2904 C CG . TYR A 1 374 ? 9.982 -8.484 70.297 1.00 69.34 ? 674 TYR A CG 1 ATOM 2905 C CD1 . TYR A 1 374 ? 9.441 -7.568 71.185 1.00 69.99 ? 674 TYR A CD1 1 ATOM 2906 C CD2 . TYR A 1 374 ? 10.836 -9.459 70.799 1.00 76.17 ? 674 TYR A CD2 1 ATOM 2907 C CE1 . TYR A 1 374 ? 9.727 -7.628 72.538 1.00 77.87 ? 674 TYR A CE1 1 ATOM 2908 C CE2 . TYR A 1 374 ? 11.132 -9.524 72.150 1.00 80.11 ? 674 TYR A CE2 1 ATOM 2909 C CZ . TYR A 1 374 ? 10.575 -8.605 73.016 1.00 82.35 ? 674 TYR A CZ 1 ATOM 2910 O OH . TYR A 1 374 ? 10.862 -8.661 74.363 1.00 90.58 ? 674 TYR A OH 1 ATOM 2911 N N . SER A 1 375 ? 7.816 -6.976 66.756 1.00 54.94 ? 675 SER A N 1 ATOM 2912 C CA . SER A 1 375 ? 7.737 -6.499 65.393 1.00 55.68 ? 675 SER A CA 1 ATOM 2913 C C . SER A 1 375 ? 9.140 -6.392 64.834 1.00 58.04 ? 675 SER A C 1 ATOM 2914 O O . SER A 1 375 ? 10.129 -6.501 65.560 1.00 56.33 ? 675 SER A O 1 ATOM 2915 C CB . SER A 1 375 ? 7.070 -5.121 65.350 1.00 51.61 ? 675 SER A CB 1 ATOM 2916 O OG . SER A 1 375 ? 7.873 -4.136 65.984 1.00 47.10 ? 675 SER A OG 1 ATOM 2917 N N . GLU A 1 376 ? 9.226 -6.184 63.533 1.00 61.56 ? 676 GLU A N 1 ATOM 2918 C CA . GLU A 1 376 ? 10.470 -5.752 62.950 1.00 62.73 ? 676 GLU A CA 1 ATOM 2919 C C . GLU A 1 376 ? 10.677 -4.336 63.467 1.00 59.54 ? 676 GLU A C 1 ATOM 2920 O O . GLU A 1 376 ? 9.710 -3.591 63.614 1.00 54.03 ? 676 GLU A O 1 ATOM 2921 C CB . GLU A 1 376 ? 10.364 -5.795 61.430 1.00 64.93 ? 676 GLU A CB 1 ATOM 2922 C CG . GLU A 1 376 ? 10.012 -7.184 60.911 1.00 76.07 ? 676 GLU A CG 1 ATOM 2923 C CD . GLU A 1 376 ? 10.912 -8.274 61.488 1.00 87.43 ? 676 GLU A CD 1 ATOM 2924 O OE1 . GLU A 1 376 ? 12.151 -8.143 61.385 1.00 75.96 ? 676 GLU A OE1 1 ATOM 2925 O OE2 . GLU A 1 376 ? 10.380 -9.266 62.036 1.00 80.86 ? 676 GLU A OE2 1 ATOM 2926 N N . PRO A 1 377 ? 11.931 -3.974 63.784 1.00 65.76 ? 677 PRO A N 1 ATOM 2927 C CA . PRO A 1 377 ? 12.259 -2.655 64.345 1.00 60.64 ? 677 PRO A CA 1 ATOM 2928 C C . PRO A 1 377 ? 11.997 -1.530 63.350 1.00 55.74 ? 677 PRO A C 1 ATOM 2929 O O . PRO A 1 377 ? 12.169 -1.741 62.149 1.00 52.74 ? 677 PRO A O 1 ATOM 2930 C CB . PRO A 1 377 ? 13.765 -2.752 64.620 1.00 60.58 ? 677 PRO A CB 1 ATOM 2931 C CG . PRO A 1 377 ? 14.069 -4.215 64.639 1.00 59.12 ? 677 PRO A CG 1 ATOM 2932 C CD . PRO A 1 377 ? 13.115 -4.840 63.677 1.00 63.18 ? 677 PRO A CD 1 ATOM 2933 N N . THR A 1 378 ? 11.582 -0.363 63.839 1.00 54.95 ? 678 THR A N 1 ATOM 2934 C CA . THR A 1 378 ? 11.440 0.819 62.988 1.00 53.64 ? 678 THR A CA 1 ATOM 2935 C C . THR A 1 378 ? 12.598 1.771 63.217 1.00 56.77 ? 678 THR A C 1 ATOM 2936 O O . THR A 1 378 ? 12.846 2.196 64.348 1.00 56.16 ? 678 THR A O 1 ATOM 2937 C CB . THR A 1 378 ? 10.145 1.591 63.262 1.00 47.55 ? 678 THR A CB 1 ATOM 2938 O OG1 . THR A 1 378 ? 9.057 0.939 62.604 1.00 52.44 ? 678 THR A OG1 1 ATOM 2939 C CG2 . THR A 1 378 ? 10.264 3.015 62.734 1.00 45.95 ? 678 THR A CG2 1 ATOM 2940 N N . VAL A 1 379 ? 13.298 2.111 62.140 1.00 56.92 ? 679 VAL A N 1 ATOM 2941 C CA . VAL A 1 379 ? 14.464 2.975 62.247 1.00 57.41 ? 679 VAL A CA 1 ATOM 2942 C C . VAL A 1 379 ? 14.074 4.449 62.237 1.00 55.28 ? 679 VAL A C 1 ATOM 2943 O O . VAL A 1 379 ? 13.252 4.889 61.429 1.00 55.59 ? 679 VAL A O 1 ATOM 2944 C CB . VAL A 1 379 ? 15.501 2.676 61.150 1.00 59.55 ? 679 VAL A CB 1 ATOM 2945 C CG1 . VAL A 1 379 ? 16.749 3.521 61.356 1.00 58.90 ? 679 VAL A CG1 1 ATOM 2946 C CG2 . VAL A 1 379 ? 15.857 1.196 61.166 1.00 57.38 ? 679 VAL A CG2 1 ATOM 2947 N N . TYR A 1 380 ? 14.659 5.201 63.160 1.00 54.04 ? 680 TYR A N 1 ATOM 2948 C CA . TYR A 1 380 ? 14.385 6.624 63.278 1.00 51.52 ? 680 TYR A CA 1 ATOM 2949 C C . TYR A 1 380 ? 15.627 7.333 63.792 1.00 54.46 ? 680 TYR A C 1 ATOM 2950 O O . TYR A 1 380 ? 16.305 6.836 64.689 1.00 56.77 ? 680 TYR A O 1 ATOM 2951 C CB . TYR A 1 380 ? 13.209 6.857 64.228 1.00 52.70 ? 680 TYR A CB 1 ATOM 2952 C CG . TYR A 1 380 ? 12.993 8.301 64.624 1.00 50.55 ? 680 TYR A CG 1 ATOM 2953 C CD1 . TYR A 1 380 ? 13.529 8.812 65.807 1.00 50.29 ? 680 TYR A CD1 1 ATOM 2954 C CD2 . TYR A 1 380 ? 12.246 9.152 63.823 1.00 46.79 ? 680 TYR A CD2 1 ATOM 2955 C CE1 . TYR A 1 380 ? 13.330 10.134 66.170 1.00 42.92 ? 680 TYR A CE1 1 ATOM 2956 C CE2 . TYR A 1 380 ? 12.039 10.474 64.179 1.00 50.75 ? 680 TYR A CE2 1 ATOM 2957 C CZ . TYR A 1 380 ? 12.582 10.961 65.350 1.00 49.72 ? 680 TYR A CZ 1 ATOM 2958 O OH . TYR A 1 380 ? 12.371 12.274 65.698 1.00 49.29 ? 680 TYR A OH 1 ATOM 2959 N N . GLU A 1 381 ? 15.929 8.491 63.219 1.00 50.90 ? 681 GLU A N 1 ATOM 2960 C CA . GLU A 1 381 ? 17.088 9.262 63.645 1.00 50.64 ? 681 GLU A CA 1 ATOM 2961 C C . GLU A 1 381 ? 16.711 10.733 63.797 1.00 46.98 ? 681 GLU A C 1 ATOM 2962 O O . GLU A 1 381 ? 15.760 11.197 63.172 1.00 45.78 ? 681 GLU A O 1 ATOM 2963 C CB . GLU A 1 381 ? 18.266 9.061 62.677 1.00 50.85 ? 681 GLU A CB 1 ATOM 2964 C CG . GLU A 1 381 ? 17.878 8.948 61.210 1.00 47.63 ? 681 GLU A CG 1 ATOM 2965 C CD . GLU A 1 381 ? 19.024 8.482 60.316 1.00 52.25 ? 681 GLU A CD 1 ATOM 2966 O OE1 . GLU A 1 381 ? 19.413 9.246 59.414 1.00 51.93 ? 681 GLU A OE1 1 ATOM 2967 O OE2 . GLU A 1 381 ? 19.538 7.359 60.506 1.00 57.23 ? 681 GLU A OE2 1 ATOM 2968 N N . PHE A 1 382 ? 17.439 11.455 64.646 1.00 45.78 ? 682 PHE A N 1 ATOM 2969 C CA . PHE A 1 382 ? 17.136 12.861 64.907 1.00 46.57 ? 682 PHE A CA 1 ATOM 2970 C C . PHE A 1 382 ? 18.382 13.661 65.262 1.00 45.41 ? 682 PHE A C 1 ATOM 2971 O O . PHE A 1 382 ? 19.408 13.093 65.638 1.00 43.63 ? 682 PHE A O 1 ATOM 2972 C CB . PHE A 1 382 ? 16.099 12.996 66.026 1.00 46.95 ? 682 PHE A CB 1 ATOM 2973 C CG . PHE A 1 382 ? 16.602 12.572 67.380 1.00 50.18 ? 682 PHE A CG 1 ATOM 2974 C CD1 . PHE A 1 382 ? 17.045 13.516 68.299 1.00 49.18 ? 682 PHE A CD1 1 ATOM 2975 C CD2 . PHE A 1 382 ? 16.618 11.229 67.740 1.00 52.13 ? 682 PHE A CD2 1 ATOM 2976 C CE1 . PHE A 1 382 ? 17.502 13.127 69.549 1.00 50.80 ? 682 PHE A CE1 1 ATOM 2977 C CE2 . PHE A 1 382 ? 17.073 10.833 68.989 1.00 51.85 ? 682 PHE A CE2 1 ATOM 2978 C CZ . PHE A 1 382 ? 17.516 11.780 69.893 1.00 50.71 ? 682 PHE A CZ 1 ATOM 2979 N N . SER A 1 383 ? 18.287 14.983 65.144 1.00 46.48 ? 683 SER A N 1 ATOM 2980 C CA . SER A 1 383 ? 19.404 15.855 65.490 1.00 48.17 ? 683 SER A CA 1 ATOM 2981 C C . SER A 1 383 ? 19.045 16.765 66.661 1.00 50.82 ? 683 SER A C 1 ATOM 2982 O O . SER A 1 383 ? 18.091 17.538 66.595 1.00 48.67 ? 683 SER A O 1 ATOM 2983 C CB . SER A 1 383 ? 19.842 16.684 64.279 1.00 43.55 ? 683 SER A CB 1 ATOM 2984 O OG . SER A 1 383 ? 19.993 15.870 63.126 1.00 40.29 ? 683 SER A OG 1 ATOM 2985 N N . MET A 1 384 ? 19.809 16.655 67.740 1.00 56.14 ? 684 MET A N 1 ATOM 2986 C CA . MET A 1 384 ? 19.643 17.540 68.884 1.00 55.56 ? 