data_ma-asfv-asfvg-156 _entry.id ma-asfv-asfvg-156 _entry.ma_collection_id ma-asfv-asfvg _struct.entry_id ma-asfv-asfvg-156 _struct.pdbx_model_details 'Model generated using AlphaFold (v2.2.0) producing 5 models with 3 recycles each, with AMBER relaxation, using templates, ranked by pLDDT, starting from an MSA with full_dbs setting.' _struct.pdbx_structure_determination_methodology computational _struct.title 'AlphaFold model for ASFV-G MGF 360-10L' _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/557bda7/base/mmcif_ma-core.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.1 loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI 1 'Highly accurate protein structure prediction with AlphaFold.' Nature 596 583 589 2021 34265844 10.1038/s41586-021-03819-2 loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal 1 'Jumper, J.' 1 1 'Evans, R.' 2 1 'Pritzel, A.' 3 1 'Green, T.' 4 1 'Figurnov, M.' 5 1 'Ronneberger, O.' 6 1 'Tunyasuvunakool, K.' 7 1 'Bates, R.' 8 1 'Zidek, A.' 9 1 'Potapenko, A.' 10 1 'Bridgland, A.' 11 1 'Meyer, C.' 12 1 'Kohl, S.A.A.' 13 1 'Ballard, A.J.' 14 1 'Cowie, A.' 15 1 'Romera-Paredes, B.' 16 1 'Nikolov, S.' 17 1 'Jain, R.' 18 1 'Adler, J.' 19 1 'Back, T.' 20 1 'Petersen, S.' 21 1 'Reiman, D.' 22 1 'Clancy, E.' 23 1 'Zielinski, M.' 24 1 'Steinegger, M.' 25 1 'Pacholska, M.' 26 1 'Berghammer, T.' 27 1 'Bodenstein, S.' 28 1 'Silver, D.' 29 1 'Vinyals, O.' 30 1 'Senior, A.W.' 31 1 'Kavukcuoglu, K.' 32 1 'Kohli, P.' 33 1 'Hassabis, D.' 34 loop_ _software.pdbx_ordinal _software.name _software.classification _software.description _software.version _software.type _software.location _software.citation_id 1 AlphaFold 'model building' 'Structure prediction' 2.2.0 package https://github.com/deepmind/alphafold 1 loop_ _ma_software_parameter.parameter_id _ma_software_parameter.group_id _ma_software_parameter.data_type _ma_software_parameter.name _ma_software_parameter.value _ma_software_parameter.description 1 1 string model_preset monomer . 2 1 string db_preset full_dbs . 3 1 boolean use_gpu_relax YES . 4 1 string max_template_date 2020-05-14 . loop_ _ma_software_group.ordinal_id _ma_software_group.group_id _ma_software_group.software_id _ma_software_group.parameter_group_id 1 1 1 1 loop_ _audit_author.name _audit_author.pdbx_ordinal 'Spinard, Edward' 1 'Azzinaro, Paul' 2 'Rai, Ayushi' 3 'Espinoza, Nallely' 4 'Ramirez-Medina, Elizabeth' 5 'Valladares, Alyssa' 6 'Borca, Manuel' 7 'Gladue, Douglas' 8 loop_ _chem_comp.id _chem_comp.type _chem_comp.name _chem_comp.formula _chem_comp.formula_weight _chem_comp.ma_provenance ALA 'L-peptide linking' ALANINE 'C3 H7 N O2' 89.094 'CCD Core' ARG 'L-peptide linking' ARGININE 'C6 H15 N4 O2 1' 175.212 'CCD Core' ASN 'L-peptide linking' ASPARAGINE 'C4 H8 N2 O3' 132.119 'CCD Core' ASP 'L-peptide linking' 'ASPARTIC ACID' 'C4 H7 N O4' 133.103 'CCD Core' CYS 'L-peptide linking' CYSTEINE 'C3 H7 N O2 S' 121.154 'CCD Core' GLN 'L-peptide linking' GLUTAMINE 'C5 H10 N2 O3' 146.146 'CCD Core' GLU 'L-peptide linking' 'GLUTAMIC ACID' 'C5 H9 N O4' 147.130 'CCD Core' GLY 'peptide linking' GLYCINE 'C2 H5 N O2' 75.067 'CCD Core' HIS 'L-peptide linking' HISTIDINE 'C6 H10 N3 O2 1' 156.165 'CCD Core' ILE 'L-peptide linking' ISOLEUCINE 'C6 H13 N O2' 131.175 'CCD Core' LEU 'L-peptide linking' LEUCINE 'C6 H13 N O2' 131.175 'CCD Core' LYS 'L-peptide linking' LYSINE 'C6 H15 N2 O2 1' 147.198 'CCD Core' MET 'L-peptide linking' METHIONINE 'C5 H11 N O2 S' 149.208 'CCD Core' PHE 'L-peptide linking' PHENYLALANINE 'C9 H11 N O2' 165.192 'CCD Core' PRO 'L-peptide linking' PROLINE 'C5 H9 N O2' 115.132 'CCD Core' SER 'L-peptide linking' SERINE 'C3 H7 N O3' 105.093 'CCD Core' THR 'L-peptide linking' THREONINE 'C4 H9 N O3' 119.120 'CCD Core' TRP 'L-peptide linking' TRYPTOPHAN 'C11 H12 N2 O2' 204.229 'CCD Core' TYR 'L-peptide linking' TYROSINE 'C9 H11 N O3' 181.191 'CCD Core' VAL 'L-peptide linking' VALINE 'C5 H11 N O2' 117.148 'CCD Core' loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.details 1 polymer nat 'ASFV-G MGF 360-10L protein' 46640.992 1 . loop_ _entity_src_nat.entity_id _entity_src_nat.pdbx_src_id _entity_src_nat.pdbx_ncbi_taxonomy_id _entity_src_nat.pdbx_organism_scientific _entity_src_nat.common_name _entity_src_nat.strain 1 1 10497 'African swine fever virus (ASFV)' . . loop_ _ma_target_ref_db_details.target_entity_id _ma_target_ref_db_details.db_name _ma_target_ref_db_details.db_name_other_details _ma_target_ref_db_details.db_code _ma_target_ref_db_details.db_accession _ma_target_ref_db_details.seq_db_isoform _ma_target_ref_db_details.seq_db_align_begin _ma_target_ref_db_details.seq_db_align_end _ma_target_ref_db_details.ncbi_taxonomy_id _ma_target_ref_db_details.organism_scientific _ma_target_ref_db_details.seq_db_sequence_version_date _ma_target_ref_db_details.seq_db_sequence_checksum 1 UNP . A0A2X0TC36_ASF A0A2X0TC36 . 1 345 10497 'African swine fever virus (ASFV)' 2018-09-12 EDE070070453ECD2 1 NCBI . CAD2068378.1 1886136903 . 1 345 10497 'African swine fever virus (ASFV)' 2020-08-05 . loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_strand_id _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can 1 polypeptide(L) no no A ;MFPSLQSFAKKVLARQQVSIEYHVILERCGLWWYKAPISLDCKHMLIKLPSFADGLDLNTALMLATKENN YQLIKLFTEWGADINYGLICANTPPVREFCWELGAKYRVDKKKIMHMFFKLIHPGTTSSNIILCLKLFND NPFPAYVIIREIRSSIYWKLKRLVEDTDILSNMSDGDMLTIYCFIVALQDNLREAISYVYQHFKYLNTWW LICALCFNKLFDLHNLYEKEKIRMDVDEMMRMACTKDNNFLTIYYCFLLGANINSAMLACVRFYNMDNLF FCIDLGADAFEEAKALAEQRNYYLISHHLSLDIYSADSSLLTLKEADPNKIYHLLKNYKLKSMLA ; ;MFPSLQSFAKKVLARQQVSIEYHVILERCGLWWYKAPISLDCKHMLIKLPSFADGLDLNTALMLATKENN YQLIKLFTEWGADINYGLICANTPPVREFCWELGAKYRVDKKKIMHMFFKLIHPGTTSSNIILCLKLFND NPFPAYVIIREIRSSIYWKLKRLVEDTDILSNMSDGDMLTIYCFIVALQDNLREAISYVYQHFKYLNTWW LICALCFNKLFDLHNLYEKEKIRMDVDEMMRMACTKDNNFLTIYYCFLLGANINSAMLACVRFYNMDNLF FCIDLGADAFEEAKALAEQRNYYLISHHLSLDIYSADSSLLTLKEADPNKIYHLLKNYKLKSMLA ; loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 MET . 1 2 PHE . 1 3 PRO . 1 4 SER . 1 5 LEU . 1 6 GLN . 1 7 SER . 1 8 PHE . 1 9 ALA . 1 10 LYS . 1 11 LYS . 1 12 VAL . 1 13 LEU . 1 14 ALA . 1 15 ARG . 1 16 GLN . 1 17 GLN . 1 18 VAL . 1 19 SER . 1 20 ILE . 1 21 GLU . 1 22 TYR . 1 23 HIS . 1 24 VAL . 1 25 ILE . 1 26 LEU . 1 27 GLU . 1 28 ARG . 1 29 CYS . 1 30 GLY . 1 31 LEU . 1 32 TRP . 1 33 TRP . 1 34 TYR . 1 35 LYS . 1 36 ALA . 1 37 PRO . 1 38 ILE . 1 39 SER . 1 40 LEU . 1 41 ASP . 1 42 CYS . 1 43 LYS . 1 44 HIS . 1 45 MET . 1 46 LEU . 1 47 ILE . 1 48 LYS . 1 49 LEU . 1 50 PRO . 1 51 SER . 1 52 PHE . 1 53 ALA . 1 54 ASP . 1 55 GLY . 1 56 LEU . 1 57 ASP . 1 58 LEU . 1 59 ASN . 1 60 THR . 1 61 ALA . 1 62 LEU . 1 63 MET . 1 64 LEU . 1 65 ALA . 1 66 THR . 1 67 LYS . 1 68 GLU . 1 69 ASN . 1 70 ASN . 1 71 TYR . 1 72 GLN . 1 73 LEU . 1 74 ILE . 1 75 LYS . 1 76 LEU . 1 77 PHE . 1 78 THR . 1 79 GLU . 1 80 TRP . 1 81 GLY . 1 82 ALA . 1 83 ASP . 1 84 ILE . 1 85 ASN . 1 86 TYR . 1 87 GLY . 1 88 LEU . 1 89 ILE . 1 90 CYS . 1 91 ALA . 1 92 ASN . 1 93 THR . 1 94 PRO . 1 95 PRO . 1 96 VAL . 1 97 ARG . 1 98 GLU . 1 99 PHE . 1 100 CYS . 1 101 TRP . 1 102 GLU . 1 103 LEU . 1 104 GLY . 1 105 ALA . 1 106 LYS . 1 107 TYR . 1 108 ARG . 1 109 VAL . 1 110 ASP . 1 111 LYS . 1 112 LYS . 1 113 LYS . 1 114 ILE . 1 115 MET . 1 116 HIS . 1 117 MET . 1 118 PHE . 1 119 PHE . 1 120 LYS . 1 121 LEU . 1 122 ILE . 1 123 HIS . 1 124 PRO . 1 125 GLY . 1 126 THR . 1 127 THR . 1 128 SER . 1 129 SER . 1 130 ASN . 1 131 ILE . 1 132 ILE . 1 133 LEU . 1 134 CYS . 1 135 LEU . 1 136 LYS . 1 137 LEU . 1 138 PHE . 1 139 ASN . 1 140 ASP . 1 141 ASN . 1 142 PRO . 1 143 PHE . 1 144 PRO . 1 145 ALA . 1 146 TYR . 1 147 VAL . 1 148 ILE . 1 149 ILE . 1 150 ARG . 1 151 GLU . 1 152 ILE . 1 153 ARG . 1 154 SER . 1 155 SER . 1 156 ILE . 1 157 TYR . 1 158 TRP . 1 159 LYS . 1 160 LEU . 1 161 LYS . 1 162 ARG . 1 163 LEU . 1 164 VAL . 1 165 GLU . 1 166 ASP . 1 167 THR . 1 168 ASP . 1 169 ILE . 1 170 LEU . 1 171 SER . 1 172 ASN . 1 173 MET . 1 174 SER . 1 175 ASP . 1 176 GLY . 1 177 ASP . 1 178 MET . 1 179 LEU . 1 180 THR . 1 181 ILE . 1 182 TYR . 1 183 CYS . 1 184 PHE . 1 185 ILE . 1 186 VAL . 1 187 ALA . 1 188 LEU . 1 189 GLN . 1 190 ASP . 1 191 ASN . 1 192 LEU . 1 193 ARG . 1 194 GLU . 1 195 ALA . 1 196 ILE . 1 197 SER . 1 198 TYR . 1 199 VAL . 1 200 TYR . 1 201 GLN . 1 202 HIS . 1 203 PHE . 1 204 LYS . 1 205 TYR . 1 206 LEU . 1 207 ASN . 1 208 THR . 1 209 TRP . 1 210 TRP . 1 211 LEU . 1 212 ILE . 1 213 CYS . 1 214 ALA . 1 215 LEU . 1 216 CYS . 1 217 PHE . 1 218 ASN . 1 219 LYS . 1 220 LEU . 1 221 PHE . 1 222 ASP . 1 223 LEU . 1 224 HIS . 1 225 ASN . 1 226 LEU . 1 227 TYR . 1 228 GLU . 1 229 LYS . 1 230 GLU . 1 231 LYS . 1 232 ILE . 1 233 ARG . 1 234 MET . 1 235 ASP . 1 236 VAL . 1 237 ASP . 1 238 GLU . 1 239 MET . 1 240 MET . 1 241 ARG . 1 242 MET . 1 243 ALA . 1 244 CYS . 1 245 THR . 1 246 LYS . 1 247 ASP . 1 248 ASN . 1 249 ASN . 1 250 PHE . 1 251 LEU . 1 252 THR . 1 253 ILE . 1 254 TYR . 1 255 TYR . 1 256 CYS . 1 257 PHE . 1 258 LEU . 1 259 LEU . 1 260 GLY . 1 261 ALA . 1 262 ASN . 1 263 ILE . 1 264 ASN . 1 265 SER . 1 266 ALA . 1 267 MET . 1 268 LEU . 1 269 ALA . 1 270 CYS . 1 271 VAL . 1 272 ARG . 1 273 PHE . 1 274 TYR . 1 275 ASN . 1 276 MET . 1 277 ASP . 1 278 ASN . 1 279 LEU . 1 280 PHE . 1 281 PHE . 1 282 CYS . 1 283 ILE . 1 284 ASP . 1 285 LEU . 1 286 GLY . 1 287 ALA . 1 288 ASP . 1 289 ALA . 1 290 PHE . 1 291 GLU . 1 292 GLU . 1 293 ALA . 1 294 LYS . 1 295 ALA . 1 296 LEU . 1 297 ALA . 1 298 GLU . 1 299 GLN . 1 300 ARG . 1 301 ASN . 1 302 TYR . 1 303 TYR . 1 304 LEU . 1 305 ILE . 1 306 SER . 1 307 HIS . 1 308 HIS . 1 309 LEU . 1 310 SER . 1 311 LEU . 1 312 ASP . 1 313 ILE . 1 314 TYR . 1 315 SER . 1 316 ALA . 1 317 ASP . 1 318 SER . 1 319 SER . 1 320 LEU . 1 321 LEU . 1 322 THR . 1 323 LEU . 1 324 LYS . 1 325 GLU . 1 326 ALA . 1 327 ASP . 1 328 PRO . 1 329 ASN . 1 330 LYS . 1 331 ILE . 1 332 TYR . 1 333 HIS . 1 334 LEU . 1 335 LEU . 1 336 LYS . 1 337 ASN . 1 338 TYR . 1 339 LYS . 1 340 LEU . 1 341 LYS . 1 342 SER . 1 343 MET . 1 344 LEU . 1 345 ALA . loop_ _struct_asym.id _struct_asym.entity_id _struct_asym.details A 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.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 A 1 1 MET 1 1 MET MET A . A 1 2 PHE 2 2 PHE PHE A . A 1 3 PRO 3 3 PRO PRO A . A 1 4 SER 4 4 SER SER A . A 1 5 LEU 5 5 LEU LEU A . A 1 6 GLN 6 6 GLN GLN A . A 1 7 SER 7 7 SER SER A . A 1 8 PHE 8 8 PHE PHE A . A 1 9 ALA 9 9 ALA ALA A . A 1 10 LYS 10 10 LYS LYS A . A 1 11 LYS 11 11 LYS LYS A . A 1 12 VAL 12 12 VAL VAL A . A 1 13 LEU 13 13 LEU LEU A . A 1 14 ALA 14 14 ALA ALA A . A 1 15 ARG 15 15 ARG ARG A . A 1 16 GLN 16 16 GLN GLN A . A 1 17 GLN 17 17 GLN GLN A . A 1 18 VAL 18 18 VAL VAL A . A 1 19 SER 19 19 SER SER A . A 1 20 ILE 20 20 ILE ILE A . A 1 21 GLU 21 21 GLU GLU A . A 1 22 TYR 22 22 TYR TYR A . A 1 23 HIS 23 23 HIS HIS A . A 1 24 VAL 24 24 VAL VAL A . A 1 25 ILE 25 25 ILE ILE A . A 1 26 LEU 26 26 LEU LEU A . A 1 27 GLU 27 27 GLU GLU A . A 1 28 ARG 28 28 ARG ARG A . A 1 29 CYS 29 29 CYS CYS A . A 1 30 GLY 30 30 GLY GLY A . A 1 31 LEU 31 31 LEU LEU A . A 1 32 TRP 32 32 TRP TRP A . A 1 33 TRP 33 33 TRP TRP A . A 1 34 TYR 34 34 TYR TYR A . A 1 35 LYS 35 35 LYS LYS A . A 1 36 ALA 36 36 ALA ALA A . A 1 37 PRO 37 37 PRO PRO A . A 1 38 ILE 38 38 ILE ILE A . A 1 39 SER 39 39 SER SER A . A 1 40 LEU 40 40 LEU LEU A . A 1 41 ASP 41 41 ASP ASP A . A 1 42 CYS 42 42 CYS CYS A . A 1 43 LYS 43 43 LYS LYS A . A 1 44 HIS 44 44 HIS HIS A . A 1 45 MET 45 45 MET MET A . A 1 46 LEU 46 46 LEU LEU A . A 1 47 ILE 47 47 ILE ILE A . A 1 48 LYS 48 48 LYS LYS A . A 1 49 LEU 49 49 LEU LEU A . A 1 50 PRO 50 50 PRO PRO A . A 1 51 SER 51 51 SER SER A . A 1 52 PHE 52 52 PHE PHE A . A 1 53 ALA 53 53 ALA ALA A . A 1 54 ASP 54 54 ASP ASP A . A 1 55 GLY 55 55 GLY GLY A . A 1 56 LEU 56 56 LEU LEU A . A 1 57 ASP 57 57 ASP ASP A . A 1 58 LEU 58 58 LEU LEU A . A 1 59 ASN 59 59 ASN ASN A . A 1 60 THR 60 60 THR THR A . A 1 61 ALA 61 61 ALA ALA A . A 1 62 LEU 62 62 LEU LEU A . A 1 63 MET 63 63 MET MET A . A 1 64 LEU 64 64 LEU LEU A . A 1 65 ALA 65 65 ALA ALA A . A 1 66 THR 66 66 THR THR A . A 1 67 LYS 67 67 LYS LYS A . A 1 68 GLU 68 68 GLU GLU A . A 1 69 ASN 69 69 ASN ASN A . A 1 70 ASN 70 70 ASN ASN A . A 1 71 TYR 71 71 TYR TYR A . A 1 72 GLN 72 72 GLN GLN A . A 1 73 LEU 73 73 LEU LEU A . A 1 74 ILE 74 74 ILE ILE A . A 1 75 LYS 75 75 LYS LYS A . A 1 76 LEU 76 76 LEU LEU A . A 1 77 PHE 77 77 PHE PHE A . A 1 78 THR 78 78 THR THR A . A 1 79 GLU 79 79 GLU GLU A . A 1 80 TRP 80 80 TRP TRP A . A 1 81 GLY 81 81 GLY GLY A . A 1 82 ALA 82 82 ALA ALA A . A 1 83 ASP 83 83 ASP ASP A . A 1 84 ILE 84 84 ILE ILE A . A 1 85 ASN 85 85 ASN ASN A . A 1 86 TYR 86 86 TYR TYR A . A 1 87 GLY 87 87 GLY GLY A . A 1 88 LEU 88 88 LEU LEU A . A 1 89 ILE 89 89 ILE ILE A . A 1 90 CYS 90 90 CYS CYS A . A 1 91 ALA 91 91 ALA ALA A . A 1 92 ASN 92 92 ASN ASN A . A 1 93 THR 93 93 THR THR A . A 1 94 PRO 94 94 PRO PRO A . A 1 95 PRO 95 95 PRO PRO A . A 1 96 VAL 96 96 VAL VAL A . A 1 97 ARG 97 97 ARG ARG A . A 1 98 GLU 98 98 GLU GLU A . A 1 99 PHE 99 99 PHE PHE A . A 1 100 CYS 100 100 CYS CYS A . A 1 101 TRP 101 101 TRP TRP A . A 1 102 GLU 102 102 GLU GLU A . A 1 103 LEU 103 103 LEU LEU A . A 1 104 GLY 104 104 GLY GLY A . A 1 105 ALA 105 105 ALA ALA A . A 1 106 LYS 106 106 LYS LYS A . A 1 107 TYR 107 107 TYR TYR A . A 1 108 ARG 108 108 ARG ARG A . A 1 109 VAL 109 109 VAL VAL A . A 1 110 ASP 110 110 ASP ASP A . A 1 111 LYS 111 111 LYS LYS A . A 1 112 LYS 112 112 LYS LYS A . A 1 113 LYS 113 113 LYS LYS A . A 1 114 ILE 114 114 ILE ILE A . A 1 115 MET 115 115 MET MET A . A 1 116 HIS 116 116 HIS HIS A . A 1 117 MET 117 117 MET MET A . A 1 118 PHE 118 118 PHE PHE A . A 1 119 PHE 119 119 PHE PHE A . A 1 120 LYS 120 120 LYS LYS A . A 1 121 LEU 121 121 LEU LEU A . A 1 122 ILE 122 122 ILE ILE A . A 1 123 HIS 123 123 HIS HIS A . A 1 124 PRO 124 124 PRO PRO A . A 1 125 GLY 125 125 GLY GLY A . A 1 126 THR 126 126 THR THR A . A 1 127 THR 127 127 THR THR A . A 1 128 SER 128 128 SER SER A . A 1 129 SER 129 129 SER SER A . A 1 130 ASN 130 130 ASN ASN A . A 1 131 ILE 131 131 ILE ILE A . A 1 132 ILE 132 132 ILE ILE A . A 1 133 LEU 133 133 LEU LEU A . A 1 134 CYS 134 134 CYS CYS A . A 1 135 LEU 135 135 LEU LEU A . A 1 136 LYS 136 136 LYS LYS A . A 1 137 LEU 137 137 LEU LEU A . A 1 138 PHE 138 138 PHE PHE A . A 1 139 ASN 139 139 ASN ASN A . A 1 140 ASP 140 140 ASP ASP A . A 1 141 ASN 141 141 ASN ASN A . A 1 142 PRO 142 142 PRO PRO A . A 1 143 PHE 143 143 PHE PHE A . A 1 144 PRO 144 144 PRO PRO A . A 1 145 ALA 145 145 ALA ALA A . A 1 146 TYR 146 146 TYR TYR A . A 1 147 VAL 147 147 VAL VAL A . A 1 148 ILE 148 148 ILE ILE A . A 1 149 ILE 149 149 ILE ILE A . A 1 150 ARG 150 150 ARG ARG A . A 1 151 GLU 151 151 GLU GLU A . A 1 152 ILE 152 152 ILE ILE A . A 1 153 ARG 153 153 ARG ARG A . A 1 154 SER 154 154 SER SER A . A 1 155 SER 155 155 SER SER A . A 1 156 ILE 156 156 ILE ILE A . A 1 157 TYR 157 157 TYR TYR A . A 1 158 TRP 158 158 TRP TRP A . A 1 159 LYS 159 159 LYS LYS A . A 1 160 LEU 160 160 LEU LEU A . A 1 161 LYS 161 161 LYS LYS A . A 1 162 ARG 162 162 ARG ARG A . A 1 163 LEU 163 163 LEU LEU A . A 1 164 VAL 164 164 VAL VAL A . A 1 165 GLU 165 165 GLU GLU A . A 1 166 ASP 166 166 ASP ASP A . A 1 167 THR 167 167 THR THR A . A 1 168 ASP 168 168 ASP ASP A . A 1 169 ILE 169 169 ILE ILE A . A 1 170 LEU 170 170 LEU LEU A . A 1 171 SER 171 171 SER SER A . A 1 172 ASN 172 172 ASN ASN A . A 1 173 MET 173 173 MET MET A . A 1 174 SER 174 174 SER SER A . A 1 175 ASP 175 175 ASP ASP A . A 1 176 GLY 176 176 GLY GLY A . A 1 177 ASP 177 177 ASP ASP A . A 1 178 MET 178 178 MET MET A . A 1 179 LEU 179 179 LEU LEU A . A 1 180 THR 180 180 THR THR A . A 1 181 ILE 181 181 ILE ILE A . A 1 182 TYR 182 182 TYR TYR A . A 1 183 CYS 183 183 CYS CYS A . A 1 184 PHE 184 184 PHE PHE A . A 1 185 ILE 185 185 ILE ILE A . A 1 186 VAL 186 186 VAL VAL A . A 1 187 ALA 187 187 ALA ALA A . A 1 188 LEU 188 188 LEU LEU A . A 1 189 GLN 189 189 GLN GLN A . A 1 190 ASP 190 190 ASP ASP A . A 1 191 ASN 191 191 ASN ASN A . A 1 192 LEU 192 192 LEU LEU A . A 1 193 ARG 193 193 ARG ARG A . A 1 194 GLU 194 194 GLU GLU A . A 1 195 ALA 195 195 ALA ALA A . A 1 196 ILE 196 196 ILE ILE A . A 1 197 SER 197 197 SER SER A . A 1 198 TYR 198 198 TYR TYR A . A 1 199 VAL 199 199 VAL VAL A . A 1 200 TYR 200 200 TYR TYR A . A 1 201 GLN 201 201 GLN GLN A . A 1 202 HIS 202 202 HIS HIS A . A 1 203 PHE 203 203 PHE PHE A . A 1 204 LYS 204 204 LYS LYS A . A 1 205 TYR 205 205 TYR TYR A . A 1 206 LEU 206 206 LEU LEU A . A 1 207 ASN 207 207 ASN ASN A . A 1 208 THR 208 208 THR THR A . A 1 209 TRP 209 209 TRP TRP A . A 1 210 TRP 210 210 TRP TRP A . A 1 211 LEU 211 211 LEU LEU A . A 1 212 ILE 212 212 ILE ILE A . A 1 213 CYS 213 213 CYS CYS A . A 1 214 ALA 214 214 ALA ALA A . A 1 215 LEU 215 215 LEU LEU A . A 1 216 CYS 216 216 CYS CYS A . A 1 217 PHE 217 217 PHE PHE A . A 1 218 ASN 218 218 ASN ASN A . A 1 219 LYS 219 219 LYS LYS A . A 1 220 LEU 220 220 LEU LEU A . A 1 221 PHE 221 221 PHE PHE A . A 1 222 ASP 222 222 ASP ASP A . A 1 223 LEU 223 223 LEU LEU A . A 1 224 HIS 224 224 HIS HIS A . A 1 225 ASN 225 225 ASN ASN A . A 1 226 LEU 226 226 LEU LEU A . A 1 227 TYR 227 227 TYR TYR A . A 1 228 GLU 228 228 GLU GLU A . A 1 229 LYS 229 229 LYS LYS A . A 1 230 GLU 230 230 GLU GLU A . A 1 231 LYS 231 231 LYS LYS A . A 1 232 ILE 232 232 ILE ILE A . A 1 233 ARG 233 233 ARG ARG A . A 1 234 MET 234 234 MET MET A . A 1 235 ASP 235 235 ASP ASP A . A 1 236 VAL 236 236 VAL VAL A . A 1 237 ASP 237 237 ASP ASP A . A 1 238 GLU 238 238 GLU GLU A . A 1 239 MET 239 239 MET MET A . A 1 240 MET 240 240 MET MET A . A 1 241 ARG 241 241 ARG ARG A . A 1 242 MET 242 242 MET MET A . A 1 243 ALA 243 243 ALA ALA A . A 1 244 CYS 244 244 CYS CYS A . A 1 245 THR 245 245 THR THR A . A 1 246 LYS 246 246 LYS LYS A . A 1 247 ASP 247 247 ASP ASP A . A 1 248 ASN 248 248 ASN ASN A . A 1 249 ASN 249 249 ASN ASN A . A 1 250 PHE 250 250 PHE PHE A . A 1 251 LEU 251 251 LEU LEU A . A 1 252 THR 252 252 THR THR A . A 1 253 ILE 253 253 ILE ILE A . A 1 254 TYR 254 254 TYR TYR A . A 1 255 TYR 255 255 TYR TYR A . A 1 256 CYS 256 256 CYS CYS A . A 1 257 PHE 257 257 PHE PHE A . A 1 258 LEU 258 258 LEU LEU A . A 1 259 LEU 259 259 LEU LEU A . A 1 260 GLY 260 260 GLY GLY A . A 1 261 ALA 261 261 ALA ALA A . A 1 262 ASN 262 262 ASN ASN A . A 1 263 ILE 263 263 ILE ILE A . A 1 264 ASN 264 264 ASN ASN A . A 1 265 SER 265 265 SER SER A . A 1 266 ALA 266 266 ALA ALA A . A 1 267 MET 267 267 MET MET A . A 1 268 LEU 268 268 LEU LEU A . A 1 269 ALA 269 269 ALA ALA A . A 1 270 CYS 270 270 CYS CYS A . A 1 271 VAL 271 271 VAL VAL A . A 1 272 ARG 272 272 ARG ARG A . A 1 273 PHE 273 273 PHE PHE A . A 1 274 TYR 274 274 TYR TYR A . A 1 275 ASN 275 275 ASN ASN A . A 1 276 MET 276 276 MET MET A . A 1 277 ASP 277 277 ASP ASP A . A 1 278 ASN 278 278 ASN ASN A . A 1 279 LEU 279 279 LEU LEU A . A 1 280 PHE 280 280 PHE PHE A . A 1 281 PHE 281 281 PHE PHE A . A 1 282 CYS 282 282 CYS CYS A . A 1 283 ILE 283 283 ILE ILE A . A 1 284 ASP 284 284 ASP ASP A . A 1 285 LEU 285 285 LEU LEU A . A 1 286 GLY 286 286 GLY GLY A . A 1 287 ALA 287 287 ALA ALA A . A 1 288 ASP 288 288 ASP ASP A . A 1 289 ALA 289 289 ALA ALA A . A 1 290 PHE 290 290 PHE PHE A . A 1 291 GLU 291 291 GLU GLU A . A 1 292 GLU 292 292 GLU GLU A . A 1 293 ALA 293 293 ALA ALA A . A 1 294 LYS 294 294 LYS LYS A . A 1 295 ALA 295 295 ALA ALA A . A 1 296 LEU 296 296 LEU LEU A . A 1 297 ALA 297 297 ALA ALA A . A 1 298 GLU 298 298 GLU GLU A . A 1 299 GLN 299 299 GLN GLN A . A 1 300 ARG 300 300 ARG ARG A . A 1 301 ASN 301 301 ASN ASN A . A 1 302 TYR 302 302 TYR TYR A . A 1 303 TYR 303 303 TYR TYR A . A 1 304 LEU 304 304 LEU LEU A . A 1 305 ILE 305 305 ILE ILE A . A 1 306 SER 306 306 SER SER A . A 1 307 HIS 307 307 HIS HIS A . A 1 308 HIS 308 308 HIS HIS A . A 1 309 LEU 309 309 LEU LEU A . A 1 310 SER 310 310 SER SER A . A 1 311 LEU 311 311 LEU LEU A . A 1 312 ASP 312 312 ASP ASP A . A 1 313 ILE 313 313 ILE ILE A . A 1 314 TYR 314 314 TYR TYR A . A 1 315 SER 315 315 SER SER A . A 1 316 ALA 316 316 ALA ALA A . A 1 317 ASP 317 317 ASP ASP A . A 1 318 SER 318 318 SER SER A . A 1 319 SER 319 319 SER SER A . A 1 320 LEU 320 320 LEU LEU A . A 1 321 LEU 321 321 LEU LEU A . A 1 322 THR 322 322 THR THR A . A 1 323 LEU 323 323 LEU LEU A . A 1 324 LYS 324 324 LYS LYS A . A 1 325 GLU 325 325 GLU GLU A . A 1 326 ALA 326 326 ALA ALA A . A 1 327 ASP 327 327 ASP ASP A . A 1 328 PRO 328 328 PRO PRO A . A 1 329 ASN 329 329 ASN ASN A . A 1 330 LYS 330 330 LYS LYS A . A 1 331 ILE 331 331 ILE ILE A . A 1 332 TYR 332 332 TYR TYR A . A 1 333 HIS 333 333 HIS HIS A . A 1 334 LEU 334 334 LEU LEU A . A 1 335 LEU 335 335 LEU LEU A . A 1 336 LYS 336 336 LYS LYS A . A 1 337 ASN 337 337 ASN ASN A . A 1 338 TYR 338 338 TYR TYR A . A 1 339 LYS 339 339 LYS LYS A . A 1 340 LEU 340 340 LEU LEU A . A 1 341 LYS 341 341 LYS LYS A . A 1 342 SER 342 342 SER SER A . A 1 343 MET 343 343 MET MET A . A 1 344 LEU 344 344 LEU LEU A . A 1 345 ALA 345 345 ALA ALA A . loop_ _ma_data.id _ma_data.name _ma_data.content_type _ma_data.content_type_other_details 1 'ASFV-G MGF 360-10L protein' target . 2 'Model 3 (top ranked model)' 'model coordinates' . 3 BFD 'reference database' . 4 MGnify 'reference database' . 5 Uniclust30 'reference database' . 8 UniRef90 'reference database' . 9 PDB70 'reference database' . loop_ _ma_data_group.ordinal_id _ma_data_group.group_id _ma_data_group.data_id 1 1 1 2 1 3 3 1 4 4 1 5 7 1 8 8 1 9 9 2 2 loop_ _ma_data_ref_db.data_id _ma_data_ref_db.name _ma_data_ref_db.location_url _ma_data_ref_db.version _ma_data_ref_db.release_date 3 BFD https://storage.googleapis.com/alphafold-databases/casp14_versions/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt.tar.gz 6a634dc6eb105c2e9b4cba7bbae93412 . 4 MGnify https://storage.googleapis.com/alphafold-databases/casp14_versions/mgy_clusters_2018_12.fa.gz 2018_12 2018-12-06 5 Uniclust30 https://storage.googleapis.com/alphafold-databases/casp14_versions/uniclust30_2018_08_hhsuite.tar.gz 2018_08 . 8 UniRef90 ftp://ftp.uniprot.org/pub/databases/uniprot/uniref/uniref90/uniref90.fasta.gz 2022_01 2022-02-23 9 PDB70 http://wwwuser.gwdg.de/~compbiol/data/hhsuite/databases/hhsuite_dbs/old-releases/pdb70_from_mmcif_200401.tar.gz . 2020-04-01 loop_ _ma_target_entity.entity_id _ma_target_entity.data_id _ma_target_entity.origin 1 1 'reference database' loop_ _ma_target_entity_instance.asym_id _ma_target_entity_instance.entity_id _ma_target_entity_instance.details A 1 . loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type _ma_protocol_step.step_name _ma_protocol_step.details _ma_protocol_step.software_group_id _ma_protocol_step.input_data_group_id _ma_protocol_step.output_data_group_id 1 1 1 modeling . 'Model generated using AlphaFold (v2.2.0) producing 5 models with 3 recycles each, with AMBER relaxation, using templates, ranked by pLDDT, starting from an MSA with full_dbs setting.' 1 1 2 loop_ _ma_model_list.ordinal_id _ma_model_list.model_id _ma_model_list.model_group_id _ma_model_list.model_name _ma_model_list.model_group_name _ma_model_list.data_id _ma_model_list.model_type _ma_model_list.model_type_other_details 1 1 1 'Model 3 (top ranked model)' . 2 'Ab initio model' . 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_seq_id _atom_site.auth_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.label_asym_id _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.label_entity_id _atom_site.auth_asym_id _atom_site.B_iso_or_equiv _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET 1 1 ? A 35.667 -3.723 -18.298 1.000 1 A 55.530 1 ATOM 2 C CA . MET 1 1 ? A 35.872 -2.794 -19.429 1.000 1 A 55.530 1 ATOM 3 C C . MET 1 1 ? A 36.469 -1.516 -18.863 1.000 1 A 55.530 1 ATOM 4 O O . MET 1 1 ? A 35.954 -1.046 -17.857 1.000 1 A 55.530 1 ATOM 5 C CB . MET 1 1 ? A 34.526 -2.543 -20.127 1.000 1 A 55.530 1 ATOM 6 C CG . MET 1 1 ? A 34.643 -1.897 -21.508 1.000 1 A 55.530 1 ATOM 7 S SD . MET 1 1 ? A 33.033 -1.848 -22.333 1.000 1 A 55.530 1 ATOM 8 C CE . MET 1 1 ? A 33.521 -1.388 -24.016 1.000 1 A 55.530 1 ATOM 9 H H . MET 1 1 ? A 35.207 -4.565 -18.612 1.000 1 A 55.530 1 ATOM 10 H H2 . MET 1 1 ? A 36.550 -3.953 -17.865 1.000 1 A 55.530 1 ATOM 11 H HA . MET 1 1 ? A 36.567 -3.232 -20.145 1.000 1 A 55.530 1 ATOM 12 H HB2 . MET 1 1 ? A 34.029 -3.503 -20.263 1.000 1 A 55.530 1 ATOM 13 H HB3 . MET 1 1 ? A 33.890 -1.924 -19.494 1.000 1 A 55.530 1 ATOM 14 H HG2 . MET 1 1 ? A 35.329 -2.485 -22.119 1.000 1 A 55.530 1 ATOM 15 H HG3 . MET 1 1 ? A 35.031 -0.883 -21.413 1.000 1 A 55.530 1 ATOM 16 H HE1 . MET 1 1 ? A 32.632 -1.323 -24.643 1.000 1 A 55.530 1 ATOM 17 H HE2 . MET 1 1 ? A 34.191 -2.144 -24.426 1.000 1 A 55.530 1 ATOM 18 H HE3 . MET 1 1 ? A 34.024 -0.421 -24.002 1.000 1 A 55.530 1 ATOM 19 H H3 . MET 1 1 ? A 35.086 -3.264 -17.610 1.000 1 A 55.530 1 ATOM 20 N N . PHE 2 2 ? A 37.573 -1.003 -19.410 1.000 1 A 69.750 1 ATOM 21 C CA . PHE 2 2 ? A 38.076 0.308 -18.983 1.000 1 A 69.750 1 ATOM 22 C C . PHE 2 2 ? A 37.117 1.399 -19.485 1.000 1 A 69.750 1 ATOM 23 O O . PHE 2 2 ? A 36.659 1.293 -20.626 1.000 1 A 69.750 1 ATOM 24 C CB . PHE 2 2 ? A 39.510 0.533 -19.484 1.000 1 A 69.750 1 ATOM 25 C CG . PHE 2 2 ? A 40.549 -0.277 -18.733 1.000 1 A 69.750 1 ATOM 26 C CD1 . PHE 2 2 ? A 41.003 0.167 -17.475 1.000 1 A 69.750 1 ATOM 27 C CD2 . PHE 2 2 ? A 41.065 -1.468 -19.279 1.000 1 A 69.750 1 ATOM 28 C CE1 . PHE 2 2 ? A 41.962 -0.577 -16.766 1.000 1 A 69.750 1 ATOM 29 C CE2 . PHE 2 2 ? A 42.023 -2.213 -18.567 1.000 1 A 69.750 1 ATOM 30 C CZ . PHE 2 2 ? A 42.471 -1.768 -17.311 1.000 1 A 69.750 1 ATOM 31 H H . PHE 2 2 ? A 37.959 -1.387 -20.260 1.000 1 A 69.750 1 ATOM 32 H HA . PHE 2 2 ? A 38.096 0.330 -17.893 1.000 1 A 69.750 1 ATOM 33 H HB2 . PHE 2 2 ? A 39.757 1.588 -19.363 1.000 1 A 69.750 1 ATOM 34 H HB3 . PHE 2 2 ? A 39.564 0.312 -20.550 1.000 1 A 69.750 1 ATOM 35 H HD1 . PHE 2 2 ? A 40.626 1.089 -17.057 1.000 1 A 69.750 1 ATOM 36 H HD2 . PHE 2 2 ? A 40.745 -1.803 -20.254 1.000 1 A 69.750 1 ATOM 37 H HE1 . PHE 2 2 ? A 42.321 -0.228 -15.809 1.000 1 A 69.750 1 ATOM 38 H HE2 . PHE 2 2 ? A 42.432 -3.117 -18.992 1.000 1 A 69.750 1 ATOM 39 H HZ . PHE 2 2 ? A 43.218 -2.332 -16.773 1.000 1 A 69.750 1 ATOM 40 N N . PRO 3 3 ? A 36.774 2.413 -18.669 1.000 1 A 74.020 1 ATOM 41 C CA . PRO 3 3 ? A 35.915 3.501 -19.120 1.000 1 A 74.020 1 ATOM 42 C C . PRO 3 3 ? A 36.579 4.237 -20.286 1.000 1 A 74.020 1 ATOM 43 O O . PRO 3 3 ? A 37.786 4.481 -20.269 1.000 1 A 74.020 1 ATOM 44 C CB . PRO 3 3 ? A 35.700 4.404 -17.900 1.000 1 A 74.020 1 ATOM 45 C CG . PRO 3 3 ? A 36.910 4.113 -17.013 1.000 1 A 74.020 1 ATOM 46 C CD . PRO 3 3 ? A 37.234 2.650 -17.310 1.000 1 A 74.020 1 ATOM 47 H HA . PRO 3 3 ? A 34.954 3.103 -19.447 1.000 1 A 74.020 1 ATOM 48 H HB2 . PRO 3 3 ? A 34.789 4.101 -17.384 1.000 1 A 74.020 1 ATOM 49 H HB3 . PRO 3 3 ? A 35.649 5.459 -18.168 1.000 1 A 74.020 1 ATOM 50 H HG2 . PRO 3 3 ? A 37.747 4.738 -17.324 1.000 1 A 74.020 1 ATOM 51 H HG3 . PRO 3 3 ? A 36.687 4.271 -15.958 1.000 1 A 74.020 1 ATOM 52 H HD2 . PRO 3 3 ? A 38.307 2.482 -17.215 1.000 1 A 74.020 1 ATOM 53 H HD3 . PRO 3 3 ? A 36.684 2.004 -16.627 1.000 1 A 74.020 1 ATOM 54 N N . SER 4 4 ? A 35.790 4.613 -21.293 1.000 1 A 82.850 1 ATOM 55 C CA . SER 4 4 ? A 36.277 5.490 -22.362 1.000 1 A 82.850 1 ATOM 56 C C . SER 4 4 ? A 36.733 6.837 -21.783 1.000 1 A 82.850 1 ATOM 57 O O . SER 4 4 ? A 36.255 7.255 -20.725 1.000 1 A 82.850 1 ATOM 58 C CB . SER 4 4 ? A 35.197 5.676 -23.437 1.000 1 A 82.850 1 ATOM 59 O OG . SER 4 4 ? A 34.086 6.397 -22.935 1.000 1 A 82.850 1 ATOM 60 H H . SER 4 4 ? A 34.808 4.379 -21.264 1.000 1 A 82.850 1 ATOM 61 H HA . SER 4 4 ? A 37.140 5.013 -22.826 1.000 1 A 82.850 1 ATOM 62 H HB2 . SER 4 4 ? A 35.622 6.223 -24.278 1.000 1 A 82.850 1 ATOM 63 H HB3 . SER 4 4 ? A 34.868 4.699 -23.792 1.000 1 A 82.850 1 ATOM 64 H HG . SER 4 4 ? A 33.307 5.839 -22.992 1.000 1 A 82.850 1 ATOM 65 N N . LEU 5 5 ? A 37.612 7.562 -22.486 1.000 1 A 81.500 1 ATOM 66 C CA . LEU 5 5 ? A 38.025 8.912 -22.071 1.000 1 A 81.500 1 ATOM 67 C C . LEU 5 5 ? A 36.809 9.831 -21.869 1.000 1 A 81.500 1 ATOM 68 O O . LEU 5 5 ? A 36.745 10.591 -20.906 1.000 1 A 81.500 1 ATOM 69 C CB . LEU 5 5 ? A 38.983 9.491 -23.129 1.000 1 A 81.500 1 ATOM 70 C CG . LEU 5 5 ? A 39.548 10.883 -22.773 1.000 1 A 81.500 1 ATOM 71 C CD1 . LEU 5 5 ? A 40.452 10.832 -21.540 1.000 1 A 81.500 1 ATOM 72 C CD2 . LEU 5 5 ? A 40.357 11.426 -23.950 1.000 1 A 81.500 1 ATOM 73 H H . LEU 5 5 ? A 38.038 7.157 -23.308 1.000 1 A 81.500 1 ATOM 74 H HA . LEU 5 5 ? A 38.544 8.831 -21.116 1.000 1 A 81.500 1 ATOM 75 H HB2 . LEU 5 5 ? A 39.818 8.803 -23.266 1.000 1 A 81.500 1 ATOM 76 H HB3 . LEU 5 5 ? A 38.451 9.566 -24.078 1.000 1 A 81.500 1 ATOM 77 H HG . LEU 5 5 ? A 38.729 11.576 -22.585 1.000 1 A 81.500 1 ATOM 78 H HD11 . LEU 5 5 ? A 40.888 11.816 -21.366 1.000 1 A 81.500 1 ATOM 79 H HD12 . LEU 5 5 ? A 39.874 10.559 -20.657 1.000 1 A 81.500 1 ATOM 80 H HD13 . LEU 5 5 ? A 41.255 10.112 -21.690 1.000 1 A 81.500 1 ATOM 81 H HD21 . LEU 5 5 ? A 40.738 12.418 -23.708 1.000 1 A 81.500 1 ATOM 82 H HD22 . LEU 5 5 ? A 41.197 10.767 -24.168 1.000 1 A 81.500 1 ATOM 83 H HD23 . LEU 5 5 ? A 39.723 11.506 -24.833 1.000 1 