684 MET A CA 1 ATOM 2987 C C . MET A 1 384 ? 20.054 18.964 68.516 1.00 57.14 ? 684 MET A C 1 ATOM 2988 O O . MET A 1 384 ? 20.957 19.166 67.700 1.00 56.32 ? 684 MET A O 1 ATOM 2989 C CB . MET A 1 384 ? 20.463 17.034 70.070 1.00 57.36 ? 684 MET A CB 1 ATOM 2990 C CG . MET A 1 384 ? 19.857 15.826 70.768 1.00 57.19 ? 684 MET A CG 1 ATOM 2991 S SD . MET A 1 384 ? 18.311 16.213 71.625 1.00 62.42 ? 684 MET A SD 1 ATOM 2992 C CE . MET A 1 384 ? 18.919 17.167 73.020 1.00 59.39 ? 684 MET A CE 1 ATOM 2993 N N . PRO A 1 385 ? 19.385 19.962 69.111 1.00 58.74 ? 685 PRO A N 1 ATOM 2994 C CA . PRO A 1 385 ? 19.689 21.359 68.789 1.00 66.25 ? 685 PRO A CA 1 ATOM 2995 C C . PRO A 1 385 ? 21.022 21.778 69.400 1.00 71.59 ? 685 PRO A C 1 ATOM 2996 O O . PRO A 1 385 ? 21.586 21.028 70.196 1.00 70.50 ? 685 PRO A O 1 ATOM 2997 C CB . PRO A 1 385 ? 18.535 22.131 69.452 1.00 67.36 ? 685 PRO A CB 1 ATOM 2998 C CG . PRO A 1 385 ? 17.517 21.092 69.839 1.00 62.03 ? 685 PRO A CG 1 ATOM 2999 C CD . PRO A 1 385 ? 18.304 19.856 70.103 1.00 56.24 ? 685 PRO A CD 1 ATOM 3000 N N . PRO A 1 386 ? 21.530 22.958 69.019 1.00 72.43 ? 686 PRO A N 1 ATOM 3001 C CA . PRO A 1 386 ? 22.724 23.536 69.645 1.00 80.45 ? 686 PRO A CA 1 ATOM 3002 C C . PRO A 1 386 ? 22.481 23.868 71.117 1.00 82.06 ? 686 PRO A C 1 ATOM 3003 O O . PRO A 1 386 ? 21.344 23.793 71.583 1.00 81.42 ? 686 PRO A O 1 ATOM 3004 C CB . PRO A 1 386 ? 22.946 24.821 68.843 1.00 74.60 ? 686 PRO A CB 1 ATOM 3005 C CG . PRO A 1 386 ? 22.306 24.553 67.531 1.00 70.20 ? 686 PRO A CG 1 ATOM 3006 C CD . PRO A 1 386 ? 21.101 23.730 67.842 1.00 69.31 ? 686 PRO A CD 1 ATOM 3007 N N . LYS A 1 387 ? 23.540 24.231 71.834 1.00 86.22 ? 687 LYS A N 1 ATOM 3008 C CA . LYS A 1 387 ? 23.426 24.563 73.251 1.00 89.08 ? 687 LYS A CA 1 ATOM 3009 C C . LYS A 1 387 ? 22.821 25.949 73.461 1.00 88.44 ? 687 LYS A C 1 ATOM 3010 O O . LYS A 1 387 ? 23.155 26.895 72.745 1.00 87.11 ? 687 LYS A O 1 ATOM 3011 C CB . LYS A 1 387 ? 24.792 24.469 73.938 1.00 87.65 ? 687 LYS A CB 1 ATOM 3012 C CG . LYS A 1 387 ? 24.795 24.925 75.389 1.00 90.00 ? 687 LYS A CG 1 ATOM 3013 C CD . LYS A 1 387 ? 26.052 24.468 76.109 1.00 90.51 ? 687 LYS A CD 1 ATOM 3014 C CE . LYS A 1 387 ? 26.147 25.065 77.505 1.00 85.61 ? 687 LYS A CE 1 ATOM 3015 N NZ . LYS A 1 387 ? 26.513 26.509 77.474 1.00 73.88 ? 687 LYS A NZ 1 ATOM 3016 N N . PRO A 1 388 ? 21.914 26.061 74.445 1.00 90.13 ? 688 PRO A N 1 ATOM 3017 C CA . PRO A 1 388 ? 21.235 27.300 74.839 1.00 96.15 ? 688 PRO A CA 1 ATOM 3018 C C . PRO A 1 388 ? 22.127 28.167 75.721 1.00 94.91 ? 688 PRO A C 1 ATOM 3019 O O . PRO A 1 388 ? 23.015 27.635 76.388 1.00 88.88 ? 688 PRO A O 1 ATOM 3020 C CB . PRO A 1 388 ? 20.038 26.798 75.663 1.00 95.66 ? 688 PRO A CB 1 ATOM 3021 C CG . PRO A 1 388 ? 19.992 25.308 75.462 1.00 94.16 ? 688 PRO A CG 1 ATOM 3022 C CD . PRO A 1 388 ? 21.400 24.906 75.194 1.00 89.33 ? 688 PRO A CD 1 ATOM 3023 N N . ASN A 1 389 ? 21.884 29.477 75.729 1.00 96.67 ? 689 ASN A N 1 ATOM 3024 C CA . ASN A 1 389 ? 22.657 30.409 76.548 1.00 90.14 ? 689 ASN A CA 1 ATOM 3025 C C . ASN A 1 389 ? 21.766 31.398 77.301 1.00 85.54 ? 689 ASN A C 1 ATOM 3026 O O . ASN A 1 389 ? 21.273 31.103 78.392 1.00 79.48 ? 689 ASN A O 1 ATOM 3027 C CB . ASN A 1 389 ? 23.669 31.170 75.686 1.00 84.88 ? 689 ASN A CB 1 ATOM 3028 C CG . ASN A 1 389 ? 24.467 30.254 74.772 1.00 92.90 ? 689 ASN A CG 1 ATOM 3029 O OD1 . ASN A 1 389 ? 24.654 30.548 73.591 1.00 94.60 ? 689 ASN A OD1 1 ATOM 3030 N ND2 . ASN A 1 389 ? 24.937 29.137 75.314 1.00 91.75 ? 689 ASN A ND2 1 HETATM 3031 C C1 . NAG B 2 . ? -55.762 -7.170 39.926 1.00 29.01 ? 1690 NAG A C1 1 HETATM 3032 C C2 . NAG B 2 . ? -55.391 -7.069 41.408 1.00 30.30 ? 1690 NAG A C2 1 HETATM 3033 C C3 . NAG B 2 . ? -56.564 -6.571 42.251 1.00 34.79 ? 1690 NAG A C3 1 HETATM 3034 C C4 . NAG B 2 . ? -57.128 -5.293 41.649 1.00 29.53 ? 1690 NAG A C4 1 HETATM 3035 C C5 . NAG B 2 . ? -57.538 -5.589 40.213 1.00 30.70 ? 1690 NAG A C5 1 HETATM 3036 C C6 . NAG B 2 . ? -58.201 -4.395 39.517 1.00 33.79 ? 1690 NAG A C6 1 HETATM 3037 C C7 . NAG B 2 . ? -53.611 -8.619 41.979 1.00 34.65 ? 1690 NAG A C7 1 HETATM 3038 C C8 . NAG B 2 . ? -53.231 -10.063 42.072 1.00 33.87 ? 1690 NAG A C8 1 HETATM 3039 N N2 . NAG B 2 . ? -54.919 -8.354 41.888 1.00 34.57 ? 1690 NAG A N2 1 HETATM 3040 O O3 . NAG B 2 . ? -56.162 -6.327 43.580 1.00 33.43 ? 1690 NAG A O3 1 HETATM 3041 O O4 . NAG B 2 . ? -58.232 -4.867 42.410 1.00 34.82 ? 1690 NAG A O4 1 HETATM 3042 O O5 . NAG B 2 . ? -56.390 -5.977 39.488 1.00 28.80 ? 1690 NAG A O5 1 HETATM 3043 O O6 . NAG B 2 . ? -57.317 -3.290 39.502 1.00 31.90 ? 1690 NAG A O6 1 HETATM 3044 O O7 . NAG B 2 . ? -52.733 -7.757 41.979 1.00 37.30 ? 1690 NAG A O7 1 HETATM 3045 C C1 . NAG C 2 . ? -65.891 -25.783 33.274 1.00 69.89 ? 1691 NAG A C1 1 HETATM 3046 C C2 . NAG C 2 . ? -66.488 -26.076 31.889 1.00 72.72 ? 1691 NAG A C2 1 HETATM 3047 C C3 . NAG C 2 . ? -66.323 -27.522 31.426 1.00 78.04 ? 1691 NAG A C3 1 HETATM 3048 C C4 . NAG C 2 . ? -64.965 -28.087 31.799 1.00 87.22 ? 1691 NAG A C4 1 HETATM 3049 C C5 . NAG C 2 . ? -64.690 -27.837 33.275 1.00 90.78 ? 1691 NAG A C5 1 HETATM 3050 C C6 . NAG C 2 . ? -63.383 -28.494 33.715 1.00 97.52 ? 1691 NAG A C6 1 HETATM 3051 C C7 . NAG C 2 . ? -68.484 -24.941 31.004 1.00 70.37 ? 1691 NAG A C7 1 HETATM 3052 C C8 . NAG C 2 . ? -68.562 -25.421 29.581 1.00 63.71 ? 1691 NAG A C8 1 HETATM 3053 N N2 . NAG C 2 . ? -67.905 -25.749 31.895 1.00 71.05 ? 1691 NAG A N2 1 HETATM 3054 O O3 . NAG C 2 . ? -66.466 -27.599 30.025 1.00 75.12 ? 1691 NAG A O3 1 HETATM 3055 O O4 . NAG C 2 . ? -64.956 -29.472 31.531 1.00 98.88 ? 1691 NAG A O4 1 HETATM 3056 O O5 . NAG C 2 . ? -64.665 -26.447 33.532 1.00 80.40 ? 1691 NAG A O5 1 HETATM 3057 O O6 . NAG C 2 . ? -62.465 -28.521 32.643 1.00 93.63 ? 1691 NAG A O6 1 HETATM 3058 O O7 . NAG C 2 . ? -68.956 -23.848 31.318 1.00 69.39 ? 1691 NAG A O7 1 HETATM 3059 C C1 . NAG D 2 . ? -56.752 -18.689 20.946 1.00 41.85 ? 1692 NAG A C1 1 HETATM 3060 C C2 . NAG D 2 . ? -56.679 -20.150 21.362 1.00 40.12 ? 1692 NAG A C2 1 HETATM 3061 C C3 . NAG D 2 . ? -55.946 -20.954 20.296 1.00 43.95 ? 1692 NAG A C3 1 HETATM 3062 C C4 . NAG D 2 . ? -56.645 -20.758 18.961 1.00 46.12 ? 1692 NAG A C4 1 HETATM 3063 C C5 . NAG D 2 . ? -56.833 -19.277 18.651 1.00 43.49 ? 1692 NAG A C5 1 HETATM 3064 C C6 . NAG D 2 . ? -57.734 -19.098 17.439 1.00 41.97 ? 1692 NAG A C6 1 HETATM 3065 C C7 . NAG D 2 . ? -56.799 -20.541 23.729 1.00 42.45 ? 1692 NAG A C7 1 HETATM 3066 C C8 . NAG D 2 . ? -56.118 -20.467 25.063 1.00 39.25 ? 1692 NAG A C8 1 HETATM 3067 N N2 . NAG D 2 . ? -56.054 -20.262 22.663 1.00 37.10 ? 1692 NAG A N2 1 HETATM 3068 O O3 . NAG D 2 . ? -55.961 -22.327 20.605 1.00 41.56 ? 1692 NAG A O3 1 HETATM 3069 O O4 . NAG D 2 . ? -55.883 -21.365 17.941 1.00 46.26 ? 1692 NAG A O4 1 HETATM 3070 O O5 . NAG D 2 . ? -57.443 -18.595 19.724 1.00 41.13 ? 1692 NAG A O5 1 HETATM 3071 O O6 . NAG D 2 . ? -59.025 -19.524 17.810 1.00 46.09 ? 1692 NAG A O6 1 HETATM 3072 O O7 . NAG D 2 . ? -57.992 -20.838 23.650 1.00 41.51 ? 1692 NAG A O7 1 HETATM 3073 C C1 . NAG E 2 . ? -67.781 15.962 11.595 1.00 61.13 ? 1693 NAG A C1 1 HETATM 3074 C C2 . NAG E 2 . ? -69.080 16.553 12.135 1.00 69.77 ? 1693 NAG A C2 1 HETATM 3075 C C3 . NAG E 2 . ? -69.366 16.122 13.568 1.00 75.90 ? 1693 NAG A C3 1 HETATM 3076 C C4 . NAG E 2 . ? -68.185 16.418 14.484 1.00 73.80 ? 1693 NAG A C4 1 HETATM 3077 C C5 . NAG E 2 . ? -66.874 16.091 13.787 1.00 67.41 ? 1693 NAG A C5 1 HETATM 3078 C C6 . NAG E 2 . ? -65.958 15.379 14.776 1.00 62.07 ? 1693 NAG A C6 1 HETATM 3079 C C7 . NAG E 2 . ? -69.761 18.640 11.176 1.00 80.87 ? 1693 NAG A C7 1 HETATM 3080 C C8 . NAG E 2 . ? -69.838 20.131 11.334 1.00 73.39 ? 1693 NAG A C8 1 HETATM 3081 N N2 . NAG E 2 . ? -69.023 17.996 12.069 1.00 78.07 ? 1693 NAG A N2 1 HETATM 3082 O O3 . NAG E 2 . ? -69.642 14.740 13.591 1.00 86.12 ? 1693 NAG A O3 1 HETATM 3083 O O4 . NAG E 2 . ? -68.173 17.773 14.876 1.00 71.87 ? 1693 NAG A O4 1 HETATM 3084 O O5 . NAG E 2 . ? -67.095 15.287 12.637 1.00 65.94 ? 1693 NAG A O5 1 HETATM 3085 O O6 . NAG E 2 . ? -64.616 15.514 14.364 1.00 57.72 ? 1693 NAG A O6 1 HETATM 3086 O O7 . NAG E 2 . ? -70.351 18.050 10.267 1.00 69.41 ? 1693 NAG A O7 1 HETATM 3087 C C1 . GOL F 3 . ? -32.305 -28.217 39.358 1.00 57.00 ? 1694 GOL A C1 1 HETATM 3088 O O1 . GOL F 3 . ? -32.773 -26.917 39.642 1.00 51.20 ? 1694 GOL A O1 1 HETATM 3089 C C2 . GOL F 3 . ? -33.333 -29.228 39.853 1.00 62.74 ? 1694 GOL A C2 1 HETATM 3090 O O2 . GOL F 3 . ? -33.330 -29.237 41.265 1.00 62.29 ? 1694 GOL A O2 1 HETATM 3091 C C3 . GOL F 3 . ? -34.721 -28.859 39.326 1.00 54.54 ? 1694 GOL A C3 1 HETATM 3092 O O3 . GOL F 3 . ? -34.627 -28.319 38.024 1.00 57.89 ? 1694 GOL A O3 1 HETATM 3093 CA CA . CA G 4 . ? -34.796 -26.023 38.699 1.00 45.17 ? 1695 CA A CA 1 HETATM 3094 O O . HOH H 5 . ? -54.784 -1.302 36.182 1.00 43.05 ? 2001 HOH A O 1 HETATM 3095 O O . HOH H 5 . ? -73.567 32.393 1.480 1.00 68.16 ? 2002 HOH A O 1 HETATM 3096 O O . HOH H 5 . ? -75.461 19.216 2.211 1.00 52.87 ? 2003 HOH A O 1 HETATM 3097 O O . HOH H 5 . ? -72.661 22.129 4.484 1.00 45.66 ? 2004 HOH A O 1 HETATM 3098 O O . HOH H 5 . ? -70.791 15.406 8.159 1.00 46.22 ? 2005 HOH A O 1 HETATM 3099 O O . HOH H 5 . ? -68.755 7.352 4.844 1.00 49.45 ? 2006 HOH A O 1 HETATM 3100 O O . HOH H 5 . ? -56.032 -3.007 9.806 1.00 44.73 ? 2007 HOH A O 1 HETATM 3101 O O . HOH H 5 . ? -65.096 2.529 0.020 1.00 44.63 ? 2008 HOH A O 1 HETATM 3102 O O . HOH H 5 . ? -65.717 7.146 -0.131 1.00 47.99 ? 2009 HOH A O 1 HETATM 3103 O O . HOH H 5 . ? -66.926 14.048 1.448 1.00 40.75 ? 2010 HOH A O 1 HETATM 3104 O O . HOH H 5 . ? -69.592 15.699 0.591 1.00 50.67 ? 2011 HOH A O 1 HETATM 3105 O O . HOH H 5 . ? -72.271 15.242 -5.471 1.00 56.27 ? 2012 HOH A O 1 HETATM 3106 O O . HOH H 5 . ? -53.899 11.868 3.659 1.00 45.57 ? 2013 HOH A O 1 HETATM 3107 O O . HOH H 5 . ? -57.481 0.019 -1.286 1.00 48.10 ? 2014 HOH A O 1 HETATM 3108 O O . HOH H 5 . ? -52.011 -2.180 -3.469 1.00 56.84 ? 2015 HOH A O 1 HETATM 3109 O O . HOH H 5 . ? -51.094 10.342 5.152 1.00 50.22 ? 2016 HOH A O 1 HETATM 3110 O O . HOH H 5 . ? -54.893 13.624 7.920 1.00 45.94 ? 2017 HOH A O 1 HETATM 3111 O O . HOH H 5 . ? -56.915 12.339 13.689 1.00 40.11 ? 2018 HOH A O 1 HETATM 3112 O O . HOH H 5 . ? -56.625 16.738 11.832 1.00 37.85 ? 2019 HOH A O 1 HETATM 3113 O O . HOH H 5 . ? -57.536 26.253 6.480 1.00 59.03 ? 2020 HOH A O 1 HETATM 3114 O O . HOH H 5 . ? -67.950 38.475 -16.353 1.00 65.08 ? 2021 HOH A O 1 HETATM 3115 O O . HOH H 5 . ? -64.276 39.228 -2.404 1.00 49.05 ? 2022 HOH A O 1 HETATM 3116 O O . HOH H 5 . ? -70.244 29.140 6.345 1.00 52.64 ? 2023 HOH A O 1 HETATM 3117 O O . HOH H 5 . ? -59.943 26.680 7.542 1.00 52.44 ? 2024 HOH A O 1 HETATM 3118 O O . HOH H 5 . ? -61.780 29.702 6.657 1.00 49.18 ? 2025 HOH A O 1 HETATM 3119 O O . HOH H 5 . ? -65.846 30.930 4.465 1.00 42.51 ? 2026 HOH A O 1 HETATM 3120 O O . HOH H 5 . ? -66.754 23.929 8.901 1.00 46.95 ? 2027 HOH A O 1 HETATM 3121 O O . HOH H 5 . ? -62.087 25.018 9.865 1.00 39.43 ? 2028 HOH A O 1 HETATM 3122 O O . HOH H 5 . ? -62.825 22.467 12.153 1.00 34.25 ? 2029 HOH A O 1 HETATM 3123 O O . HOH H 5 . ? -60.005 8.367 13.221 1.00 42.13 ? 2030 HOH A O 1 HETATM 3124 O O . HOH H 5 . ? -58.114 6.533 13.064 1.00 45.56 ? 2031 HOH A O 1 HETATM 3125 O O . HOH H 5 . ? -65.437 0.949 7.722 1.00 51.57 ? 2032 HOH A O 1 HETATM 3126 O O . HOH H 5 . ? -68.546 2.106 9.164 1.00 55.81 ? 2033 HOH A O 1 HETATM 3127 O O . HOH H 5 . ? -58.357 -3.685 10.480 1.00 33.64 ? 2034 HOH A O 1 HETATM 3128 O O . HOH H 5 . ? -56.258 -3.853 12.812 1.00 36.35 ? 2035 HOH A O 1 HETATM 3129 O O . HOH H 5 . ? -52.565 -6.565 17.277 1.00 35.70 ? 2036 HOH A O 1 HETATM 3130 O O . HOH H 5 . ? -43.850 -11.533 27.039 1.00 38.41 ? 2037 HOH A O 1 HETATM 3131 O O . HOH H 5 . ? -42.548 -12.720 32.379 1.00 47.41 ? 2038 HOH A O 1 HETATM 3132 O O . HOH H 5 . ? -45.612 -13.616 40.196 1.00 44.48 ? 2039 HOH A O 1 HETATM 3133 O O . HOH H 5 . ? -44.634 -12.663 35.441 1.00 34.01 ? 2040 HOH A O 1 HETATM 3134 O O . HOH H 5 . ? -44.128 -19.844 48.172 1.00 43.18 ? 2041 HOH A O 1 HETATM 3135 O O . HOH H 5 . ? -47.593 -12.251 41.754 1.00 52.84 ? 2042 HOH A O 1 HETATM 3136 O O . HOH H 5 . ? -53.128 -5.223 38.493 1.00 39.88 ? 2043 HOH A O 1 HETATM 3137 O O . HOH H 5 . ? -50.644 -7.320 34.928 1.00 38.21 ? 2044 HOH A O 1 HETATM 3138 O O . HOH H 5 . ? -50.297 -9.275 39.878 1.00 35.71 ? 2045 HOH A O 1 HETATM 3139 O O . HOH H 5 . ? -52.896 1.319 28.978 1.00 74.50 ? 2046 HOH A O 1 HETATM 3140 O O . HOH H 5 . ? -50.599 4.154 15.650 1.00 60.55 ? 2047 HOH A O 1 HETATM 3141 O O . HOH H 5 . ? -51.532 1.292 15.070 1.00 54.84 ? 2048 HOH A O 1 HETATM 3142 O O . HOH H 5 . ? -59.597 2.262 21.864 1.00 36.37 ? 2049 HOH A O 1 HETATM 3143 O O . HOH H 5 . ? -67.869 -3.236 19.043 1.00 45.24 ? 2050 HOH A O 1 HETATM 3144 O O . HOH H 5 . ? -61.953 -0.678 23.173 1.00 37.68 ? 2051 HOH A O 1 HETATM 3145 O O . HOH H 5 . ? -65.760 -5.920 26.948 1.00 43.01 ? 2052 HOH A O 1 HETATM 3146 O O . HOH H 5 . ? -65.971 -13.712 23.236 1.00 60.33 ? 2053 HOH A O 1 HETATM 3147 O O . HOH H 5 . ? -59.146 -22.998 32.523 1.00 59.20 ? 2054 HOH A O 1 HETATM 3148 O O . HOH H 5 . ? -68.969 -19.003 27.272 1.00 52.49 ? 2055 HOH A O 1 HETATM 3149 O O . HOH H 5 . ? -69.144 -16.833 31.574 1.00 46.86 ? 