A 81.500 1 ATOM 84 N N . GLN 6 6 ? A 35.804 9.696 -22.738 1.000 1 A 85.250 1 ATOM 85 C CA . GLN 6 6 ? A 34.535 10.402 -22.621 1.000 1 A 85.250 1 ATOM 86 C C . GLN 6 6 ? A 33.779 10.014 -21.341 1.000 1 A 85.250 1 ATOM 87 O O . GLN 6 6 ? A 33.273 10.888 -20.639 1.000 1 A 85.250 1 ATOM 88 C CB . GLN 6 6 ? A 33.703 10.105 -23.877 1.000 1 A 85.250 1 ATOM 89 C CG . GLN 6 6 ? A 32.429 10.957 -23.910 1.000 1 A 85.250 1 ATOM 90 C CD . GLN 6 6 ? A 31.512 10.639 -25.086 1.000 1 A 85.250 1 ATOM 91 O OE1 . GLN 6 6 ? A 31.574 9.598 -25.709 1.000 1 A 85.250 1 ATOM 92 N NE2 . GLN 6 6 ? A 30.576 11.506 -25.406 1.000 1 A 85.250 1 ATOM 93 H H . GLN 6 6 ? A 35.914 9.032 -23.491 1.000 1 A 85.250 1 ATOM 94 H HA . GLN 6 6 ? A 34.737 11.473 -22.575 1.000 1 A 85.250 1 ATOM 95 H HB2 . GLN 6 6 ? A 33.439 9.048 -23.893 1.000 1 A 85.250 1 ATOM 96 H HB3 . GLN 6 6 ? A 34.295 10.330 -24.764 1.000 1 A 85.250 1 ATOM 97 H HG2 . GLN 6 6 ? A 32.705 12.011 -23.945 1.000 1 A 85.250 1 ATOM 98 H HG3 . GLN 6 6 ? A 31.864 10.774 -22.996 1.000 1 A 85.250 1 ATOM 99 H HE21 . GLN 6 6 ? A 30.636 12.457 -25.070 1.000 1 A 85.250 1 ATOM 100 H HE22 . GLN 6 6 ? A 30.099 11.289 -26.270 1.000 1 A 85.250 1 ATOM 101 N N . SER 7 7 ? A 33.709 8.723 -21.012 1.000 1 A 82.190 1 ATOM 102 C CA . SER 7 7 ? A 33.060 8.242 -19.788 1.000 1 A 82.190 1 ATOM 103 C C . SER 7 7 ? A 33.766 8.725 -18.525 1.000 1 A 82.190 1 ATOM 104 O O . SER 7 7 ? A 33.119 9.151 -17.566 1.000 1 A 82.190 1 ATOM 105 C CB . SER 7 7 ? A 33.063 6.722 -19.777 1.000 1 A 82.190 1 ATOM 106 O OG . SER 7 7 ? A 32.123 6.278 -18.834 1.000 1 A 82.190 1 ATOM 107 H H . SER 7 7 ? A 34.138 8.039 -21.619 1.000 1 A 82.190 1 ATOM 108 H HA . SER 7 7 ? A 32.028 8.592 -19.770 1.000 1 A 82.190 1 ATOM 109 H HB2 . SER 7 7 ? A 32.788 6.357 -20.766 1.000 1 A 82.190 1 ATOM 110 H HB3 . SER 7 7 ? A 34.055 6.344 -19.529 1.000 1 A 82.190 1 ATOM 111 H HG . SER 7 7 ? A 31.454 5.834 -19.360 1.000 1 A 82.190 1 ATOM 112 N N . PHE 8 8 ? A 35.101 8.724 -18.545 1.000 1 A 82.860 1 ATOM 113 C CA . PHE 8 8 ? A 35.920 9.245 -17.460 1.000 1 A 82.860 1 ATOM 114 C C . PHE 8 8 ? A 35.705 10.750 -17.273 1.000 1 A 82.860 1 ATOM 115 O O . PHE 8 8 ? A 35.439 11.185 -16.155 1.000 1 A 82.860 1 ATOM 116 C CB . PHE 8 8 ? A 37.390 8.908 -17.723 1.000 1 A 82.860 1 ATOM 117 C CG . PHE 8 8 ? A 38.288 9.316 -16.574 1.000 1 A 82.860 1 ATOM 118 C CD1 . PHE 8 8 ? A 38.980 10.541 -16.612 1.000 1 A 82.860 1 ATOM 119 C CD2 . PHE 8 8 ? A 38.405 8.480 -15.448 1.000 1 A 82.860 1 ATOM 120 C CE1 . PHE 8 8 ? A 39.788 10.926 -15.528 1.000 1 A 82.860 1 ATOM 121 C CE2 . PHE 8 8 ? A 39.216 8.864 -14.365 1.000 1 A 82.860 1 ATOM 122 C CZ . PHE 8 8 ? A 39.908 10.087 -14.406 1.000 1 A 82.860 1 ATOM 123 H H . PHE 8 8 ? A 35.566 8.344 -19.358 1.000 1 A 82.860 1 ATOM 124 H HA . PHE 8 8 ? A 35.617 8.756 -16.534 1.000 1 A 82.860 1 ATOM 125 H HB2 . PHE 8 8 ? A 37.488 7.834 -17.879 1.000 1 A 82.860 1 ATOM 126 H HB3 . PHE 8 8 ? A 37.723 9.404 -18.635 1.000 1 A 82.860 1 ATOM 127 H HD1 . PHE 8 8 ? A 38.894 11.188 -17.472 1.000 1 A 82.860 1 ATOM 128 H HD2 . PHE 8 8 ? A 37.884 7.534 -15.423 1.000 1 A 82.860 1 ATOM 129 H HE1 . PHE 8 8 ? A 40.326 11.861 -15.563 1.000 1 A 82.860 1 ATOM 130 H HE2 . PHE 8 8 ? A 39.327 8.212 -13.512 1.000 1 A 82.860 1 ATOM 131 H HZ . PHE 8 8 ? A 40.545 10.379 -13.585 1.000 1 A 82.860 1 ATOM 132 N N . ALA 9 9 ? A 35.718 11.534 -18.357 1.000 1 A 84.440 1 ATOM 133 C CA . ALA 9 9 ? A 35.426 12.967 -18.311 1.000 1 A 84.440 1 ATOM 134 C C . ALA 9 9 ? A 34.027 13.241 -17.734 1.000 1 A 84.440 1 ATOM 135 O O . ALA 9 9 ? A 33.880 14.071 -16.840 1.000 1 A 84.440 1 ATOM 136 C CB . ALA 9 9 ? A 35.581 13.548 -19.720 1.000 1 A 84.440 1 ATOM 137 H H . ALA 9 9 ? A 35.969 11.131 -19.248 1.000 1 A 84.440 1 ATOM 138 H HA . ALA 9 9 ? A 36.151 13.451 -17.657 1.000 1 A 84.440 1 ATOM 139 H HB1 . ALA 9 9 ? A 34.864 13.091 -20.402 1.000 1 A 84.440 1 ATOM 140 H HB2 . ALA 9 9 ? A 35.411 14.624 -19.692 1.000 1 A 84.440 1 ATOM 141 H HB3 . ALA 9 9 ? A 36.591 13.362 -20.087 1.000 1 A 84.440 1 ATOM 142 N N . LYS 10 10 ? A 33.010 12.477 -18.155 1.000 1 A 86.630 1 ATOM 143 C CA . LYS 10 10 ? A 31.658 12.554 -17.580 1.000 1 A 86.630 1 ATOM 144 C C . LYS 10 10 ? A 31.631 12.190 -16.095 1.000 1 A 86.630 1 ATOM 145 O O . LYS 10 10 ? A 30.949 12.858 -15.327 1.000 1 A 86.630 1 ATOM 146 C CB . LYS 10 10 ? A 30.704 11.646 -18.362 1.000 1 A 86.630 1 ATOM 147 C CG . LYS 10 10 ? A 30.359 12.210 -19.744 1.000 1 A 86.630 1 ATOM 148 C CD . LYS 10 10 ? A 29.417 11.238 -20.458 1.000 1 A 86.630 1 ATOM 149 C CE . LYS 10 10 ? A 29.255 11.647 -21.919 1.000 1 A 86.630 1 ATOM 150 N NZ . LYS 10 10 ? A 28.151 10.896 -22.555 1.000 1 A 86.630 1 ATOM 151 H H . LYS 10 10 ? A 33.187 11.823 -18.904 1.000 1 A 86.630 1 ATOM 152 H HA . LYS 10 10 ? A 31.306 13.584 -17.645 1.000 1 A 86.630 1 ATOM 153 H HB2 . LYS 10 10 ? A 31.150 10.657 -18.469 1.000 1 A 86.630 1 ATOM 154 H HB3 . LYS 10 10 ? A 29.777 11.535 -17.801 1.000 1 A 86.630 1 ATOM 155 H HG2 . LYS 10 10 ? A 29.865 13.175 -19.632 1.000 1 A 86.630 1 ATOM 156 H HG3 . LYS 10 10 ? A 31.265 12.349 -20.333 1.000 1 A 86.630 1 ATOM 157 H HD2 . LYS 10 10 ? A 29.827 10.229 -20.414 1.000 1 A 86.630 1 ATOM 158 H HD3 . LYS 10 10 ? A 28.451 11.256 -19.954 1.000 1 A 86.630 1 ATOM 159 H HE2 . LYS 10 10 ? A 30.195 11.471 -22.442 1.000 1 A 86.630 1 ATOM 160 H HE3 . LYS 10 10 ? A 29.039 12.714 -21.957 1.000 1 A 86.630 1 ATOM 161 H HZ1 . LYS 10 10 ? A 27.292 11.261 -22.170 1.000 1 A 86.630 1 ATOM 162 H HZ2 . LYS 10 10 ? A 28.139 11.053 -23.553 1.000 1 A 86.630 1 ATOM 163 H HZ3 . LYS 10 10 ? A 28.216 9.908 -22.357 1.000 1 A 86.630 1 ATOM 164 N N . LYS 11 11 ? A 32.389 11.171 -15.672 1.000 1 A 83.020 1 ATOM 165 C CA . LYS 11 11 ? A 32.517 10.786 -14.257 1.000 1 A 83.020 1 ATOM 166 C C . LYS 11 11 ? A 33.151 11.903 -13.428 1.000 1 A 83.020 1 ATOM 167 O O . LYS 11 11 ? A 32.741 12.111 -12.293 1.000 1 A 83.020 1 ATOM 168 C CB . LYS 11 11 ? A 33.322 9.479 -14.128 1.000 1 A 83.020 1 ATOM 169 C CG . LYS 11 11 ? A 33.071 8.785 -12.779 1.000 1 A 83.020 1 ATOM 170 C CD . LYS 11 11 ? A 33.751 7.408 -12.708 1.000 1 A 83.020 1 ATOM 171 C CE . LYS 11 11 ? A 33.327 6.676 -11.425 1.000 1 A 83.020 1 ATOM 172 N NZ . LYS 11 11 ? A 33.718 5.239 -11.417 1.000 1 A 83.020 1 ATOM 173 H H . LYS 11 11 ? A 32.900 10.646 -16.368 1.000 1 A 83.020 1 ATOM 174 H HA . LYS 11 11 ? A 31.514 10.630 -13.857 1.000 1 A 83.020 1 ATOM 175 H HB2 . LYS 11 11 ? A 34.386 9.685 -14.239 1.000 1 A 83.020 1 ATOM 176 H HB3 . LYS 11 11 ? A 33.029 8.797 -14.926 1.000 1 A 83.020 1 ATOM 177 H HG2 . LYS 11 11 ? A 31.996 8.645 -12.662 1.000 1 A 83.020 1 ATOM 178 H HG3 . LYS 11 11 ? A 33.435 9.412 -11.965 1.000 1 A 83.020 1 ATOM 179 H HD2 . LYS 11 11 ? A 33.440 6.823 -13.574 1.000 1 A 83.020 1 ATOM 180 H HD3 . LYS 11 11 ? A 34.833 7.532 -12.732 1.000 1 A 83.020 1 ATOM 181 H HE2 . LYS 11 11 ? A 33.748 7.194 -10.563 1.000 1 A 83.020 1 ATOM 182 H HE3 . LYS 11 11 ? A 32.241 6.742 -11.349 1.000 1 A 83.020 1 ATOM 183 H HZ1 . LYS 11 11 ? A 33.208 4.722 -12.119 1.000 1 A 83.020 1 ATOM 184 H HZ2 . LYS 11 11 ? A 34.706 5.104 -11.576 1.000 1 A 83.020 1 ATOM 185 H HZ3 . LYS 11 11 ? A 33.456 4.796 -10.548 1.000 1 A 83.020 1 ATOM 186 N N . VAL 12 12 ? A 34.137 12.615 -13.979 1.000 1 A 84.040 1 ATOM 187 C CA . VAL 12 12 ? A 34.763 13.783 -13.338 1.000 1 A 84.040 1 ATOM 188 C C . VAL 12 12 ? A 33.776 14.943 -13.240 1.000 1 A 84.040 1 ATOM 189 O O . VAL 12 12 ? A 33.607 15.483 -12.152 1.000 1 A 84.040 1 ATOM 190 C CB . VAL 12 12 ? A 36.062 14.197 -14.057 1.000 1 A 84.040 1 ATOM 191 C CG1 . VAL 12 12 ? A 36.640 15.507 -13.506 1.000 1 A 84.040 1 ATOM 192 C CG2 . VAL 12 12 ? A 37.138 13.116 -13.878 1.000 1 A 84.040 1 ATOM 193 H H . VAL 12 12 ? A 34.454 12.346 -14.899 1.000 1 A 84.040 1 ATOM 194 H HA . VAL 12 12 ? A 35.027 13.520 -12.313 1.000 1 A 84.040 1 ATOM 195 H HB . VAL 12 12 ? A 35.867 14.325 -15.122 1.000 1 A 84.040 1 ATOM 196 H HG11 . VAL 12 12 ? A 37.598 15.719 -13.980 1.000 1 A 84.040 1 ATOM 197 H HG12 . VAL 12 12 ? A 35.972 16.340 -13.728 1.000 1 A 84.040 1 ATOM 198 H HG13 . VAL 12 12 ? A 36.779 15.439 -12.427 1.000 1 A 84.040 1 ATOM 199 H HG21 . VAL 12 12 ? A 36.788 12.155 -14.255 1.000 1 A 84.040 1 ATOM 200 H HG22 . VAL 12 12 ? A 37.397 13.013 -12.824 1.000 1 A 84.040 1 ATOM 201 H HG23 . VAL 12 12 ? A 38.030 13.393 -14.439 1.000 1 A 84.040 1 ATOM 202 N N . LEU 13 13 ? A 33.078 15.278 -14.328 1.000 1 A 83.640 1 ATOM 203 C CA . LEU 13 13 ? A 32.064 16.338 -14.334 1.000 1 A 83.640 1 ATOM 204 C C . LEU 13 13 ? A 30.934 16.056 -13.334 1.000 1 A 83.640 1 ATOM 205 O O . LEU 13 13 ? A 30.571 16.937 -12.566 1.000 1 A 83.640 1 ATOM 206 C CB . LEU 13 13 ? A 31.502 16.504 -15.756 1.000 1 A 83.640 1 ATOM 207 C CG . LEU 13 13 ? A 32.476 17.147 -16.760 1.000 1 A 83.640 1 ATOM 208 C CD1 . LEU 13 13 ? A 31.871 17.073 -18.164 1.000 1 A 83.640 1 ATOM 209 C CD2 . LEU 13 13 ? A 32.761 18.613 -16.433 1.000 1 A 83.640 1 ATOM 210 H H . LEU 13 13 ? A 33.283 14.810 -15.199 1.000 1 A 83.640 1 ATOM 211 H HA . LEU 13 13 ? A 32.523 17.273 -14.014 1.000 1 A 83.640 1 ATOM 212 H HB2 . LEU 13 13 ? A 30.607 17.125 -15.706 1.000 1 A 83.640 1 ATOM 213 H HB3 . LEU 13 13 ? A 31.201 15.524 -16.127 1.000 1 A 83.640 1 ATOM 214 H HG . LEU 13 13 ? A 33.421 16.604 -16.763 1.000 1 A 83.640 1 ATOM 215 H HD11 . LEU 13 13 ? A 31.701 16.031 -18.438 1.000 1 A 83.640 1 ATOM 216 H HD12 . LEU 13 13 ? A 32.559 17.518 -18.883 1.000 1 A 83.640 1 ATOM 217 H HD13 . LEU 13 13 ? A 30.926 17.616 -18.193 1.000 1 A 83.640 1 ATOM 218 H HD21 . LEU 13 13 ? A 33.397 19.049 -17.204 1.000 1 A 83.640 1 ATOM 219 H HD22 . LEU 13 13 ? A 33.282 18.699 -15.479 1.000 1 A 83.640 1 ATOM 220 H HD23 . LEU 13 13 ? A 31.830 19.177 -16.380 1.000 1 A 83.640 1 ATOM 221 N N . ALA 14 14 ? A 30.443 14.816 -13.266 