2056 HOH A O 1 HETATM 3150 O O . HOH H 5 . ? -66.677 -17.990 38.842 1.00 45.89 ? 2057 HOH A O 1 HETATM 3151 O O . HOH H 5 . ? -45.925 -10.316 36.756 1.00 41.95 ? 2058 HOH A O 1 HETATM 3152 O O . HOH H 5 . ? -72.124 -18.575 30.650 1.00 62.34 ? 2059 HOH A O 1 HETATM 3153 O O . HOH H 5 . ? -69.849 -22.602 34.195 1.00 54.57 ? 2060 HOH A O 1 HETATM 3154 O O . HOH H 5 . ? -61.411 -23.146 42.259 1.00 48.05 ? 2061 HOH A O 1 HETATM 3155 O O . HOH H 5 . ? -59.429 -14.646 41.230 1.00 43.88 ? 2062 HOH A O 1 HETATM 3156 O O . HOH H 5 . ? -49.889 6.341 12.364 1.00 47.87 ? 2063 HOH A O 1 HETATM 3157 O O . HOH H 5 . ? -66.456 -13.039 39.178 1.00 40.43 ? 2064 HOH A O 1 HETATM 3158 O O . HOH H 5 . ? -63.272 0.611 35.522 1.00 44.98 ? 2065 HOH A O 1 HETATM 3159 O O . HOH H 5 . ? -50.242 1.037 30.356 1.00 50.90 ? 2066 HOH A O 1 HETATM 3160 O O . HOH H 5 . ? -45.378 -29.224 39.074 1.00 61.46 ? 2067 HOH A O 1 HETATM 3161 O O . HOH H 5 . ? -57.004 -21.433 35.046 1.00 45.82 ? 2068 HOH A O 1 HETATM 3162 O O . HOH H 5 . ? -60.327 -18.583 22.204 1.00 43.22 ? 2069 HOH A O 1 HETATM 3163 O O . HOH H 5 . ? -64.707 -11.060 21.596 1.00 34.75 ? 2070 HOH A O 1 HETATM 3164 O O . HOH H 5 . ? -67.940 -8.000 14.006 1.00 48.43 ? 2071 HOH A O 1 HETATM 3165 O O . HOH H 5 . ? -30.706 -12.243 37.332 1.00 36.64 ? 2072 HOH A O 1 HETATM 3166 O O . HOH H 5 . ? -67.049 -6.500 8.568 1.00 52.82 ? 2073 HOH A O 1 HETATM 3167 O O . HOH H 5 . ? -68.150 -2.011 16.357 1.00 44.07 ? 2074 HOH A O 1 HETATM 3168 O O . HOH H 5 . ? -70.223 -6.307 11.759 1.00 53.40 ? 2075 HOH A O 1 HETATM 3169 O O . HOH H 5 . ? -70.466 -0.434 15.319 1.00 50.86 ? 2076 HOH A O 1 HETATM 3170 O O . HOH H 5 . ? -29.551 -10.339 39.038 1.00 48.61 ? 2077 HOH A O 1 HETATM 3171 O O . HOH H 5 . ? -59.025 -13.988 14.066 1.00 37.64 ? 2078 HOH A O 1 HETATM 3172 O O . HOH H 5 . ? -57.056 -6.884 9.206 1.00 53.25 ? 2079 HOH A O 1 HETATM 3173 O O . HOH H 5 . ? -56.079 -12.148 15.533 1.00 32.14 ? 2080 HOH A O 1 HETATM 3174 O O . HOH H 5 . ? -19.176 -16.999 61.558 1.00 47.64 ? 2081 HOH A O 1 HETATM 3175 O O . HOH H 5 . ? -51.438 -14.832 19.880 1.00 38.49 ? 2082 HOH A O 1 HETATM 3176 O O . HOH H 5 . ? -47.736 -15.000 24.167 1.00 45.47 ? 2083 HOH A O 1 HETATM 3177 O O . HOH H 5 . ? -35.959 -26.532 40.733 1.00 43.52 ? 2084 HOH A O 1 HETATM 3178 O O . HOH H 5 . ? -37.115 -24.630 34.601 1.00 39.57 ? 2085 HOH A O 1 HETATM 3179 O O . HOH H 5 . ? -26.789 -27.048 40.921 1.00 47.77 ? 2086 HOH A O 1 HETATM 3180 O O . HOH H 5 . ? -26.176 -21.263 36.859 1.00 33.49 ? 2087 HOH A O 1 HETATM 3181 O O . HOH H 5 . ? -18.448 -22.610 38.907 1.00 48.50 ? 2088 HOH A O 1 HETATM 3182 O O . HOH H 5 . ? -18.492 -21.767 41.585 1.00 43.25 ? 2089 HOH A O 1 HETATM 3183 O O . HOH H 5 . ? -7.101 -13.097 48.316 0.50 53.23 ? 2090 HOH A O 1 HETATM 3184 O O . HOH H 5 . ? -7.739 -10.253 65.477 1.00 50.28 ? 2091 HOH A O 1 HETATM 3185 O O . HOH H 5 . ? -9.441 -7.826 60.891 1.00 45.50 ? 2092 HOH A O 1 HETATM 3186 O O . HOH H 5 . ? -3.987 2.045 62.383 1.00 57.21 ? 2093 HOH A O 1 HETATM 3187 O O . HOH H 5 . ? -17.512 -18.146 35.382 1.00 55.36 ? 2094 HOH A O 1 HETATM 3188 O O . HOH H 5 . ? -30.629 -14.732 35.991 1.00 42.00 ? 2095 HOH A O 1 HETATM 3189 O O . HOH H 5 . ? -39.767 -21.179 35.829 1.00 35.42 ? 2096 HOH A O 1 HETATM 3190 O O . HOH H 5 . ? -39.748 -13.169 33.465 1.00 45.35 ? 2097 HOH A O 1 HETATM 3191 O O . HOH H 5 . ? -33.223 -11.502 38.182 1.00 37.47 ? 2098 HOH A O 1 HETATM 3192 O O . HOH H 5 . ? -32.779 -9.573 39.894 1.00 44.04 ? 2099 HOH A O 1 HETATM 3193 O O . HOH H 5 . ? -39.420 -6.457 48.554 1.00 55.33 ? 2100 HOH A O 1 HETATM 3194 O O . HOH H 5 . ? -27.612 -10.605 40.613 1.00 45.05 ? 2101 HOH A O 1 HETATM 3195 O O . HOH H 5 . ? -32.377 -15.490 52.711 1.00 41.35 ? 2102 HOH A O 1 HETATM 3196 O O . HOH H 5 . ? -20.998 -31.161 59.496 1.00 44.79 ? 2103 HOH A O 1 HETATM 3197 O O . HOH H 5 . ? -16.441 -18.543 63.332 1.00 45.42 ? 2104 HOH A O 1 HETATM 3198 O O . HOH H 5 . ? -25.002 -28.694 59.103 1.00 31.70 ? 2105 HOH A O 1 HETATM 3199 O O . HOH H 5 . ? -19.547 -22.349 62.620 1.00 48.69 ? 2106 HOH A O 1 HETATM 3200 O O . HOH H 5 . ? -19.195 -10.242 41.589 1.00 44.72 ? 2107 HOH A O 1 HETATM 3201 O O . HOH H 5 . ? -23.751 -7.329 49.231 1.00 41.55 ? 2108 HOH A O 1 HETATM 3202 O O . HOH H 5 . ? -21.234 -11.440 59.001 1.00 46.58 ? 2109 HOH A O 1 HETATM 3203 O O . HOH H 5 . ? -16.113 -5.496 56.997 1.00 45.59 ? 2110 HOH A O 1 HETATM 3204 O O . HOH H 5 . ? -29.634 -20.090 43.682 1.00 25.77 ? 2111 HOH A O 1 HETATM 3205 O O . HOH H 5 . ? -39.037 -12.842 42.632 1.00 35.92 ? 2112 HOH A O 1 HETATM 3206 O O . HOH H 5 . ? -42.994 -14.068 47.733 1.00 48.94 ? 2113 HOH A O 1 HETATM 3207 O O . HOH H 5 . ? -37.326 -21.392 50.257 1.00 39.90 ? 2114 HOH A O 1 HETATM 3208 O O . HOH H 5 . ? -34.819 -19.613 52.964 1.00 40.06 ? 2115 HOH A O 1 HETATM 3209 O O . HOH H 5 . ? -31.469 -24.695 48.263 1.00 45.04 ? 2116 HOH A O 1 HETATM 3210 O O . HOH H 5 . ? -34.231 -26.735 42.902 1.00 40.74 ? 2117 HOH A O 1 HETATM 3211 O O . HOH H 5 . ? -28.481 -25.535 39.279 1.00 43.38 ? 2118 HOH A O 1 HETATM 3212 O O . HOH H 5 . ? -28.835 -27.212 45.640 1.00 41.62 ? 2119 HOH A O 1 HETATM 3213 O O . HOH H 5 . ? -7.549 -19.601 51.893 1.00 39.97 ? 2120 HOH A O 1 HETATM 3214 O O . HOH H 5 . ? -3.970 -23.289 54.377 1.00 54.87 ? 2121 HOH A O 1 HETATM 3215 O O . HOH H 5 . ? -4.893 -25.248 55.823 1.00 62.09 ? 2122 HOH A O 1 HETATM 3216 O O . HOH H 5 . ? -1.257 -12.889 59.616 1.00 47.23 ? 2123 HOH A O 1 HETATM 3217 O O . HOH H 5 . ? -4.281 -16.731 64.955 1.00 43.39 ? 2124 HOH A O 1 HETATM 3218 O O . HOH H 5 . ? 2.128 -1.404 66.268 1.00 53.61 ? 2125 HOH A O 1 HETATM 3219 O O . HOH H 5 . ? 10.602 19.178 78.118 1.00 64.31 ? 2126 HOH A O 1 HETATM 3220 O O . HOH H 5 . ? 19.563 17.901 81.098 1.00 63.53 ? 2127 HOH A O 1 HETATM 3221 O O . HOH H 5 . ? 6.369 14.319 78.007 1.00 73.99 ? 2128 HOH A O 1 HETATM 3222 O O . HOH H 5 . ? 5.974 17.327 77.264 1.00 69.71 ? 2129 HOH A O 1 HETATM 3223 O O . HOH H 5 . ? -4.761 2.473 65.335 1.00 65.91 ? 2130 HOH A O 1 HETATM 3224 O O . HOH H 5 . ? -1.596 7.506 68.251 1.00 64.02 ? 2131 HOH A O 1 HETATM 3225 O O . HOH H 5 . ? -2.954 0.007 67.521 1.00 59.18 ? 2132 HOH A O 1 HETATM 3226 O O . HOH H 5 . ? -4.518 -2.431 65.796 1.00 48.90 ? 2133 HOH A O 1 HETATM 3227 O O . HOH H 5 . ? -0.713 -9.435 73.284 1.00 57.88 ? 2134 HOH A O 1 HETATM 3228 O O . HOH H 5 . ? 25.872 6.438 72.166 1.00 57.43 ? 2135 HOH A O 1 HETATM 3229 O O . HOH H 5 . ? 9.465 7.413 79.116 1.00 67.96 ? 2136 HOH A O 1 HETATM 3230 O O . HOH H 5 . ? 23.840 18.534 64.899 1.00 52.83 ? 2137 HOH A O 1 HETATM 3231 O O . HOH H 5 . ? 27.420 23.778 68.208 1.00 54.97 ? 2138 HOH A O 1 HETATM 3232 O O . HOH H 5 . ? 