1.000 1 A 83.280 1 ATOM 222 C CA . ALA 14 14 ? A 29.390 14.423 -12.328 1.000 1 A 83.280 1 ATOM 223 C C . ALA 14 14 ? A 29.812 14.510 -10.846 1.000 1 A 83.280 1 ATOM 224 O O . ALA 14 14 ? A 28.952 14.542 -9.970 1.000 1 A 83.280 1 ATOM 225 C CB . ALA 14 14 ? A 28.934 13.005 -12.691 1.000 1 A 83.280 1 ATOM 226 H H . ALA 14 14 ? A 30.748 14.137 -13.949 1.000 1 A 83.280 1 ATOM 227 H HA . ALA 14 14 ? A 28.543 15.097 -12.457 1.000 1 A 83.280 1 ATOM 228 H HB1 . ALA 14 14 ? A 28.606 12.984 -13.730 1.000 1 A 83.280 1 ATOM 229 H HB2 . ALA 14 14 ? A 28.097 12.718 -12.055 1.000 1 A 83.280 1 ATOM 230 H HB3 . ALA 14 14 ? A 29.752 12.299 -12.554 1.000 1 A 83.280 1 ATOM 231 N N . ARG 15 15 ? A 31.116 14.536 -10.535 1.000 1 A 83.640 1 ATOM 232 C CA . ARG 15 15 ? A 31.621 14.724 -9.159 1.000 1 A 83.640 1 ATOM 233 C C . ARG 15 15 ? A 31.630 16.184 -8.725 1.000 1 A 83.640 1 ATOM 234 O O . ARG 15 15 ? A 31.726 16.456 -7.532 1.000 1 A 83.640 1 ATOM 235 C CB . ARG 15 15 ? A 33.058 14.204 -9.045 1.000 1 A 83.640 1 ATOM 236 C CG . ARG 15 15 ? A 33.150 12.685 -9.125 1.000 1 A 83.640 1 ATOM 237 C CD . ARG 15 15 ? A 34.603 12.297 -9.420 1.000 1 A 83.640 1 ATOM 238 N NE . ARG 15 15 ? A 34.727 10.845 -9.594 1.000 1 A 83.640 1 ATOM 239 C CZ . ARG 15 15 ? A 35.808 10.111 -9.443 1.000 1 A 83.640 1 ATOM 240 N NH1 . ARG 15 15 ? A 36.996 10.639 -9.358 1.000 1 A 83.640 1 ATOM 241 N NH2 . ARG 15 15 ? A 35.697 8.818 -9.338 1.000 1 A 83.640 1 ATOM 242 H H . ARG 15 15 ? A 31.780 14.542 -11.297 1.000 1 A 83.640 1 ATOM 243 H HA . ARG 15 15 ? A 30.981 14.200 -8.449 1.000 1 A 83.640 1 ATOM 244 H HB2 . ARG 15 15 ? A 33.478 14.511 -8.087 1.000 1 A 83.640 1 ATOM 245 H HB3 . ARG 15 15 ? A 33.664 14.661 -9.828 1.000 1 A 83.640 1 ATOM 246 H HG2 . ARG 15 15 ? A 32.838 12.268 -8.167 1.000 1 A 83.640 1 ATOM 247 H HG3 . ARG 15 15 ? A 32.487 12.298 -9.898 1.000 1 A 83.640 1 ATOM 248 H HD2 . ARG 15 15 ? A 35.227 12.636 -8.593 1.000 1 A 83.640 1 ATOM 249 H HD3 . ARG 15 15 ? A 34.924 12.795 -10.335 1.000 1 A 83.640 1 ATOM 250 H HE . ARG 15 15 ? A 33.846 10.359 -9.684 1.000 1 A 83.640 1 ATOM 251 H HH11 . ARG 15 15 ? A 37.074 11.643 -9.430 1.000 1 A 83.640 1 ATOM 252 H HH12 . ARG 15 15 ? A 37.824 10.076 -9.225 1.000 1 A 83.640 1 ATOM 253 H HH21 . ARG 15 15 ? A 36.525 8.279 -9.126 1.000 1 A 83.640 1 ATOM 254 H HH22 . ARG 15 15 ? A 34.785 8.469 -9.081 1.000 1 A 83.640 1 ATOM 255 N N . GLN 16 16 ? A 31.635 17.108 -9.678 1.000 1 A 80.700 1 ATOM 256 C CA . GLN 16 16 ? A 31.781 18.526 -9.400 1.000 1 A 80.700 1 ATOM 257 C C . GLN 16 16 ? A 30.413 19.150 -9.141 1.000 1 A 80.700 1 ATOM 258 O O . GLN 16 16 ? A 29.423 18.810 -9.786 1.000 1 A 80.700 1 ATOM 259 C CB . GLN 16 16 ? A 32.538 19.211 -10.546 1.000 1 A 80.700 1 ATOM 260 C CG . GLN 16 16 ? A 33.998 18.729 -10.610 1.000 1 A 80.700 1 ATOM 261 C CD . GLN 16 16 ? A 34.807 19.385 -11.725 1.000 1 A 80.700 1 ATOM 262 O OE1 . GLN 16 16 ? A 34.309 20.069 -12.599 1.000 1 A 80.700 1 ATOM 263 N NE2 . GLN 16 16 ? A 36.109 19.198 -11.745 1.000 1 A 80.700 1 ATOM 264 H H . GLN 16 16 ? A 31.445 16.835 -10.632 1.000 1 A 80.700 1 ATOM 265 H HA . GLN 16 16 ? A 32.371 18.652 -8.492 1.000 1 A 80.700 1 ATOM 266 H HB2 . GLN 16 16 ? A 32.532 20.289 -10.379 1.000 1 A 80.700 1 ATOM 267 H HB3 . GLN 16 16 ? A 32.036 19.005 -11.491 1.000 1 A 80.700 1 ATOM 268 H HG2 . GLN 16 16 ? A 34.027 17.651 -10.765 1.000 1 A 80.700 1 ATOM 269 H HG3 . GLN 16 16 ? A 34.484 18.949 -9.660 1.000 1 A 80.700 1 ATOM 270 H HE21 . GLN 16 16 ? A 36.572 18.683 -11.011 1.000 1 A 80.700 1 ATOM 271 H HE22 . GLN 16 16 ? A 36.598 19.697 -12.474 1.000 1 A 80.700 1 ATOM 272 N N . GLN 17 17 ? A 30.362 20.098 -8.206 1.000 1 A 75.240 1 ATOM 273 C CA . GLN 17 17 ? A 29.222 20.996 -8.116 1.000 1 A 75.240 1 ATOM 274 C C . GLN 17 17 ? A 29.357 22.019 -9.241 1.000 1 A 75.240 1 ATOM 275 O O . GLN 17 17 ? A 30.209 22.903 -9.205 1.000 1 A 75.240 1 ATOM 276 C CB . GLN 17 17 ? A 29.148 21.622 -6.723 1.000 1 A 75.240 1 ATOM 277 C CG . GLN 17 17 ? A 27.846 22.420 -6.555 1.000 1 A 75.240 1 ATOM 278 C CD . GLN 17 17 ? A 27.641 22.910 -5.127 1.000 1 A 75.240 1 ATOM 279 O OE1 . GLN 17 17 ? A 28.415 22.654 -4.221 1.000 1 A 75.240 1 ATOM 280 N NE2 . GLN 17 17 ? A 26.570 23.625 -4.862 1.000 1 A 75.240 1 ATOM 281 H H . GLN 17 17 ? A 31.202 20.348 -7.703 1.000 1 A 75.240 1 ATOM 282 H HA . GLN 17 17 ? A 28.308 20.423 -8.270 1.000 1 A 75.240 1 ATOM 283 H HB2 . GLN 17 17 ? A 29.165 20.820 -5.985 1.000 1 A 75.240 1 ATOM 284 H HB3 . GLN 17 17 ? A 30.006 22.273 -6.555 1.000 1 A 75.240 1 ATOM 285 H HG2 . GLN 17 17 ? A 27.859 23.284 -7.220 1.000 1 A 75.240 1 ATOM 286 H HG3 . GLN 17 17 ? A 26.997 21.792 -6.823 1.000 1 A 75.240 1 ATOM 287 H HE21 . GLN 17 17 ? A 25.920 23.877 -5.593 1.000 1 A 75.240 1 ATOM 288 H HE22 . GLN 17 17 ? A 26.483 23.948 -3.909 1.000 1 A 75.240 1 ATOM 289 N N . VAL 18 18 ? A 28.549 21.839 -10.276 1.000 1 A 75.860 1 ATOM 290 C CA . VAL 18 18 ? A 28.586 22.660 -11.481 1.000 1 A 75.860 1 ATOM 291 C C . VAL 18 18 ? A 27.594 23.817 -11.329 1.000 1 A 75.860 1 ATOM 292 O O . VAL 18 18 ? A 26.461 23.606 -10.899 1.000 1 A 75.860 1 ATOM 293 C CB . VAL 18 18 ? A 28.321 21.764 -12.700 1.000 1 A 75.860 1 ATOM 294 C CG1 . VAL 18 18 ? A 28.295 22.569 -13.985 1.000 1 A 75.860 1 ATOM 295 C CG2 . VAL 18 18 ? A 29.405 20.689 -12.864 1.000 1 A 75.860 1 ATOM 296 H H . VAL 18 18 ? A 27.905 21.061 -10.255 1.000 1 A 75.860 1 ATOM 297 H HA . VAL 18 18 ? A 29.584 23.085 -11.596 1.000 1 A 75.860 1 ATOM 298 H HB . VAL 18 18 ? A 27.355 21.273 -12.573 1.000 1 A 75.860 1 ATOM 299 H HG11 . VAL 18 18 ? A 28.197 21.909 -14.846 1.000 1 A 75.860 1 ATOM 300 H HG12 . VAL 18 18 ? A 29.204 23.163 -14.081 1.000 1 A 75.860 1 ATOM 301 H HG13 . VAL 18 18 ? A 27.415 23.212 -13.954 1.000 1 A 75.860 1 ATOM 302 H HG21 . VAL 18 18 ? A 29.376 19.992 -12.027 1.000 1 A 75.860 1 ATOM 303 H HG22 . VAL 18 18 ? A 30.392 21.150 -12.911 1.000 1 A 75.860 1 ATOM 304 H HG23 . VAL 18 18 ? A 29.235 20.115 -13.775 1.000 1 A 75.860 1 ATOM 305 N N . SER 19 19 ? A 28.020 25.042 -11.657 1.000 1 A 82.590 1 ATOM 306 C CA . SER 19 19 ? A 27.135 26.220 -11.660 1.000 1 A 82.590 1 ATOM 307 C C . SER 19 19 ? A 25.980 26.043 -12.655 1.000 1 A 82.590 1 ATOM 308 O O . SER 19 19 ? A 26.147 25.403 -13.697 1.000 1 A 82.590 1 ATOM 309 C CB . SER 19 19 ? A 27.921 27.499 -11.986 1.000 1 A 82.590 1 ATOM 310 O OG . SER 19 19 ? A 27.057 28.618 -11.963 1.000 1 A 82.590 1 ATOM 311 H H . SER 19 19 ? A 28.972 25.150 -11.976 1.000 1 A 82.590 1 ATOM 312 H HA . SER 19 19 ? A 26.709 26.331 -10.663 1.000 1 A 82.590 1 ATOM 313 H HB2 . SER 19 19 ? A 28.363 27.417 -12.979 1.000 1 A 82.590 1 ATOM 314 H HB3 . SER 19 19 ? A 28.714 27.638 -11.251 1.000 1 A 82.590 1 ATOM 315 H HG . SER 19 19 ? A 27.519 29.393 -12.289 1.000 1 A 82.590 1 ATOM 316 N N . ILE 20 20 ? A 24.830 26.662 -12.364 1.000 1 A 84.010 1 ATOM 317 C CA . ILE 20 20 ? A 23.603 26.597 -13.181 1.000 1 A 84.010 1 ATOM 318 C C . ILE 20 20 ? A 23.872 26.989 -14.645 1.000 1 A 84.010 1 ATOM 319 O O . ILE 20 20 ? A 23.290 26.410 -15.560 1.000 1 A 84.010 1 ATOM 320 C CB . ILE 20 20 ? A 22.499 27.478 -12.540 1.000 1 A 84.010 1 ATOM 321 C CG1 . ILE 20 20 ? A 22.111 26.918 -11.149 1.000 1 A 84.010 1 ATOM 322 C CG2 . ILE 20 20 ? A 21.248 27.571 -13.437 1.000 1 A 84.010 1 ATOM 323 C CD1 . ILE 20 20 ? A 21.150 27.807 -10.346 1.000 1 A 84.010 1 ATOM 324 H H . ILE 20 20 ? A 24.814 27.233 -11.532 1.000 1 A 84.010 1 ATOM 325 H HA . ILE 20 20 ? A 23.252 25.565 -13.192 1.000 1 A 84.010 1 ATOM 326 H HB . ILE 20 20 ? A 22.896 28.485 -12.413 1.000 1 A 84.010 1 ATOM 327 H HG12 . ILE 20 20 ? A 21.661 25.933 -11.269 1.000 1 A 84.010 1 ATOM 328 H HG13 . ILE 20 20 ? A 23.009 26.800 -10.542 1.000 1 A 84.010 1 ATOM 329 H HG21 . ILE 20 20 ? A 21.496 28.018 -14.400 1.000 1 A 84.010 1 ATOM 330 H HG22 . ILE 20 20 ? A 20.494 28.212 -12.980 1.000 1 A 84.010 1 ATOM 331 H HG23 . ILE 20 20 ? A 20.832 26.577 -13.602 1.000 1 A 84.010 1 ATOM 332 H HD11 . ILE 20 20 ? A 21.548 28.820 -10.280 1.000 1 A 84.010 1 ATOM 333 H HD12 . ILE 20 20 ? A 21.047 27.402 -9.339 1.000 1 A 84.010 1 ATOM 334 H HD13 . ILE 20 20 ? A 20.164 27.828 -10.809 1.000 1 A 84.010 1 ATOM 335 N N . GLU 21 21 ? A 24.811 27.907 -14.881 1.000 1 A 85.550 1 ATOM 336 C CA . GLU 21 21 ? A 25.219 28.375 -16.216 1.000 1 A 85.550 1 ATOM 337 C C . GLU 21 21 ? A 25.728 27.250 -17.136 1.000 1 A 85.550 1 ATOM 338 O O . GLU 21 21 ? A 25.607 27.335 -18.357 1.000 1 A 85.550 1 ATOM 339 C CB . GLU 21 21 ? A 26.324 29.425 -16.042 1.000 1 A 85.550 1 ATOM 340 C CG . GLU 21 21 ? A 25.823 30.684 -15.314 1.000 1 A 85.550 1 ATOM 341 C CD . GLU 21 21 ? A 26.941 31.688 -15.005 1.000 1 A 85.550 1 ATOM 342 O OE1 . GLU 21 21 ? A 26.609 32.725 -14.393 1.000 1 A 85.550 1 ATOM 343 O OE2 . GLU 21 21 ? A 28.117 31.387 -15.313 1.000 1 A 85.550 1 ATOM 344 H H . GLU 21 21 ? A 25.259 28.338 -14.086 1.000 1 A 85.550 1 ATOM 345 H HA . GLU 21 21 ? A 24.370 28.842 -16.715 1.000 1 A 85.550 1 ATOM 346 H HB2 . GLU 21 21 ? A 27.140 28.974 -15.478 1.000 1 A 85.550 1 ATOM 347 H HB3 . GLU 21 21 ? A 26.696 29.714 -17.025 1.000 1 A 85.550 1 ATOM 348 H HG2 . GLU 21 21 ? A 25.061 31.161 -15.930 1.000 1 A 85.550 1 ATOM 349 H HG3 . GLU 21 21 ? A 25.360 30.393 -14.371 1.000 1 A 85.550 1 ATOM 350 N N . TYR 22 22 ? A 26.245 26.159 -16.568 1.000 1 A 85.130 1 ATOM 351 C CA . TYR 22 22 ? A 26.787 25.025 -17.320 1.000 1 A 85.130 1 ATOM 352 C C . TYR 22 22 ? A 25.814 23.838 -17.416 1.000 1 A 85.130 1 ATOM 353 O O . TYR 22 22 ? A 26.180 22.787 -17.949 1.000 1 A 85.130 1 ATOM 354 C CB . TYR 22 22 ? A 28.121 24.615 -16.704 1.000 1 A 85.130 1 ATOM 355 C CG . TYR 22 22 ? A 29.188 25.687 -16.666 1.000 1 A 85.130 1 ATOM 356 C CD1 . TYR 22 22 ? A 29.847 26.060 -17.849 1.000 1 A 85.130 1 ATOM 357 C CD2 . TYR 22 22 ? A 29.522 26.308 -15.448 