13.387 -9.253 64.408 1.00 62.56 ? 2139 HOH A O 1 HETATM 3233 O O . HOH H 5 . ? 14.571 -8.513 60.032 1.00 61.66 ? 2140 HOH A O 1 HETATM 3234 O O . HOH H 5 . ? 9.249 0.833 59.717 1.00 57.81 ? 2141 HOH A O 1 HETATM 3235 O O . HOH H 5 . ? 20.132 11.626 58.955 1.00 33.01 ? 2142 HOH A O 1 HETATM 3236 O O . HOH H 5 . ? 22.793 15.825 63.617 1.00 46.94 ? 2143 HOH A O 1 HETATM 3237 O O . HOH H 5 . ? -53.893 -4.926 44.041 1.00 37.07 ? 2144 HOH A O 1 HETATM 3238 O O . HOH H 5 . ? -56.932 -1.601 41.487 1.00 42.34 ? 2145 HOH A O 1 HETATM 3239 O O . HOH H 5 . ? -54.698 -3.183 38.790 1.00 38.98 ? 2146 HOH A O 1 HETATM 3240 O O . HOH H 5 . ? -33.856 -24.336 40.127 1.00 37.12 ? 2147 HOH A O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 GLN 1 301 301 GLN GLN A . n A 1 2 PRO 2 302 302 PRO PRO A . n A 1 3 HIS 3 303 303 HIS HIS A . n A 1 4 ILE 4 304 304 ILE ILE A . n A 1 5 ILE 5 305 305 ILE ILE A . n A 1 6 GLN 6 306 306 GLN GLN A . n A 1 7 LEU 7 307 307 LEU LEU A . n A 1 8 LYS 8 308 308 LYS LYS A . n A 1 9 ASN 9 309 309 ASN ASN A . n A 1 10 GLU 10 310 310 GLU GLU A . n A 1 11 THR 11 311 311 THR THR A . n A 1 12 THR 12 312 312 THR THR A . n A 1 13 TYR 13 313 313 TYR TYR A . n A 1 14 GLU 14 314 314 GLU GLU A . n A 1 15 ASN 15 315 315 ASN ASN A . n A 1 16 GLY 16 316 316 GLY GLY A . n A 1 17 GLN 17 317 317 GLN GLN A . n A 1 18 VAL 18 318 318 VAL VAL A . n A 1 19 THR 19 319 319 THR THR A . n A 1 20 LEU 20 320 320 LEU LEU A . n A 1 21 VAL 21 321 321 VAL VAL A . n A 1 22 CYS 22 322 322 CYS CYS A . n A 1 23 ASP 23 323 323 ASP ASP A . n A 1 24 ALA 24 324 324 ALA ALA A . n A 1 25 GLU 25 325 325 GLU GLU A . n A 1 26 GLY 26 326 326 GLY GLY A . n A 1 27 GLU 27 327 327 GLU GLU A . n A 1 28 PRO 28 328 328 PRO PRO A . n A 1 29 ILE 29 329 329 ILE ILE A . n A 1 30 PRO 30 330 330 PRO PRO A . n A 1 31 GLU 31 331 331 GLU GLU A . n A 1 32 ILE 32 332 332 ILE ILE A . n A 1 33 THR 33 333 333 THR THR A . n A 1 34 TRP 34 334 334 TRP TRP A . n A 1 35 LYS 35 335 335 LYS LYS A . n A 1 36 ARG 36 336 336 ARG ARG A . n A 1 37 ALA 37 337 337 ALA ALA A . n A 1 38 VAL 38 338 338 VAL VAL A . n A 1 39 ASP 39 339 339 ASP ASP A . n A 1 40 GLY 40 340 340 GLY GLY A . n A 1 41 PHE 41 341 341 PHE PHE A . n A 1 42 THR 42 342 342 THR THR A . n A 1 43 PHE 43 343 343 PHE PHE A . n A 1 44 THR 44 344 344 THR THR A . n A 1 45 GLU 45 345 345 GLU GLU A . n A 1 46 GLY 46 346 ? ? ? A . n A 1 47 ASP 47 347 ? ? ? A . n A 1 48 LYS 48 348 348 LYS LYS A . n A 1 49 SER 49 349 349 SER SER A . n A 1 50 LEU 50 350 350 LEU LEU A . n A 1 51 ASP 51 351 351 ASP ASP A . n A 1 52 GLY 52 352 352 GLY GLY A . n A 1 53 ARG 53 353 353 ARG ARG A . n A 1 54 ILE 54 354 354 ILE ILE A . n A 1 55 GLU 55 355 355 GLU GLU A . n A 1 56 VAL 56 356 356 VAL VAL A . n A 1 57 LYS 57 357 357 LYS LYS A . n A 1 58 GLY 58 358 358 GLY GLY A . n A 1 59 GLN 59 359 359 GLN GLN A . n A 1 60 HIS 60 360 360 HIS HIS A . n A 1 61 GLY 61 361 361 GLY GLY A . n A 1 62 SER 62 362 362 SER SER A . n A 1 63 SER 63 363 363 SER SER A . n A 1 64 SER 64 364 364 SER SER A . n A 1 65 LEU 65 365 365 LEU LEU A . n A 1 66 HIS 66 366 366 HIS HIS A . n A 1 67 ILE 67 367 367 ILE ILE A . n A 1 68 LYS 68 368 368 LYS LYS A . n A 1 69 ASP 69 369 369 ASP ASP A . n A 1 70 VAL 70 370 370 VAL VAL A . n A 1 71 LYS 71 371 371 LYS LYS A . n A 1 72 LEU 72 372 372 LEU LEU A . n A 1 73 SER 73 373 373 SER SER A . n A 1 74 ASP 74 374 374 ASP ASP A . n A 1 75 SER 75 375 375 SER SER A . n A 1 76 GLY 76 376 376 GLY GLY A . n A 1 77 ARG 77 377 377 ARG ARG A . n A 1 78 TYR 78 378 378 TYR TYR A . n A 1 79 ASP 79 379 379 ASP ASP A . n A 1 80 CYS 80 380 380 CYS CYS A . n A 1 81 GLU 81 381 381 GLU GLU A . n A 1 82 ALA 82 382 382 ALA ALA A . n A 1 83 ALA 83 383 383 ALA ALA A . n A 1 84 SER 84 384 384 SER SER A . n A 1 85 ARG 85 385 385 ARG ARG A . n A 1 86 ILE 86 386 386 ILE ILE A . n A 1 87 GLY 87 387 387 GLY GLY A . n A 1 88 GLY 88 388 388 GLY GLY A . n A 1 89 HIS 89 389 389 HIS HIS A . n A 1 90 GLN 90 390 390 GLN GLN A . n A 1 91 LYS 91 391 391 LYS LYS A . n A 1 92 SER 92 392 392 SER SER A . n A 1 93 MET 93 393 393 MET MET A . n A 1 94 TYR 94 394 394 TYR TYR A . n A 1 95 LEU 95 395 395 LEU LEU A . n A 1 96 ASP 96 396 396 ASP ASP A . n A 1 97 ILE 97 397 397 ILE ILE A . n A 1 98 GLU 98 398 398 GLU GLU A . n A 1 99 TYR 99 399 399 TYR TYR A . n A 1 100 ALA 100 400 400 ALA ALA A . n A 1 101 PRO 101 401 401 PRO PRO A . n A 1 102 LYS 102 402 402 LYS LYS A . n A 1 103 PHE 103 403 403 PHE PHE A . n A 1 104 ILE 104 404 404 ILE ILE A . n A 1 105 SER 105 405 405 SER SER A . n A 1 106 ASN 106 406 406 ASN ASN A . n A 1 107 GLN 107 407 407 GLN GLN A . n A 1 108 THR 108 408 408 THR THR A . n A 1 109 ILE 109 409 409 ILE ILE A . n A 1 110 TYR 110 410 410 TYR TYR A . n A 1 111 TYR 111 411 411 TYR TYR A . n A 1 112 SER 112 412 412 SER SER A . n A 1 113 TRP 113 413 413 TRP TRP A . n A 1 114 GLU 114 414 414 GLU GLU A . n A 1 115 GLY 115 415 415 GLY GLY A . n A 1 116 ASN 116 416 416 ASN ASN A . n A 1 117 PRO 117 417 417 PRO PRO A . n A 1 118 ILE 118 418 418 ILE ILE A . n A 1 119 ASN 119 419 419 ASN ASN A . n A 1 120 ILE 120 420 420 ILE ILE A . n A 1 121 SER 121 421 421 SER SER A . n A 1 122 CYS 122 422 422 CYS CYS A . n A 1 123 ASP 123 423 423 ASP ASP A . n A 1 124 VAL 124 424 424 VAL VAL A . n A 1 125 LYS 125 425 425 LYS LYS A . n A 1 126 SER 126 426 426 SER SER A . n A 1 127 ASN 127 427 427 ASN ASN A . n A 1 128 PRO 128 428 428 PRO PRO A . n A 1 129 PRO 129 429 429 PRO PRO A . n A 1 130 ALA 130 430 430 ALA ALA A . n A 1 131 SER 131 431 431 SER SER A . n A 1 132 ILE 132 432 432 ILE ILE A . n A 1 133 HIS 133 433 433 HIS HIS A . n A 1 134 TRP 134 434 434 TRP TRP A . n A 1 135 ARG 135 435 435 ARG ARG A . n A 1 136 ARG 136 436 436 ARG ARG A . n A 1 137 ASP 137 437 437 ASP ASP A . n A 1 138 LYS 138 438 438 LYS LYS A . n A 1 139 LEU 139 439 439 LEU LEU A . n A 1 140 VAL 140 440 440 VAL VAL A . n A 1 141 LEU 141 441 441 LEU LEU A . n A 1 142 PRO 142 442 442 PRO PRO A . n A 1 143 ALA 143 443 443 ALA ALA A . n A 1 144 LYS 144 444 444 LYS LYS A . n A 1 145 ASN 145 445 445 ASN ASN A . n A 1 146 THR 146 446 446 THR THR A . n A 1 147 THR 147 447 447 THR THR A . n A 1 148 ASN 148 448 448 ASN ASN A . n A 1 149 LEU 149 449 449 LEU LEU A . n A 1 150 LYS 150 450 450 LYS LYS A . n A 1 151 THR 151 451 451 THR THR A . n A 1 152 TYR 152 452 452 TYR TYR A . n A 1 153 SER 153 453 453 SER SER A . n A 1 154 THR 154 454 454 THR THR A . n A 1 155 GLY 155 455 455 GLY GLY A . n A 1 156 ARG 156 456 456 ARG ARG A . n A 1 157 LYS 157 457 457 LYS LYS A . n A 1 158 MET 158 458 458 MET MET A . n A 1 159 ILE 159 459 459 ILE ILE A . n A 1 160 LEU 160 460 460 LEU LEU A . n A 