1.000 1 A 85.130 1 ATOM 358 C CE1 . TYR 22 22 ? A 30.859 27.034 -17.817 1.000 1 A 85.130 1 ATOM 359 C CE2 . TYR 22 22 ? A 30.513 27.308 -15.414 1.000 1 A 85.130 1 ATOM 360 C CZ . TYR 22 22 ? A 31.187 27.667 -16.602 1.000 1 A 85.130 1 ATOM 361 O OH . TYR 22 22 ? A 32.143 28.630 -16.592 1.000 1 A 85.130 1 ATOM 362 H H . TYR 22 22 ? A 26.275 26.120 -15.559 1.000 1 A 85.130 1 ATOM 363 H HA . TYR 22 22 ? A 26.990 25.345 -18.342 1.000 1 A 85.130 1 ATOM 364 H HB2 . TYR 22 22 ? A 27.903 24.332 -15.674 1.000 1 A 85.130 1 ATOM 365 H HB3 . TYR 22 22 ? A 28.520 23.747 -17.228 1.000 1 A 85.130 1 ATOM 366 H HD1 . TYR 22 22 ? A 29.554 25.624 -18.792 1.000 1 A 85.130 1 ATOM 367 H HD2 . TYR 22 22 ? A 28.996 26.028 -14.547 1.000 1 A 85.130 1 ATOM 368 H HE1 . TYR 22 22 ? A 31.364 27.340 -18.721 1.000 1 A 85.130 1 ATOM 369 H HE2 . TYR 22 22 ? A 30.752 27.811 -14.489 1.000 1 A 85.130 1 ATOM 370 H HH . TYR 22 22 ? A 32.153 29.115 -15.764 1.000 1 A 85.130 1 ATOM 371 N N . HIS 23 23 ? A 24.565 23.976 -16.957 1.000 1 A 88.610 1 ATOM 372 C CA . HIS 23 23 ? A 23.555 22.914 -17.058 1.000 1 A 88.610 1 ATOM 373 C C . HIS 23 23 ? A 23.324 22.444 -18.503 1.000 1 A 88.610 1 ATOM 374 O O . HIS 23 23 ? A 23.221 21.243 -18.746 1.000 1 A 88.610 1 ATOM 375 C CB . HIS 23 23 ? A 22.240 23.402 -16.439 1.000 1 A 88.610 1 ATOM 376 C CG . HIS 23 23 ? A 22.180 23.347 -14.929 1.000 1 A 88.610 1 ATOM 377 N ND1 . HIS 23 23 ? A 21.058 23.609 -14.178 1.000 1 A 88.610 1 ATOM 378 C CD2 . HIS 23 23 ? A 23.171 22.986 -14.051 1.000 1 A 88.610 1 ATOM 379 C CE1 . HIS 23 23 ? A 21.354 23.392 -12.887 1.000 1 A 88.610 1 ATOM 380 N NE2 . HIS 23 23 ? A 22.630 23.007 -12.762 1.000 1 A 88.610 1 ATOM 381 H H . HIS 23 23 ? A 24.303 24.848 -16.520 1.000 1 A 88.610 1 ATOM 382 H HA . HIS 23 23 ? A 23.899 22.039 -16.506 1.000 1 A 88.610 1 ATOM 383 H HB2 . HIS 23 23 ? A 21.432 22.777 -16.820 1.000 1 A 88.610 1 ATOM 384 H HB3 . HIS 23 23 ? A 22.034 24.420 -16.770 1.000 1 A 88.610 1 ATOM 385 H HD1 . HIS 23 23 ? A 20.175 23.949 -14.533 1.000 1 A 88.610 1 ATOM 386 H HD2 . HIS 23 23 ? A 24.188 22.721 -14.301 1.000 1 A 88.610 1 ATOM 387 H HE1 . HIS 23 23 ? A 20.673 23.525 -12.060 1.000 1 A 88.610 1 ATOM 388 N N . VAL 24 24 ? A 23.352 23.363 -19.476 1.000 1 A 87.560 1 ATOM 389 C CA . VAL 24 24 ? A 23.230 23.036 -20.911 1.000 1 A 87.560 1 ATOM 390 C C . VAL 24 24 ? A 24.346 22.091 -21.375 1.000 1 A 87.560 1 ATOM 391 O O . VAL 24 24 ? A 24.125 21.227 -22.224 1.000 1 A 87.560 1 ATOM 392 C CB . VAL 24 24 ? A 23.245 24.330 -21.755 1.000 1 A 87.560 1 ATOM 393 C CG1 . VAL 24 24 ? A 23.175 24.052 -23.265 1.000 1 A 87.560 1 ATOM 394 C CG2 . VAL 24 24 ? A 22.063 25.239 -21.394 1.000 1 A 87.560 1 ATOM 395 H H . VAL 24 24 ? A 23.435 24.332 -19.205 1.000 1 A 87.560 1 ATOM 396 H HA . VAL 24 24 ? A 22.282 22.524 -21.075 1.000 1 A 87.560 1 ATOM 397 H HB . VAL 24 24 ? A 24.169 24.871 -21.553 1.000 1 A 87.560 1 ATOM 398 H HG11 . VAL 24 24 ? A 22.299 23.441 -23.482 1.000 1 A 87.560 1 ATOM 399 H HG12 . VAL 24 24 ? A 23.102 24.994 -23.808 1.000 1 A 87.560 1 ATOM 400 H HG13 . VAL 24 24 ? A 24.075 23.536 -23.598 1.000 1 A 87.560 1 ATOM 401 H HG21 . VAL 24 24 ? A 22.123 25.551 -20.351 1.000 1 A 87.560 1 ATOM 402 H HG22 . VAL 24 24 ? A 21.123 24.710 -21.553 1.000 1 A 87.560 1 ATOM 403 H HG23 . VAL 24 24 ? A 22.079 26.137 -22.012 1.000 1 A 87.560 1 ATOM 404 N N . ILE 25 25 ? A 25.553 22.221 -20.815 1.000 1 A 86.170 1 ATOM 405 C CA . ILE 25 25 ? A 26.676 21.332 -21.133 1.000 1 A 86.170 1 ATOM 406 C C . ILE 25 25 ? A 26.425 19.944 -20.544 1.000 1 A 86.170 1 ATOM 407 O O . ILE 25 25 ? A 26.601 18.950 -21.246 1.000 1 A 86.170 1 ATOM 408 C CB . ILE 25 25 ? A 28.024 21.922 -20.657 1.000 1 A 86.170 1 ATOM 409 C CG1 . ILE 25 25 ? A 28.247 23.313 -21.295 1.000 1 A 86.170 1 ATOM 410 C CG2 . ILE 25 25 ? A 29.179 20.956 -20.988 1.000 1 A 86.170 1 ATOM 411 C CD1 . ILE 25 25 ? A 29.604 23.939 -20.962 1.000 1 A 86.170 1 ATOM 412 H H . ILE 25 25 ? A 25.660 22.872 -20.051 1.000 1 A 86.170 1 ATOM 413 H HA . ILE 25 25 ? A 26.727 21.212 -22.215 1.000 1 A 86.170 1 ATOM 414 H HB . ILE 25 25 ? A 27.998 22.041 -19.574 1.000 1 A 86.170 1 ATOM 415 H HG12 . ILE 25 25 ? A 28.153 23.240 -22.379 1.000 1 A 86.170 1 ATOM 416 H HG13 . ILE 25 25 ? A 27.478 23.994 -20.932 1.000 1 A 86.170 1 ATOM 417 H HG21 . ILE 25 25 ? A 30.125 21.348 -20.613 1.000 1 A 86.170 1 ATOM 418 H HG22 . ILE 25 25 ? A 29.251 20.810 -22.066 1.000 1 A 86.170 1 ATOM 419 H HG23 . ILE 25 25 ? A 29.028 19.990 -20.507 1.000 1 A 86.170 1 ATOM 420 H HD11 . ILE 25 25 ? A 29.579 25.005 -21.187 1.000 1 A 86.170 1 ATOM 421 H HD12 . ILE 25 25 ? A 29.831 23.789 -19.906 1.000 1 A 86.170 1 ATOM 422 H HD13 . ILE 25 25 ? A 30.387 23.476 -21.562 1.000 1 A 86.170 1 ATOM 423 N N . LEU 26 26 ? A 25.972 19.861 -19.289 1.000 1 A 87.540 1 ATOM 424 C CA . LEU 26 26 ? A 25.657 18.583 -18.641 1.000 1 A 87.540 1 ATOM 425 C C . LEU 26 26 ? A 24.576 17.811 -19.403 1.000 1 A 87.540 1 ATOM 426 O O . LEU 26 26 ? A 24.744 16.616 -19.651 1.000 1 A 87.540 1 ATOM 427 C CB . LEU 26 26 ? A 25.229 18.817 -17.183 1.000 1 A 87.540 1 ATOM 428 C CG . LEU 26 26 ? A 26.323 19.413 -16.282 1.000 1 A 87.540 1 ATOM 429 C CD1 . LEU 26 26 ? A 25.759 19.594 -14.877 1.000 1 A 87.540 1 ATOM 430 C CD2 . LEU 26 26 ? A 27.555 18.507 -16.190 1.000 1 A 87.540 1 ATOM 431 H H . LEU 26 26 ? A 25.804 20.719 -18.782 1.000 1 A 87.540 1 ATOM 432 H HA . LEU 26 26 ? A 26.547 17.955 -18.656 1.000 1 A 87.540 1 ATOM 433 H HB2 . LEU 26 26 ? A 24.915 17.863 -16.759 1.000 1 A 87.540 1 ATOM 434 H HB3 . LEU 26 26 ? A 24.364 19.480 -17.169 1.000 1 A 87.540 1 ATOM 435 H HG . LEU 26 26 ? A 26.627 20.388 -16.663 1.000 1 A 87.540 1 ATOM 436 H HD11 . LEU 26 26 ? A 26.520 20.035 -14.233 1.000 1 A 87.540 1 ATOM 437 H HD12 . LEU 26 26 ? A 24.897 20.260 -14.904 1.000 1 A 87.540 1 ATOM 438 H HD13 . LEU 26 26 ? A 25.469 18.628 -14.465 1.000 1 A 87.540 1 ATOM 439 H HD21 . LEU 26 26 ? A 27.260 17.510 -15.863 1.000 1 A 87.540 1 ATOM 440 H HD22 . LEU 26 26 ? A 28.057 18.453 -17.156 1.000 1 A 87.540 1 ATOM 441 H HD23 . LEU 26 26 ? A 28.259 18.921 -15.468 1.000 1 A 87.540 1 ATOM 442 N N . GLU 27 27 ? A 23.523 18.499 -19.846 1.000 1 A 88.610 1 ATOM 443 C CA . GLU 27 27 ? A 22.471 17.924 -20.687 1.000 1 A 88.610 1 ATOM 444 C C . GLU 27 27 ? A 23.022 17.374 -22.004 1.000 1 A 88.610 1 ATOM 445 O O . GLU 27 27 ? A 22.834 16.195 -22.311 1.000 1 A 88.610 1 ATOM 446 C CB . GLU 27 27 ? A 21.366 18.965 -20.895 1.000 1 A 88.610 1 ATOM 447 C CG . GLU 27 27 ? A 20.144 18.354 -21.595 1.000 1 A 88.610 1 ATOM 448 C CD . GLU 27 27 ? A 18.977 19.343 -21.731 1.000 1 A 88.610 1 ATOM 449 O OE1 . GLU 27 27 ? A 17.857 18.860 -22.009 1.000 1 A 88.610 1 ATOM 450 O OE2 . GLU 27 27 ? A 19.208 20.564 -21.580 1.000 1 A 88.610 1 ATOM 451 H H . GLU 27 27 ? A 23.425 19.465 -19.567 1.000 1 A 88.610 1 ATOM 452 H HA . GLU 27 27 ? A 22.027 17.068 -20.178 1.000 1 A 88.610 1 ATOM 453 H HB2 . GLU 27 27 ? A 21.058 19.343 -19.920 1.000 1 A 88.610 1 ATOM 454 H HB3 . GLU 27 27 ? A 21.758 19.793 -21.485 1.000 1 A 88.610 1 ATOM 455 H HG2 . GLU 27 27 ? A 19.816 17.485 -21.025 1.000 1 A 88.610 1 ATOM 456 H HG3 . GLU 27 27 ? A 20.436 18.017 -22.589 1.000 1 A 88.610 1 ATOM 457 N N . ARG 28 28 ? A 23.810 18.168 -22.739 1.000 1 A 87.750 1 ATOM 458 C CA . ARG 28 28 ? A 24.455 17.718 -23.987 1.000 1 A 87.750 1 ATOM 459 C C . ARG 28 28 ? A 25.455 16.579 -23.772 1.000 1 A 87.750 1 ATOM 460 O O . ARG 28 28 ? A 25.667 15.763 -24.667 1.000 1 A 87.750 1 ATOM 461 C CB . ARG 28 28 ? A 25.134 18.911 -24.666 1.000 1 A 87.750 1 ATOM 462 C CG . ARG 28 28 ? A 24.102 19.879 -25.255 1.000 1 A 87.750 1 ATOM 463 C CD . ARG 28 28 ? A 24.824 21.051 -25.921 1.000 1 A 87.750 1 ATOM 464 N NE . ARG 28 28 ? A 23.865 22.002 -26.509 1.000 1 A 87.750 1 ATOM 465 C CZ . ARG 28 28 ? A 24.135 22.947 -27.392 1.000 1 A 87.750 1 ATOM 466 N NH1 . ARG 28 28 ? A 25.338 23.128 -27.866 1.000 1 A 87.750 1 ATOM 467 N NH2 . ARG 28 28 ? A 23.192 23.738 -27.817 1.000 1 A 87.750 1 ATOM 468 H H . ARG 28 28 ? A 23.944 19.118 -22.424 1.000 1 A 87.750 1 ATOM 469 H HA . ARG 28 28 ? A 23.689 17.313 -24.648 1.000 1 A 87.750 1 ATOM 470 H HB2 . ARG 28 28 ? A 25.765 19.431 -23.945 1.000 1 A 87.750 1 ATOM 471 H HB3 . ARG 28 28 ? A 25.764 18.543 -25.476 1.000 1 A 87.750 1 ATOM 472 H HG2 . ARG 28 28 ? A 23.502 19.356 -26.000 1.000 1 A 87.750 1 ATOM 473 H HG3 . ARG 28 28 ? A 23.439 20.254 -24.475 1.000 1 A 87.750 1 ATOM 474 H HD2 . ARG 28 28 ? A 25.481 20.656 -26.695 1.000 1 A 87.750 1 ATOM 475 H HD3 . ARG 28 28 ? A 25.424 21.563 -25.169 1.000 1 A 87.750 1 ATOM 476 H HE . ARG 28 28 ? A 22.915 21.944 -26.170 1.000 1 A 87.750 1 ATOM 477 H HH11 . ARG 28 28 ? A 26.086 22.542 -27.522 1.000 1 A 87.750 1 ATOM 478 H HH12 . ARG 28 28 ? A 25.523 23.862 -28.534 1.000 1 A 87.750 1 ATOM 479 H HH21 . ARG 28 28 ? A 23.395 24.468 -28.485 1.000 1 A 87.750 1 ATOM 480 H HH22 . ARG 28 28 ? A 22.254 23.642 -27.455 1.000 1 A 87.750 1 ATOM 481 N N . CYS 29 29 ? A 26.056 16.484 -22.589 1.000 1 A 86.790 1 ATOM 482 C CA . CYS 29 29 ? A 26.913 15.367 -22.204 1.000 1 A 86.790 1 ATOM 483 C C . CYS 29 29 ? A 26.129 14.110 -21.783 1.000 1 A 86.790 1 ATOM 484 O O . CYS 29 29 ? A 26.752 13.065 -21.574 1.000 1 A 86.790 1 ATOM 485 C CB . CYS 29 29 ? A 27.884 15.826 -21.106 1.000 1 A 86.790 1 ATOM 486 S SG . CYS 29 29 ? A 29.130 16.963 -21.783 1.000 1 A 86.790 1 ATOM 487 H H . CYS 29 29 ? A 25.915 17.235 -21.929 1.000 1 A 86.790 1 ATOM 488 H HA . CYS 29 29 ? A 27.502 15.076 -23.074 1.000 1 A 86.790 1 ATOM 489 H HB2 . CYS 29 29 ? A 28.390 14.961 -20.679 1.000 1 A 86.790 1 ATOM 490 H HB3 . CYS 29 29 ? A 27.330 16.326 -20.311 1.000 1 A 86.790 1 ATOM 491 H HG . CYS 29 29 ? A 29.394 16.309 -22.918 1.000 1 A 86.790 1 ATOM 492 N N . GLY 30 30 ? A 24.798 14.152 -21.673 1.000 1 A 87.990 