1 161 GLU 161 461 461 GLU GLU A . n A 1 162 ILE 162 462 462 ILE ILE A . n A 1 163 ALA 163 463 463 ALA ALA A . n A 1 164 PRO 164 464 464 PRO PRO A . n A 1 165 THR 165 465 465 THR THR A . n A 1 166 SER 166 466 466 SER SER A . n A 1 167 ASP 167 467 467 ASP ASP A . n A 1 168 ASN 168 468 468 ASN ASN A . n A 1 169 ASP 169 469 469 ASP ASP A . n A 1 170 PHE 170 470 470 PHE PHE A . n A 1 171 GLY 171 471 471 GLY GLY A . n A 1 172 ARG 172 472 472 ARG ARG A . n A 1 173 TYR 173 473 473 TYR TYR A . n A 1 174 ASN 174 474 474 ASN ASN A . n A 1 175 CYS 175 475 475 CYS CYS A . n A 1 176 THR 176 476 476 THR THR A . n A 1 177 ALA 177 477 477 ALA ALA A . n A 1 178 THR 178 478 478 THR THR A . n A 1 179 ASN 179 479 479 ASN ASN A . n A 1 180 HIS 180 480 480 HIS HIS A . n A 1 181 ILE 181 481 481 ILE ILE A . n A 1 182 GLY 182 482 482 GLY GLY A . n A 1 183 THR 183 483 483 THR THR A . n A 1 184 ARG 184 484 484 ARG ARG A . n A 1 185 PHE 185 485 485 PHE PHE A . n A 1 186 GLN 186 486 486 GLN GLN A . n A 1 187 GLU 187 487 487 GLU GLU A . n A 1 188 TYR 188 488 488 TYR TYR A . n A 1 189 ILE 189 489 489 ILE ILE A . n A 1 190 LEU 190 490 490 LEU LEU A . n A 1 191 ALA 191 491 491 ALA ALA A . n A 1 192 LEU 192 492 492 LEU LEU A . n A 1 193 ALA 193 493 493 ALA ALA A . n A 1 194 ASP 194 494 494 ASP ASP A . n A 1 195 VAL 195 495 495 VAL VAL A . n A 1 196 PRO 196 496 496 PRO PRO A . n A 1 197 SER 197 497 497 SER SER A . n A 1 198 SER 198 498 498 SER SER A . n A 1 199 PRO 199 499 499 PRO PRO A . n A 1 200 TYR 200 500 500 TYR TYR A . n A 1 201 GLY 201 501 501 GLY GLY A . n A 1 202 VAL 202 502 502 VAL VAL A . n A 1 203 LYS 203 503 503 LYS LYS A . n A 1 204 ILE 204 504 504 ILE ILE A . n A 1 205 ILE 205 505 505 ILE ILE A . n A 1 206 GLU 206 506 506 GLU GLU A . n A 1 207 LEU 207 507 507 LEU LEU A . n A 1 208 SER 208 508 508 SER SER A . n A 1 209 GLN 209 509 509 GLN GLN A . n A 1 210 THR 210 510 510 THR THR A . n A 1 211 THR 211 511 511 THR THR A . n A 1 212 ALA 212 512 512 ALA ALA A . n A 1 213 LYS 213 513 513 LYS LYS A . n A 1 214 VAL 214 514 514 VAL VAL A . n A 1 215 SER 215 515 515 SER SER A . n A 1 216 PHE 216 516 516 PHE PHE A . n A 1 217 ASN 217 517 517 ASN ASN A . n A 1 218 LYS 218 518 518 LYS LYS A . n A 1 219 PRO 219 519 519 PRO PRO A . n A 1 220 ASP 220 520 520 ASP ASP A . n A 1 221 SER 221 521 521 SER SER A . n A 1 222 HIS 222 522 522 HIS HIS A . n A 1 223 GLY 223 523 523 GLY GLY A . n A 1 224 GLY 224 524 524 GLY GLY A . n A 1 225 VAL 225 525 525 VAL VAL A . n A 1 226 PRO 226 526 526 PRO PRO A . n A 1 227 ILE 227 527 527 ILE ILE A . n A 1 228 HIS 228 528 528 HIS HIS A . n A 1 229 HIS 229 529 529 HIS HIS A . n A 1 230 TYR 230 530 530 TYR TYR A . n A 1 231 GLN 231 531 531 GLN GLN A . n A 1 232 VAL 232 532 532 VAL VAL A . n A 1 233 ASP 233 533 533 ASP ASP A . n A 1 234 VAL 234 534 534 VAL VAL A . n A 1 235 LYS 235 535 535 LYS LYS A . n A 1 236 GLU 236 536 536 GLU GLU A . n A 1 237 VAL 237 537 537 VAL VAL A . n A 1 238 ALA 238 538 538 ALA ALA A . n A 1 239 SER 239 539 539 SER SER A . n A 1 240 GLU 240 540 540 GLU GLU A . n A 1 241 ILE 241 541 541 ILE ILE A . n A 1 242 TRP 242 542 542 TRP TRP A . n A 1 243 LYS 243 543 543 LYS LYS A . n A 1 244 ILE 244 544 544 ILE ILE A . n A 1 245 VAL 245 545 545 VAL VAL A . n A 1 246 ARG 246 546 546 ARG ARG A . n A 1 247 SER 247 547 547 SER SER A . n A 1 248 HIS 248 548 548 HIS HIS A . n A 1 249 GLY 249 549 549 GLY GLY A . n A 1 250 VAL 250 550 550 VAL VAL A . n A 1 251 GLN 251 551 551 GLN GLN A . n A 1 252 THR 252 552 552 THR THR A . n A 1 253 MET 253 553 553 MET MET A . n A 1 254 VAL 254 554 554 VAL VAL A . n A 1 255 VAL 255 555 555 VAL VAL A . n A 1 256 LEU 256 556 556 LEU LEU A . n A 1 257 ASN 257 557 557 ASN ASN A . n A 1 258 ASN 258 558 558 ASN ASN A . n A 1 259 LEU 259 559 559 LEU LEU A . n A 1 260 GLU 260 560 560 GLU GLU A . n A 1 261 PRO 261 561 561 PRO PRO A . n A 1 262 ASN 262 562 562 ASN ASN A . n A 1 263 THR 263 563 563 THR THR A . n A 1 264 THR 264 564 564 THR THR A . n A 1 265 TYR 265 565 565 TYR TYR A . n A 1 266 GLU 266 566 566 GLU GLU A . n A 1 267 ILE 267 567 567 ILE ILE A . n A 1 268 ARG 268 568 568 ARG ARG A . n A 1 269 VAL 269 569 569 VAL VAL A . n A 1 270 ALA 270 570 570 ALA ALA A . n A 1 271 ALA 271 571 571 ALA ALA A . n A 1 272 VAL 272 572 572 VAL VAL A . n A 1 273 ASN 273 573 573 ASN ASN A . n A 1 274 GLY 274 574 574 GLY GLY A . n A 1 275 LYS 275 575 575 LYS LYS A . n A 1 276 GLY 276 576 576 GLY GLY A . n A 1 277 GLN 277 577 577 GLN GLN A . n A 1 278 GLY 278 578 578 GLY GLY A . n A 1 279 ASP 279 579 579 ASP ASP A . n A 1 280 TYR 280 580 580 TYR TYR A . n A 1 281 SER 281 581 581 SER SER A . n A 1 282 LYS 282 582 582 LYS LYS A . n A 1 283 ILE 283 583 583 ILE ILE A . n A 1 284 GLU 284 584 584 GLU GLU A . n A 1 285 ILE 285 585 585 ILE ILE A . n A 1 286 PHE 286 586 586 PHE PHE A . n A 1 287 GLN 287 587 587 GLN GLN A . n A 1 288 THR 288 588 588 THR THR A . n A 1 289 LEU 289 589 589 LEU LEU A . n A 1 290 PRO 290 590 590 PRO PRO A . n A 1 291 VAL 291 591 591 VAL VAL A . n A 1 292 ARG 292 592 592 ARG ARG A . n A 1 293 GLU 293 593 593 GLU GLU A . n A 1 294 PRO 294 594 594 PRO PRO A . n A 1 295 SER 295 595 595 SER SER A . n A 1 296 PRO 296 596 596 PRO PRO A . n A 1 297 PRO 297 597 597 PRO PRO A . n A 1 298 SER 298 598 598 SER SER A . n A 1 299 ILE 299 599 599 ILE ILE A . n A 1 300 HIS 300 600 600 HIS HIS A . n A 1 301 GLY 301 601 601 GLY GLY A . n A 1 302 GLN 302 602 602 GLN GLN A . n A 1 303 PRO 303 603 603 PRO PRO A . n A 1 304 SER 304 604 604 SER SER A . n A 1 305 SER 305 605 605 SER SER A . n A 1 306 GLY 306 606 606 GLY GLY A . n A 1 307 LYS 307 607 607 LYS LYS A . n A 1 308 SER 308 608 608 SER SER A . n A 1 309 PHE 309 609 609 PHE PHE A . n A 1 310 LYS 310 610 610 LYS LYS A . n A 1 311 LEU 311 611 611 LEU LEU A . n A 1 312 SER 312 612 612 SER SER A . n A 1 313 ILE 313 613 613 ILE ILE A . n A 1 314 THR 314 614 614 THR THR A . n A 1 315 LYS 315 615 615 LYS LYS A . n A 1 316 GLN 316 616 616 GLN GLN A . n A 1 317 ASP 317 617 617 ASP ASP A . n A 1 318 ASP 318 618 618 ASP ASP A . n A 1 319 GLY 319 619 619 GLY GLY A . n A 1 320 GLY 320 620 620 GLY GLY A . n A 1 321 ALA 321 621 621 ALA ALA A . n A 1 322 PRO 322 622 622 PRO PRO A . n A 1 323 ILE 323 623 623 ILE ILE A . n A 1 324 LEU 324 624 624 LEU LEU A . n A 1 325 GLU 325 625 625 GLU GLU A . n A 1 326 TYR 326 626 626 TYR TYR A . n A 1 327 ILE 327 627 627 ILE ILE A . n A 1 328 VAL 328 628 628 VAL VAL A . n A 1 329 LYS 329 629 629 LYS LYS A . n A 1 330 TYR 330 630 630 TYR TYR A . n A 1 331 ARG 331 631 631 ARG ARG A . n A 1 332 SER 332 632 632 SER SER A . n A 1 333 LYS 333 633 ? ? ? A . n A 1 334 ASP 334 634 ? ? ? A . n A 1 335 LYS 335 635 ? ? ? A . n A 1 336 GLU 336 636 ? ? ? A . n A 1 337 ASP 337 637 ? ? ? A . n A 1 338 GLN 338 638 638 GLN GLN A . n A 1 339 TRP 339 639 639 TRP TRP A . n A 1 340 LEU 340 640 640 LEU LEU A . n A 1 341 GLU 341 641 641 GLU GLU A . n A 1 342 LYS 342 642 642 LYS LYS A . n A 1 343 LYS 343 643 643 LYS LYS A . n A 1 344 VAL 344 644 644 VAL VAL A . n A 1 345 GLN 345 645 645 GLN GLN A . n A 1 346 GLY 346 646 646 GLY GLY A . n A 1 347 ASN 347 647 647 ASN ASN A . n A 1 348 LYS 348 648 648 LYS LYS A . n A 1 349 ASP 349 649 649 ASP ASP A . n A 1 350 HIS 350 650 650 HIS HIS A . n A 1 351 ILE 351 651 651 ILE ILE A . n A 1 352 ILE 352 652 652 ILE ILE A . n A 1 353 LEU 353 653 653 LEU LEU A . n A 1 354 GLU 354 654 654 GLU GLU A . n A 1 355 HIS 355 655 655 HIS HIS A . n A 1 356 LEU 356 656 656 LEU LEU A . n A 1 357 GLN 357 657 657 GLN GLN A . n A 1 358 TRP 358 658 658 TRP TRP A . n A 1 359 THR 359 659 659 THR THR A . n A 1 360 MET 360 660 660 MET MET A . n A 1 361 GLY 361 661 661 GLY GLY A . n A 1 362 TYR 362 662 662 TYR TYR A . n A 1 363 GLU 363 663 663 GLU GLU A . n A 1 364 VAL 364 664 664 VAL VAL A . n A 1 365 GLN 365 665 665 GLN GLN A . n A 1 366 ILE 366 666 666 ILE ILE A . n A 1 367 THR 367 667 667 THR THR A . n A 1 368 ALA 368 668 668 ALA ALA A . n A 1 369 ALA 369 669 669 ALA ALA A . n A 1 370 ASN 370 670 670 ASN ASN A . n A 1 371 ARG 371 671 671 ARG ARG A . n A 1 372 LEU 372 672 672 LEU LEU A . n A 1 373 GLY 373 673 673 GLY GLY A . n A 1 374 TYR 374 674 674 TYR TYR A . n A 1 375 SER 375 675 675 SER SER A . n A 1 376 GLU 376 676 676 GLU GLU A . n A 1 377 PRO 377 677 677 PRO PRO A . n A 1 378 THR 378 678 678 THR THR A . n A 1 379 VAL 379 679 679 VAL VAL A . n A 1 380 TYR 380 680 680 TYR TYR A . n A 1 381 GLU 381 681 681 GLU GLU A . n A 1 382 PHE 382 682 682 PHE PHE A . n A 1 383 SER 383 683 683 SER SER A . n A 1 384 MET 384 684 684 MET MET A . n A 1 385 PRO 385 685 685 PRO PRO A . n A 1 386 PRO 386 686 686 PRO PRO A . n A 1 387 LYS 387 687 687 LYS LYS A . n A 1 388 PRO 388 688 688 PRO PRO A . n A 1 389 ASN 389 689 689 ASN ASN A . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 NAG 1 1690 1690 NAG NAG A . C 2 NAG 1 1691 1691 NAG NAG A . D 2 NAG 1 1692 1692 NAG NAG A . E 2 NAG 1 1693 1693 NAG NAG A . F 3 GOL 1 1694 1694 GOL GOL A . G 4 CA 1 1695 1695 CA CA A . H 5 HOH 1 2001 2001 HOH HOH A . H 5 HOH 2 2002 2002 HOH HOH A . H 5 HOH 3 2003 2003 HOH HOH A . H 5 HOH 4 2004 2004 HOH HOH A . H 5 HOH 5 2005 2005 HOH HOH A . H 5 HOH 6 2006 2006 HOH HOH A . H 5 HOH 7 2007 2007 HOH HOH A . H 5 HOH 8 2008 2008 HOH HOH A . H 5 HOH 9 2009 2009 HOH HOH A . H 5 HOH 10 2010 2010 HOH HOH A . H 5 HOH 11 2011 2011 HOH HOH A . H 5 HOH 12 2012 2012 HOH HOH A . H 5 HOH 13 2013 2013 HOH HOH A . H 5 HOH 14 2014 2014 HOH HOH A . H 5 HOH 15 2015 2015 HOH HOH A . H 5 HOH 16 2016 2016 HOH HOH A . H 5 HOH 17 2017 2017 HOH HOH A . H 5 HOH 18 2018 2018 HOH HOH A . H 5 HOH 19 2019 2019 HOH HOH A . H 5 HOH 20 2020 2020 HOH HOH A . H 5 HOH 21 2021 2021 HOH HOH A . H 5 HOH 22 2022 2022 HOH HOH A . H 5 HOH 23 2023 2023 HOH HOH A . H 5 HOH 24 2024 2024 HOH HOH A . H 5 HOH 25 2025 2025 HOH HOH A . H 5 HOH 26 2026 2026 HOH HOH A . H 5 HOH 27 2027 2027 HOH HOH A . H 5 HOH 28 2028 2028 HOH HOH A . H 5 HOH 29 2029 2029 HOH HOH A . H 5 HOH 30 2030 2030 HOH HOH A . H 5 HOH 31 2031 2031 HOH HOH A . H 5 HOH 32 2032 2032 HOH HOH A . H 5 HOH 33 2033 2033 HOH HOH A . H 5 HOH 34 2034 2034 HOH HOH A . H 5 HOH 35 2035 2035 HOH HOH A . H 5 HOH 36 2036 2036 HOH HOH A . H 5 HOH 37 2037 2037 HOH HOH A . H 5 HOH 38 2038 2038 HOH HOH A . H 5 HOH 39 2039 2039 HOH HOH A . H 5 HOH 40 2040 2040 HOH HOH A . H 5 HOH 41 2041 2041 HOH HOH A . H 5 HOH 42 2042 2042 HOH HOH A . H 5 HOH 43 2043 2043 HOH HOH A . H 5 HOH 44 2044 2044 HOH HOH A . H 5 HOH 45 2045 2045 HOH HOH A . H 5 HOH 46 2046 2046 HOH HOH A . H 5 HOH 47 2047 2047 HOH HOH A . H 5 HOH 48 2048 2048 HOH HOH A . H 5 HOH 49 2049 2049 HOH HOH A . H 5 HOH 50 2050 2050 HOH HOH A . H 5 HOH 51 2051 2051 HOH HOH A . H 5 HOH 52 2052 2052 HOH HOH A . H 5 HOH 53 2053 2053 HOH HOH A . H 5 HOH 54 2054 2054 HOH HOH A . H 5 HOH 55 2055 2055 HOH HOH A . H 5 HOH 56 2056 2056 HOH HOH A . H 5 HOH 57 2057 2057 HOH HOH A . H 5 HOH 58 2058 2058 HOH HOH A . H 5 HOH 59 2059 2059 HOH HOH A . H 5 HOH 60 2060 2060 HOH HOH A . H 5 HOH 61 2061 2061 HOH HOH A . H 5 HOH 62 2062 2062 HOH HOH A . H 5 HOH 63 2063 2063 HOH HOH A . H 5 HOH 64 2064 2064 HOH HOH A . H 5 HOH 65 2065 2065 HOH HOH A . H 5 HOH 66 2066 2066 HOH HOH A . H 5 HOH 67 2067 2067 HOH HOH A . H 5 HOH 68 2068 2068 HOH HOH A . H 5 HOH 69 2069 2069 HOH HOH A . H 5 HOH 70 2070 2070 HOH HOH A . H 5 HOH 71 2071 2071 HOH HOH A . H 5 HOH 72 2072 2072 HOH HOH A . H 5 HOH 73 2073 2073 HOH HOH A . H 5 HOH 74 2074 2074 HOH HOH A . H 5 HOH 75 2075 2075 HOH HOH A . H 5 HOH 76 2076 2076 HOH HOH A . H 5 HOH 77 2077 2077 HOH HOH A . H 5 HOH 78 2078 2078 HOH HOH A . H 5 HOH 79 2079 2079 HOH HOH A . H 5 HOH 80 2080 2080 HOH HOH A . H 5 HOH 81 2081 2081 HOH HOH A . H 5 HOH 82 2082 2082 HOH HOH A . H 5 HOH 83 2083 2083 HOH HOH A . H 5 HOH 84 2084 2084 HOH HOH A . H 5 HOH 85 2085 2085 HOH HOH A . H 5 HOH 86 2086 2086 HOH HOH A . H 5 HOH 87 2087 2087 HOH HOH A . H 5 HOH 88 2088 2088 HOH HOH A . H 5 HOH 89 2089 2089 HOH HOH A . H 5 HOH 90 2090 2090 HOH HOH A . H 5 HOH 91 2091 2091 HOH HOH A . H 5 HOH 92 2092 2092 HOH HOH A . H 5 HOH 93 2093 2093 HOH HOH A . H 5 HOH 94 2094 2094 HOH HOH A . H 5 HOH 95 2095 2095 HOH HOH A . H 5 HOH 96 2096 2096 HOH HOH A . H 5 HOH 97 2097 2097 HOH HOH A . H 5 HOH 98 2098 2098 HOH HOH A . H 5 HOH 99 2099 2099 HOH HOH A . H 5 HOH 100 2100 2100 HOH HOH A . H 5 HOH 101 2101 2101 HOH HOH A . H 5 HOH 102 2102 2102 HOH HOH A . H 5 HOH 103 2103 2103 HOH HOH A . H 5 HOH 104 2104 2104 HOH HOH A . H 5 HOH 105 2105 2105 HOH HOH A . H 5 HOH 106 2106 2106 HOH HOH A . H 5 HOH 107 2107 2107 HOH HOH A . H 5 HOH 108 2108 2108 HOH HOH A . H 5 HOH 109 2109 2109 HOH HOH A . H 5 HOH 110 2110 2110 HOH HOH A . H 5 HOH 111 2111 2111 HOH HOH A . H 5 HOH 112 2112 2112 HOH HOH A . H 5 HOH 113 2113 2113 HOH HOH A . H 5 HOH 114 2114 2114 HOH HOH A . H 5 HOH 115 2115 2115 HOH HOH A . H 5 HOH 116 2116 2116 HOH HOH A . H 5 HOH 117 2117 2117 HOH HOH A . H 5 HOH 118 2118 2118 HOH HOH A . H 5 HOH 119 2119 2119 HOH HOH A . H 5 HOH 120 2120 2120 HOH HOH A . H 5 HOH 121 2121 2121 HOH HOH A . H 5 HOH 122 2122 2122 HOH HOH A . H 5 HOH 123 2123 2123 HOH HOH A . H 5 HOH 124 2124 2124 HOH HOH A . H 5 HOH 125 2125 2125 HOH HOH A . H 5 HOH 126 2126 2126 HOH HOH A . H 5 HOH 127 2127 2127 HOH HOH A . H 5 HOH 128 2128 2128 HOH HOH A . H 5 HOH 129 2129 2129 HOH HOH A . H 5 HOH 130 2130 2130 HOH HOH A . H 5 HOH 131 2131 2131 HOH HOH A . H 5 HOH 132 2132 2132 HOH HOH A . H 5 HOH 133 2133 2133 HOH HOH A . H 5 HOH 134 2134 2134 HOH HOH A . H 5 HOH 135 2135 2135 HOH HOH A . H 5 HOH 136 2136 2136 HOH HOH A . H 5 HOH 137 2137 2137 HOH HOH A . H 5 HOH 138 2138 2138 HOH HOH A . H 5 HOH 139 2139 2139 HOH HOH A . H 5 HOH 140 2140 2140 HOH HOH A . H 5 HOH 141 2141 2141 HOH HOH A . H 5 HOH 142 2142 2142 HOH HOH A . H 5 HOH 143 2143 2143 HOH HOH A . H 5 HOH 144 2144 2144 HOH HOH A . H 5 HOH 145 2145 2145 HOH HOH A . H 5 HOH 146 2146 2146 HOH HOH A . H 5 HOH 147 2147 2147 HOH HOH A . # 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 9 A ASN 309 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 119 A ASN 419 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 145 A ASN 445 ? ASN 'GLYCOSYLATION SITE' 4 A ASN 174 A ASN 474 ? ASN 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_and_software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _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 # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # _pdbx_struct_special_symmetry.id 1 _pdbx_struct_special_symmetry.PDB_model_num 1 _pdbx_struct_special_symmetry.auth_asym_id A _pdbx_struct_special_symmetry.auth_comp_id HOH _pdbx_struct_special_symmetry.auth_seq_id 2090 _pdbx_struct_special_symmetry.PDB_ins_code ? _pdbx_struct_special_symmetry.label_asym_id H _pdbx_struct_special_symmetry.label_comp_id HOH _pdbx_struct_special_symmetry.label_seq_id . # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 O1 ? F GOL . ? A GOL 1694 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 O ? H HOH . ? A HOH 2084 ? 1_555 89.8 ? 2 O1 ? F GOL . ? A GOL 1694 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 O ? H HOH . ? A HOH 2147 ? 1_555 72.5 ? 3 O ? H HOH . ? A HOH 2084 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 O ? H HOH . ? A HOH 2147 ? 1_555 80.5 ? 4 O1 ? F GOL . ? A GOL 1694 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OE2 ? A GLU 381 ? A GLU 681 ? 2_546 89.3 ? 5 O ? H HOH . ? A HOH 2084 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OE2 ? A GLU 381 ? A GLU 681 ? 2_546 157.9 ? 6 O ? H HOH . ? A HOH 2147 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OE2 ? A GLU 381 ? A GLU 681 ? 2_546 120.1 ? 7 O1 ? F GOL . ? A GOL 1694 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OE1 ? A GLU 381 ? A GLU 681 ? 2_546 93.2 ? 8 O ? H HOH . ? A HOH 2084 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OE1 ? A GLU 381 ? A GLU 681 ? 2_546 153.3 ? 9 O ? H HOH . ? A HOH 2147 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OE1 ? A GLU 381 ? A GLU 681 ? 2_546 75.2 ? 10 OE2 ? A GLU 381 ? A GLU 681 ? 2_546 CA ? G CA . ? A CA 1695 ? 1_555 OE1 ? A GLU 381 ? A GLU 681 ? 2_546 48.8 ? 11 O1 ? F GOL . ? A GOL 1694 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OD2 ? A ASP 194 ? A ASP 494 ? 1_555 155.6 ? 12 O ? H HOH . ? A HOH 2084 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OD2 ? A ASP 194 ? A ASP 494 ? 1_555 83.7 ? 13 O ? H HOH . ? A HOH 2147 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 OD2 ? A ASP 194 ? A ASP 494 ? 1_555 83.2 ? 14 OE2 ? A GLU 381 ? A GLU 681 ? 2_546 CA ? G CA . ? A CA 1695 ? 1_555 OD2 ? A ASP 194 ? A ASP 494 ? 1_555 105.4 ? 15 OE1 ? A GLU 381 ? A GLU 681 ? 2_546 CA ? G CA . ? A CA 1695 ? 1_555 OD2 ? A ASP 194 ? A ASP 494 ? 1_555 82.7 ? 16 O1 ? F GOL . ? A GOL 1694 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 O3 ? F GOL . ? A GOL 1694 ? 1_555 72.3 ? 17 O ? H HOH . ? A HOH 2084 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 O3 ? F GOL . ? A GOL 1694 ? 1_555 94.0 ? 18 O ? H HOH . ? A HOH 2147 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 O3 ? F GOL . ? A GOL 1694 ? 1_555 144.3 ? 19 OE2 ? A GLU 381 ? A GLU 681 ? 2_546 CA ? G CA . ? A CA 1695 ? 1_555 O3 ? F GOL . ? A GOL 1694 ? 1_555 64.8 ? 20 OE1 ? A GLU 381 ? A GLU 681 ? 2_546 CA ? G CA . ? A CA 1695 ? 1_555 O3 ? F GOL . ? A GOL 1694 ? 1_555 112.2 ? 21 OD2 ? A ASP 194 ? A ASP 494 ? 1_555 CA ? G CA . ? A CA 1695 ? 1_555 O3 ? F GOL . ? A GOL 1694 ? 1_555 131.6 ? # 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 2009-11-17 2 'Structure model' 1 1 2011-05-07 3 'Structure model' 1 2 2011-07-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Version format compliance' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal PHENIX refinement '(PHENIX.REFINE)' ? 1 MOSFLM 'data reduction' . ? 2 SCALEPACK 'data scaling' . ? 3 PHASER phasing . ? 4 # _pdbx_database_remark.id 700 _pdbx_database_remark.text ; SHEET THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN ORDER TO REPRESENT THIS FEATURE IN THE SHEET RECORDS BELOW, TWO SHEETS ARE DEFINED. ; # _pdbx_validate_close_contact.id 1 _pdbx_validate_close_contact.PDB_model_num 1 _pdbx_validate_close_contact.auth_atom_id_1 ND2 _pdbx_validate_close_contact.auth_asym_id_1 A _pdbx_validate_close_contact.auth_comp_id_1 ASN _pdbx_validate_close_contact.auth_seq_id_1 309 _pdbx_validate_close_contact.PDB_ins_code_1 ? _pdbx_validate_close_contact.label_alt_id_1 ? _pdbx_validate_close_contact.auth_atom_id_2 C2 _pdbx_validate_close_contact.auth_asym_id_2 A _pdbx_validate_close_contact.auth_comp_id_2 NAG _pdbx_validate_close_contact.auth_seq_id_2 1693 _pdbx_validate_close_contact.PDB_ins_code_2 ? _pdbx_validate_close_contact.label_alt_id_2 ? _pdbx_validate_close_contact.dist 2.16 # 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 LEU A 307 ? ? -160.24 85.72 2 1 ASN A 315 ? ? 78.68 -9.84 3 1 SER A 349 ? ? -112.55 -166.97 4 1 LEU A 350 ? ? -50.80 -77.67 5 1 HIS A 360 ? ? 53.45 93.17 6 1 THR A 465 ? ? -163.65 59.56 7 1 SER A 466 ? ? 153.41 144.78 8 1 ASP A 467 ? ? -68.60 8.76 9 1 SER A 508 ? ? -136.36 -153.45 10 1 THR A 552 ? ? -86.49 33.43 11 1 LYS A 615 ? ? -37.19 132.51 12 1 GLU A 625 ? ? -171.51 119.80 13 1 LYS A 642 ? ? -178.44 132.95 # _pdbx_validate_chiral.id 1 _pdbx_validate_chiral.PDB_model_num 1 _pdbx_validate_chiral.auth_atom_id C1 _pdbx_validate_chiral.label_alt_id ? _pdbx_validate_chiral.auth_asym_id A _pdbx_validate_chiral.auth_comp_id NAG _pdbx_validate_chiral.auth_seq_id 1691 _pdbx_validate_chiral.PDB_ins_code ? _pdbx_validate_chiral.details 'WRONG HAND' _pdbx_validate_chiral.omega . # 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 GLY 346 ? A GLY 46 2 1 Y 1 A ASP 347 ? A ASP 47 3 1 Y 1 A LYS 633 ? A LYS 333 4 1 Y 1 A ASP 634 ? A ASP 334 5 1 Y 1 A LYS 635 ? A LYS 335 6 1 Y 1 A GLU 636 ? A GLU 336 7 1 Y 1 A ASP 637 ? A ASP 337 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 GLYCEROL GOL 4 'CALCIUM ION' CA 5 water HOH #