1 ATOM 493 C CA . GLY 30 30 ? A 23.996 13.035 -21.166 1.000 1 A 87.990 1 ATOM 494 C C . GLY 30 30 ? A 24.101 12.828 -19.658 1.000 1 A 87.990 1 ATOM 495 O O . GLY 30 30 ? A 23.857 11.727 -19.175 1.000 1 A 87.990 1 ATOM 496 H H . GLY 30 30 ? A 24.312 15.015 -21.872 1.000 1 A 87.990 1 ATOM 497 H HA2 . GLY 30 30 ? A 22.949 13.204 -21.418 1.000 1 A 87.990 1 ATOM 498 H HA3 . GLY 30 30 ? A 24.329 12.104 -21.626 1.000 1 A 87.990 1 ATOM 499 N N . LEU 31 31 ? A 24.516 13.856 -18.916 1.000 1 A 90.910 1 ATOM 500 C CA . LEU 31 31 ? A 24.543 13.882 -17.453 1.000 1 A 90.910 1 ATOM 501 C C . LEU 31 31 ? A 23.264 14.525 -16.918 1.000 1 A 90.910 1 ATOM 502 O O . LEU 31 31 ? A 23.310 15.413 -16.070 1.000 1 A 90.910 1 ATOM 503 C CB . LEU 31 31 ? A 25.818 14.593 -16.963 1.000 1 A 90.910 1 ATOM 504 C CG . LEU 31 31 ? A 27.114 13.821 -17.231 1.000 1 A 90.910 1 ATOM 505 C CD1 . LEU 31 31 ? A 28.300 14.659 -16.760 1.000 1 A 90.910 1 ATOM 506 C CD2 . LEU 31 31 ? A 27.119 12.492 -16.477 1.000 1 A 90.910 1 ATOM 507 H H . LEU 31 31 ? A 24.650 14.742 -19.383 1.000 1 A 90.910 1 ATOM 508 H HA . LEU 31 31 ? A 24.537 12.861 -17.072 1.000 1 A 90.910 1 ATOM 509 H HB2 . LEU 31 31 ? A 25.879 15.573 -17.436 1.000 1 A 90.910 1 ATOM 510 H HB3 . LEU 31 31 ? A 25.742 14.753 -15.887 1.000 1 A 90.910 1 ATOM 511 H HG . LEU 31 31 ? A 27.229 13.631 -18.298 1.000 1 A 90.910 1 ATOM 512 H HD11 . LEU 31 31 ? A 28.219 14.854 -15.690 1.000 1 A 90.910 1 ATOM 513 H HD12 . LEU 31 31 ? A 29.230 14.126 -16.956 1.000 1 A 90.910 1 ATOM 514 H HD13 . LEU 31 31 ? A 28.316 15.609 -17.294 1.000 1 A 90.910 1 ATOM 515 H HD21 . LEU 31 31 ? A 26.823 12.656 -15.441 1.000 1 A 90.910 1 ATOM 516 H HD22 . LEU 31 31 ? A 28.116 12.051 -16.494 1.000 1 A 90.910 1 ATOM 517 H HD23 . LEU 31 31 ? A 26.417 11.805 -16.950 1.000 1 A 90.910 1 ATOM 518 N N . TRP 32 32 ? A 22.120 14.100 -17.450 1.000 1 A 91.020 1 ATOM 519 C CA . TRP 32 32 ? A 20.828 14.713 -17.172 1.000 1 A 91.020 1 ATOM 520 C C . TRP 32 32 ? A 19.738 13.656 -17.093 1.000 1 A 91.020 1 ATOM 521 O O . TRP 32 32 ? A 19.627 12.802 -17.972 1.000 1 A 91.020 1 ATOM 522 C CB . TRP 32 32 ? A 20.540 15.750 -18.254 1.000 1 A 91.020 1 ATOM 523 C CG . TRP 32 32 ? A 19.598 16.835 -17.863 1.000 1 A 91.020 1 ATOM 524 C CD1 . TRP 32 32 ? A 18.282 16.909 -18.156 1.000 1 A 91.020 1 ATOM 525 C CD2 . TRP 32 32 ? A 19.933 18.078 -17.183 1.000 1 A 91.020 1 ATOM 526 N NE1 . TRP 32 32 ? A 17.781 18.111 -17.696 1.000 1 A 91.020 1 ATOM 527 C CE2 . TRP 32 32 ? A 18.740 18.840 -17.032 1.000 1 A 91.020 1 ATOM 528 C CE3 . TRP 32 32 ? A 21.134 18.651 -16.712 1.000 1 A 91.020 1 ATOM 529 C CZ2 . TRP 32 32 ? A 18.719 20.081 -16.387 1.000 1 A 91.020 1 ATOM 530 C CZ3 . TRP 32 32 ? A 21.131 19.913 -16.090 1.000 1 A 91.020 1 ATOM 531 C CH2 . TRP 32 32 ? A 19.925 20.613 -15.908 1.000 1 A 91.020 1 ATOM 532 H H . TRP 32 32 ? A 22.140 13.335 -18.109 1.000 1 A 91.020 1 ATOM 533 H HA . TRP 32 32 ? A 20.876 15.231 -16.214 1.000 1 A 91.020 1 ATOM 534 H HB2 . TRP 32 32 ? A 20.204 15.266 -19.171 1.000 1 A 91.020 1 ATOM 535 H HB3 . TRP 32 32 ? A 21.490 16.245 -18.455 1.000 1 A 91.020 1 ATOM 536 H HD1 . TRP 32 32 ? A 17.746 16.184 -18.752 1.000 1 A 91.020 1 ATOM 537 H HE1 . TRP 32 32 ? A 16.911 18.505 -18.023 1.000 1 A 91.020 1 ATOM 538 H HE3 . TRP 32 32 ? A 22.061 18.113 -16.844 1.000 1 A 91.020 1 ATOM 539 H HZ2 . TRP 32 32 ? A 17.795 20.630 -16.286 1.000 1 A 91.020 1 ATOM 540 H HZ3 . TRP 32 32 ? A 22.057 20.347 -15.744 1.000 1 A 91.020 1 ATOM 541 H HH2 . TRP 32 32 ? A 19.924 21.573 -15.413 1.000 1 A 91.020 1 ATOM 542 N N . TRP 33 33 ? A 18.943 13.701 -16.028 1.000 1 A 92.620 1 ATOM 543 C CA . TRP 33 33 ? A 17.850 12.764 -15.791 1.000 1 A 92.620 1 ATOM 544 C C . TRP 33 33 ? A 16.745 13.447 -14.986 1.000 1 A 92.620 1 ATOM 545 O O . TRP 33 33 ? A 17.023 14.258 -14.107 1.000 1 A 92.620 1 ATOM 546 C CB . TRP 33 33 ? A 18.396 11.523 -15.080 1.000 1 A 92.620 1 ATOM 547 C CG . TRP 33 33 ? A 17.565 10.277 -15.113 1.000 1 A 92.620 1 ATOM 548 C CD1 . TRP 33 33 ? A 16.476 10.018 -15.879 1.000 1 A 92.620 1 ATOM 549 C CD2 . TRP 33 33 ? A 17.828 9.042 -14.383 1.000 1 A 92.620 1 ATOM 550 N NE1 . TRP 33 33 ? A 16.024 8.737 -15.627 1.000 1 A 92.620 1 ATOM 551 C CE2 . TRP 33 33 ? A 16.828 8.091 -14.725 1.000 1 A 92.620 1 ATOM 552 C CE3 . TRP 33 33 ? A 18.845 8.617 -13.501 1.000 1 A 92.620 1 ATOM 553 C CZ2 . TRP 33 33 ? A 16.809 6.796 -14.202 1.000 1 A 92.620 1 ATOM 554 C CZ3 . TRP 33 33 ? A 18.829 7.321 -12.950 1.000 1 A 92.620 1 ATOM 555 C CH2 . TRP 33 33 ? A 17.816 6.413 -13.302 1.000 1 A 92.620 1 ATOM 556 H H . TRP 33 33 ? A 19.084 14.435 -15.349 1.000 1 A 92.620 1 ATOM 557 H HA . TRP 33 33 ? A 17.448 12.461 -16.758 1.000 1 A 92.620 1 ATOM 558 H HB2 . TRP 33 33 ? A 18.602 11.777 -14.040 1.000 1 A 92.620 1 ATOM 559 H HB3 . TRP 33 33 ? A 19.346 11.258 -15.544 1.000 1 A 92.620 1 ATOM 560 H HD1 . TRP 33 33 ? A 16.022 10.689 -16.594 1.000 1 A 92.620 1 ATOM 561 H HE1 . TRP 33 33 ? A 15.212 8.297 -16.036 1.000 1 A 92.620 1 ATOM 562 H HE3 . TRP 33 33 ? A 19.646 9.300 -13.264 1.000 1 A 92.620 1 ATOM 563 H HZ2 . TRP 33 33 ? A 16.030 6.114 -14.509 1.000 1 A 92.620 1 ATOM 564 H HZ3 . TRP 33 33 ? A 19.611 7.013 -12.272 1.000 1 A 92.620 1 ATOM 565 H HH2 . TRP 33 33 ? A 17.835 5.411 -12.900 1.000 1 A 92.620 1 ATOM 566 N N . TYR 34 34 ? A 15.481 13.178 -15.326 1.000 1 A 89.460 1 ATOM 567 C CA . TYR 34 34 ? A 14.305 13.836 -14.733 1.000 1 A 89.460 1 ATOM 568 C C . TYR 34 34 ? A 14.407 15.371 -14.664 1.000 1 A 89.460 1 ATOM 569 O O . TYR 34 34 ? A 14.055 15.984 -13.660 1.000 1 A 89.460 1 ATOM 570 C CB . TYR 34 34 ? A 13.969 13.225 -13.370 1.000 1 A 89.460 1 ATOM 571 C CG . TYR 34 34 ? A 13.814 11.724 -13.375 1.000 1 A 89.460 1 ATOM 572 C CD1 . TYR 34 34 ? A 12.758 11.111 -14.080 1.000 1 A 89.460 1 ATOM 573 C CD2 . TYR 34 34 ? A 14.726 10.946 -12.644 1.000 1 A 89.460 1 ATOM 574 C CE1 . TYR 34 34 ? A 12.601 9.711 -14.026 1.000 1 A 89.460 1 ATOM 575 C CE2 . TYR 34 34 ? A 14.554 9.556 -12.565 1.000 1 A 89.460 1 ATOM 576 C CZ . TYR 34 34 ? A 13.485 8.942 -13.238 1.000 1 A 89.460 1 ATOM 577 O OH . TYR 34 34 ? A 13.314 7.612 -13.069 1.000 1 A 89.460 1 ATOM 578 H H . TYR 34 34 ? A 15.314 12.414 -15.965 1.000 1 A 89.460 1 ATOM 579 H HA . TYR 34 34 ? A 13.461 13.624 -15.390 1.000 1 A 89.460 1 ATOM 580 H HB2 . TYR 34 34 ? A 14.743 13.509 -12.657 1.000 1 A 89.460 1 ATOM 581 H HB3 . TYR 34 34 ? A 13.032 13.653 -13.014 1.000 1 A 89.460 1 ATOM 582 H HD1 . TYR 34 34 ? A 12.059 11.707 -14.648 1.000 1 A 89.460 1 ATOM 583 H HD2 . TYR 34 34 ? A 15.549 11.422 -12.130 1.000 1 A 89.460 1 ATOM 584 H HE1 . TYR 34 34 ? A 11.806 9.213 -14.561 1.000 1 A 89.460 1 ATOM 585 H HE2 . TYR 34 34 ? A 15.253 8.942 -12.016 1.000 1 A 89.460 1 ATOM 586 H HH . TYR 34 34 ? A 12.879 7.223 -13.831 1.000 1 A 89.460 1 ATOM 587 N N . LYS 35 35 ? A 14.876 16.000 -15.750 1.000 1 A 87.200 1 ATOM 588 C CA . LYS 35 35 ? A 15.045 17.463 -15.864 1.000 1 A 87.200 1 ATOM 589 C C . LYS 35 35 ? A 16.066 18.068 -14.884 1.000 1 A 87.200 1 ATOM 590 O O . LYS 35 35 ? A 16.007 19.264 -14.611 1.000 1 A 87.200 1 ATOM 591 C CB . LYS 35 35 ? A 13.693 18.198 -15.791 1.000 1 A 87.200 1 ATOM 592 C CG . LYS 35 35 ? A 12.630 17.662 -16.757 1.000 1 A 87.200 1 ATOM 593 C CD . LYS 35 35 ? A 11.330 18.450 -16.567 1.000 1 A 87.200 1 ATOM 594 C CE . LYS 35 35 ? A 10.263 17.947 -17.541 1.000 1 A 87.200 1 ATOM 595 N NZ . LYS 35 35 ? A 8.986 18.684 -17.367 1.000 1 A 87.200 1 ATOM 596 H H . LYS 35 35 ? A 15.188 15.423 -16.518 1.000 1 A 87.200 1 ATOM 597 H HA . LYS 35 35 ? A 15.450 17.660 -16.857 1.000 1 A 87.200 1 ATOM 598 H HB2 . LYS 35 35 ? A 13.310 18.148 -14.772 1.000 1 A 87.200 1 ATOM 599 H HB3 . LYS 35 35 ? A 13.861 19.250 -16.024 1.000 1 A 87.200 1 ATOM 600 H HG2 . LYS 35 35 ? A 12.433 16.609 -16.555 1.000 1 A 87.200 1 ATOM 601 H HG3 . LYS 35 35 ? A 12.982 17.773 -17.782 1.000 1 A 87.200 1 ATOM 602 H HD2 . LYS 35 35 ? A 11.524 19.507 -16.747 1.000 1 A 87.200 1 ATOM 603 H HD3 . LYS 35 35 ? A 10.983 18.321 -15.541 1.000 1 A 87.200 1 ATOM 604 H HE2 . LYS 35 35 ? A 10.634 18.074 -18.558 1.000 1 A 87.200 1 ATOM 605 H HE3 . LYS 35 35 ? A 10.109 16.882 -17.372 1.000 1 A 87.200 1 ATOM 606 H HZ1 . LYS 35 35 ? A 9.125 19.671 -17.528 1.000 1 A 87.200 1 ATOM 607 H HZ2 . LYS 35 35 ? A 8.632 18.561 -16.429 1.000 1 A 87.200 1 ATOM 608 H HZ3 . LYS 35 35 ? A 8.290 18.350 -18.018 1.000 1 A 87.200 1 ATOM 609 N N . ALA 36 36 ? A 16.992 17.263 -14.371 1.000 1 A 89.200 1 ATOM 610 C CA . ALA 36 36 ? A 18.026 17.701 -13.447 1.000 1 A 89.200 1 ATOM 611 C C . ALA 36 36 ? A 19.393 17.090 -13.793 1.000 1 A 89.200 1 ATOM 612 O O . ALA 36 36 ? A 19.451 16.009 -14.390 1.000 1 A 89.200 1 ATOM 613 C CB . ALA 36 36 ? A 17.577 17.309 -12.040 1.000 1 A 89.200 1 ATOM 614 H H . ALA 36 36 ? A 16.968 16.277 -14.586 1.000 1 A 89.200 1 ATOM 615 H HA . ALA 36 36 ? A 18.117 18.786 -13.498 1.000 1 A 89.200 1 ATOM 616 H HB1 . ALA 36 36 ? A 16.621 17.783 -11.820 1.000 1 A 89.200 1 ATOM 617 H HB2 . ALA 36 36 ? A 18.320 17.627 -11.309 1.000 1 A 89.200 1 ATOM 618 H HB3 . ALA 36 36 ? A 17.463 16.226 -11.984 1.000 1 A 89.200 1 ATOM 619 N N . PRO 37 37 ? A 20.502 17.743 -13.403 1.000 1 A 89.200 1 ATOM 620 C CA . PRO 37 37 ? A 21.828 17.187 -13.607 1.000 1 A 89.200 1 ATOM 621 C C . PRO 37 37 ? A 22.060 15.958 -12.727 1.000 1 A 89.200 1 ATOM 622 O O . PRO 37 37 ? A 21.656 15.906 -11.564 1.000 1 A 89.200 1 ATOM 623 C CB . PRO 37 37 ? A 22.808 18.315 -13.290 1.000 1 A 89.200 1 ATOM 624 C CG . PRO 37 37 ? A 22.044 19.181 -12.290 1.000 1 A 89.200 1 ATOM 625 C CD . PRO 37 37 ? A 20.588 19.033 -12.726 1.000 1 A 89.200 1 ATOM 626 H HA . PRO 37 37 ? A 21.941 16.904 -14.654 1.000 1 A 89.200 1 ATOM 627 H HB2 . PRO 37 37 ? A 23.000 18.890 -14.195 1.000 1 A 89.200 1 ATOM 628 H HB3 . PRO 37 37 ? A 23.742 17.943 -12.869 1.000 1 A 89.200 1 ATOM 629 H HG2 . PRO 37 37 ? A 22.167 18.773 -11.287 1.000 1 A 89.200 1 ATOM 630 H HG3 . PRO 37 37 ? A 22.373 20.220 -12.323 1.000 1 A 89.200 1 ATOM 631 H HD2 . PRO 37 37 ? A 20.330 19.833 -13.419 1.000 1 A 89.200 1 ATOM 632 H HD3 . PRO 37 37 ? A 19.937 19.076 -11.852 1.000 1 A 89.200 1 ATOM 633 N N . ILE 38 38 ? A 22.770 14.979 -13.281 1.000 1 A 90.520 1 ATOM 634 C CA . ILE 38 38 ? A 23.254 13.810 -12.549 1.000 1 A 90.520 1 ATOM 635 C C . ILE 38 38 ? A 24.508 14.215 -11.780 1.000 1 A 90.520 1 ATOM 636 O O . ILE 38 38 ? A 25.501 14.624 -12.384 1.000 1 A 90.520 1 ATOM 637 C CB . ILE 38 38 ? A 23.539 12.642 -13.517 1.000 1 A 90.520 1 ATOM 638 C CG1 . ILE 38 38 ? A 22.228 12.205 -14.207 1.000 1 A 90.520 1 ATOM 639 C CG2 . ILE 38 38 ? A 24.184 11.445 -12.793 1.000 1 A 90.520 1 ATOM 640 C CD1 . ILE 38 38 ? A 22.423 11.104 -15.251 1.000 1 A 90.520 1 ATOM 641 H H . ILE 38 38 ? A 23.083 15.115 -14.231 1.000 1 A 90.520 1 ATOM 642 H HA . ILE 38 38 ? A 22.493 13.493 -11.835 1.000 1 A 90.520 1 ATOM 643 H HB . ILE 38 38 ? A 24.235 12.990 -14.280 1.000 1 A 90.520 1 ATOM 644 H HG12 . ILE 38 38 ? A 21.779 13.059 -14.713 1.000 1 A 90.520 1 ATOM 645 H HG13 . ILE 38 38 ? A 21.521 11.849 -13.457 1.000 1 A 90.520 1 ATOM 646 H HG21 . ILE 38 38 ? A 24.479 10.682 -13.514 1.000 1 A 90.520 1 ATOM 647 H HG22 . ILE 38 38 ? A 25.082 11.743 -12.252 1.000 1 A 90.520 1 ATOM 648 H HG23 . ILE 38 38 ? A 23.460 11.021 -12.097 1.000 1 A 90.520 1 ATOM 649 H HD11 . ILE 38 38 ? A 23.230 11.368 -15.934 1.000 1 A 90.520 1 ATOM 650 H HD12 . ILE 38 38 ? A 21.502 10.994 -15.824 1.000 1 A 90.520 1 ATOM 651 H HD13 . ILE 38 38 ? A 22.645 10.153 -14.768 1.000 1 A 90.520 1 ATOM 652 N N . SER 39 39 ? A 24.492 14.025 -10.462 1.000 1 A 88.990 1 ATOM 653 C CA . SER 39 39 ? A 25.697 14.128 -9.635 1.000 1 A 88.990 1 ATOM 654 C C . SER 39 39 ? A 26.056 12.773 -9.026 1.000 1 A 88.990 1 ATOM 655 O O . SER 39 39 ? A 25.181 11.965 -8.720 1.000 1 A 88.990 1 ATOM 656 C CB . SER 39 39 ? A 25.578 15.256 -8.609 1.000 1 A 88.990 1 ATOM 657 O OG . SER 39 39 ? A 24.418 15.127 -7.821 1.000 1 A 88.990 1 ATOM 658 H H . SER 39 39 ? A 23.651 13.666 -10.033 1.000 1 A 88.990 1 ATOM 659 H HA . SER 39 39 ? A 26.534 14.405 -10.276 1.000 1 A 88.990 1 ATOM 660 H HB2 . SER 39 39 ? A 26.459 15.256 -7.967 1.000 1 A 88.990 1 ATOM 661 H HB3 . SER 39 39 ? A 25.539 16.207 -9.139 1.000 1 A 88.990 1 ATOM 662 H HG . SER 39 39 ? A 23.655 15.085 -8.402 1.000 1 A 88.990 1 ATOM 663 N N . LEU 40 40 ? A 27.352 12.495 -8.895 1.000 1 A 89.130 1 ATOM 664 C CA . LEU 40 40 ? A 27.886 11.220 -8.421 1.000 1 A 89.130 1 ATOM 665 C C . LEU 40 40 ? A 28.719 11.434 -7.154 1.000 1 A 89.130 1 ATOM 666 O O . LEU 40 40 ? A 29.844 11.937 -7.205 1.000 1 A 89.130 1 ATOM 667 C CB . LEU 40 40 ? A 28.691 10.550 -9.554 1.000 1 A 89.130 1 ATOM 668 C CG . LEU 40 40 ? A 29.350 9.216 -9.146 1.000 1 A 89.130 1 ATOM 669 C CD1 . LEU 40 40 ? A 28.355 8.081 -8.910 1.000 1 A 89.130 1 ATOM 670 C CD2 . LEU 40 40 ? A 30.317 8.753 -10.238 1.000 1 A 89.130 1 ATOM 671 H H . LEU 40 40 ? A 28.011 13.215 -9.153 1.000 1 A 89.130 1 ATOM 672 H HA . LEU 40 40 ? A 27.058 10.559 -8.168 1.000 1 A 89.130 1 ATOM 673 H HB2 . LEU 40 40 ? A 29.472 11.243 -9.869 1.000 1 A 89.130 1 ATOM 674 H HB3 . LEU 40 40 ? A 28.032 10.377 -10.404 1.000 1 A 89.130 1 ATOM 675 H HG . LEU 40 40 ? A 29.927 9.357 -8.233 1.000 1 A 89.130 1 ATOM 676 H HD11 . LEU 40 40 ? A 28.879 7.201 -8.535 1.000 1 A 89.130 1 ATOM 677 H HD12 . LEU 40 40 ? A 27.616 8.375 -8.166 1.000 1 A 89.130 1 ATOM 678 H HD13 . LEU 40 40 ? A 27.852 7.825 -9.842 1.000 1 A 89.130 1 ATOM 679 H HD21 . LEU 40 40 ? A 31.067 9.526 -10.406 1.000 1 A 89.130 1 ATOM 680 H HD22 . LEU 40 40 ? A 29.768 8.586 -11.165 1.000 1 A 89.130 1 ATOM 681 H HD23 . LEU 40 40 ? A 30.799 7.827 -9.924 1.000 1 A 89.130 1 ATOM 682 N N . ASP 41 41 ? A 28.206 10.955 -6.025 1.000 1 A 88.070 1 ATOM 683 C CA . ASP 41 41 ? A 28.985 10.789 -4.803 1.000 1 A 88.070 1 ATOM 684 C C . ASP 41 41 ? A 29.869 9.545 -4.938 1.000 1 A 88.070 1 ATOM 685 O O . ASP 41 41 ? A 29.407 8.412 -4.831 1.000 1 A 88.070 1 ATOM 686 C CB . ASP 41 41 ? A 28.053 10.704 -3.589 1.000 1 A 88.070 1 ATOM 687 C CG . ASP 41 41 ? A 28.800 10.530 -2.260 1.000 1 A 88.070 1 ATOM 688 O OD1 . ASP 41 41 ? A 30.031 10.292 -2.270 1.000 1 A 88.070 1 ATOM 689 O OD2 . ASP 41 41 ? A 28.129 10.634 -1.211 1.000 1 A 88.070 1 ATOM 690 H H . ASP 41 41 ? A 27.305 10.501 -6.070 1.000 1 A 88.070 1 ATOM 691 H HA . ASP 41 41 ? A 29.627 11.659 -4.663 1.000 1 A 88.070 1 ATOM 692 H HB2 . ASP 41 41 ? A 27.469 11.624 -3.543 1.000 1 A 88.070 1 ATOM 693 H HB3 . ASP 41 41 ? A 27.367 9.867 -3.720 1.000 1 A 88.070 1 ATOM 694 N N . CYS 42 42 ? A 31.163 9.751 -5.176 1.000 1 A 80.900 1 ATOM 695 C CA . CYS 42 42 ? A 32.114 8.653 -5.345 1.000 1 A 80.900 1 ATOM 696 C C . CYS 42 42 ? A 32.543 7.982 -4.042 1.000 1 A 80.900 1 ATOM 697 O O . CYS 42 42 ? A 33.105 6.892 -4.109 1.000 1 A 80.900 1 ATOM 698 C CB . CYS 42 42 ? A 33.334 9.169 -6.104 1.000 1 A 80.900 1 ATOM 699 S SG . CYS 42 42 ? A 32.803 9.410 -7.812 1.000 1 A 80.900 1 ATOM 700 H H . CYS 42 42 ? A 31.480 10.706 -5.259 1.000 1 A 80.900 1 ATOM 701 H HA . CYS 42 42 ? A 31.644 7.866 -5.935 1.000 1 A 80.900 1 ATOM 702 H HB2 . CYS 42 42 ? A 34.129 8.425 -6.064 1.000 1 A 80.900 1 ATOM 703 H HB3 . CYS 42 42 ? A 33.685 10.102 -5.664 1.000 1 A 80.900 1 ATOM 704 H HG . CYS 42 42 ? A 31.718 10.138 -7.530 1.000 1 A 80.900 1 ATOM 705 N N . LYS 43 43 ? A 32.300 8.599 -2.880 1.000 1 A 84.210 1 ATOM 706 C CA . LYS 43 43 ? A 32.622 7.974 -1.594 1.000 1 A 84.210 1 ATOM 707 C C . LYS 43 43 ? A 31.674 6.807 -1.322 1.000 1 A 84.210 1 ATOM 708 O O . LYS 43 43 ? A 32.110 5.769 -0.838 1.000 1 A 84.210 1 ATOM 709 C CB . LYS 43 43 ? A 32.569 9.036 -0.487 1.000 1 A 84.210 1 ATOM 710 C CG . LYS 43 43 ? A 33.037 8.469 0.859 1.000 1 A 84.210 1 ATOM 711 C CD . LYS 43 43 ? A 32.977 9.538 1.953 1.000 1 A 84.210 1 ATOM 712 C CE . LYS 43 43 ? A 33.315 8.890 3.298 1.000 1 A 84.210 1 ATOM 713 N NZ . LYS 43 43 ? A 33.137 9.838 4.424 1.000 1 A 84.210 1 ATOM 714 H H . LYS 43 43 ? A 31.714 9.421 -2.870 1.000 1 A 84.210 1 ATOM 715 H HA . LYS 43 43 ? A 33.626 7.553 -1.637 1.000 1 A 84.210 1 ATOM 716 H HB2 . LYS 43 43 ? A 33.212 9.872 -0.763 1.000 1 A 84.210 1 ATOM 717 H HB3 . LYS 43 43 ? A 31.548 9.403 -0.382 1.000 1 A 84.210 1 ATOM 718 H HG2 . LYS 43 43 ? A 34.060 8.105 0.764 1.000 1 A 84.210 1 ATOM 719 H HG3 . LYS 43 43 ? A 32.391 7.640 1.148 1.000 1 A 84.210 1 ATOM 720 H HD2 . LYS 43 43 ? A 33.685 10.334 1.726 1.000 1 A 84.210 1 ATOM 721 H HD3 . LYS 43 43 ? A 31.969 9.952 1.989 1.000 1 A 84.210 1 ATOM 722 H HE2 . LYS 43 43 ? A 34.341 8.524 3.263 1.000 1 A 84.210 1 ATOM 723 H HE3 . LYS 43 43 ? A 32.658 8.031 3.434 1.000 1 A 84.210 1 ATOM 724 H HZ1 . LYS 43 43 ? A 33.380 9.394 5.298 1.000 1 A 84.210 1 ATOM 725 H HZ2 . LYS 43 43 ? A 33.712 10.660 4.303 1.000 1 A 84.210 1 ATOM 726 H HZ3 . LYS 43 43 ? A 32.169 10.119 4.483 1.000 1 A 84.210 1 ATOM 727 N N . HIS 44 44 ? A 30.404 6.974 -1.683 1.000 1 A 85.530 1 ATOM 728 C CA . HIS 44 44 ? A 29.353 5.976 -1.460 1.000 1 A 85.530 1 ATOM 729 C C . HIS 44 44 ? A 28.841 5.328 -2.758 1.000 1 A 85.530 1 ATOM 730 O O . HIS 44 44 ? A 28.006 4.432 -2.708 1.000 1 A 85.530 1 ATOM 731 C CB . HIS 44 44 ? A 28.230 6.634 -0.650 1.000 1 A 85.530 1 ATOM 732 C CG . HIS 44 44 ? A 28.724 7.346 0.584 1.000 1 A 85.530 1 ATOM 733 N ND1 . HIS 44 44 ? A 28.832 8.709 0.723 1.000 1 A 85.530 1 ATOM 734 C CD2 . HIS 44 44 ? A 29.195 6.782 1.741 1.000 1 A 85.530 1 ATOM 735 C CE1 . HIS 44 44 ? A 29.324 8.961 1.942 1.000 1 A 85.530 1 ATOM 736 N NE2 . HIS 44 44 ? A 29.602 7.820 2.594 1.000 1 A 85.530 1 ATOM 737 H H . HIS 44 44 ? A 30.131 7.894 -1.996 1.000 1 A 85.530 1 ATOM 738 H HA . HIS 44 44 ? A 29.753 5.163 -0.855 1.000 1 A 85.530 1 ATOM 739 H HB2 . HIS 44 44 ? A 27.726 7.366 -1.282 1.000 1 A 85.530 1 ATOM 740 H HB3 . HIS 44 44 ? A 27.503 5.876 -0.357 1.000 1 A 85.530 1 ATOM 741 H HD1 . HIS 44 44 ? A 28.539 9.402 0.049 1.000 1 A 85.530 1 ATOM 742 H HD2 . HIS 44 44 ? A 29.262 5.724 1.947 1.000 1 A 85.530 1 ATOM 743 H HE1 . HIS 44 44 ? A 29.467 9.953 2.344 1.000 1 A 85.530 1 ATOM 744 N N . MET 45 45 ? A 29.349 5.765 -3.918 1.000 1 A 87.610 1 ATOM 745 C CA . MET 45 45 ? A 28.900 5.356 -5.256 1.000 1 A 87.610 1 ATOM 746 C C . MET 45 45 ? A 27.391 5.567 -5.468 1.000 1 A 87.610 1 ATOM 747 O O . MET 45 45 ? A 26.694 4.692 -5.988 1.000 1 A 87.610 1 ATOM 748 C CB . MET 45 45 ? A 29.402 3.940 -5.585 1.000 1 A 87.610 1 ATOM 749 C CG . MET 45 45 ? A 30.933 3.878 -5.695 1.000 1 A 87.610 1 ATOM 750 S SD . MET 45 45 ? A 31.679 4.774 -7.099 1.000 1 A 87.610 1 ATOM 751 C CE . MET 45 45 ? A 30.897 3.887 -8.470 1.000 1 A 87.610 1 ATOM 752 H H . MET 45 45 ? A 29.978 6.554 -3.874 1.000 1 A 87.610 1 ATOM 753 H HA . MET 45 45 ? A 29.373 6.034 -5.967 1.000 1 A 87.610 1 ATOM 754 H HB2 . MET 45 45 ? A 29.072 3.246 -4.812 1.000 1 A 87.610 1 ATOM 755 H HB3 . MET 45 45 ? A 28.969 3.608 -6.529 1.000 1 A 87.610 1 ATOM 756 H HG2 . MET 45 45 ? A 31.220 2.830 -5.776 1.000 1 A 87.610 1 ATOM 757 H HG3 . MET 45 45 ? A 31.370 4.260 -4.772 1.000 1 A 87.610 1 ATOM 758 H HE1 . MET 45 45 ? A 29.869 4.234 -8.577 1.000 1 A 87.610 1 ATOM 759 H HE2 . MET 45 45 ? A 31.437 4.074 -9.398 1.000 1 A 87.610 1 ATOM 760 H HE3 . MET 45 45 ? A 30.895 2.816 -8.267 1.000 1 A 87.610 1 ATOM 761 N N . LEU 46 46 ? A 26.907 6.750 -5.070 1.000 1 A 91.700 1 ATOM 762 C CA . LEU 46 46 ? A 25.503 7.156 -5.163 1.000 1 A 91.700 1 ATOM 763 C C . LEU 46 46 ? A 25.291 8.209 -6.258 1.000 1 A 91.700 1 ATOM 764 O O . LEU 46 46 ? A 25.989 9.221 -6.315 1.000 1 A 91.700 1 ATOM 765 C CB . LEU 46 46 ? A 24.985 7.688 -3.813 1.000 1 A 91.700 1 ATOM 766 C CG . LEU 46 46 ? A 25.047 6.707 -2.631 1.000 1 A 91.700 1 ATOM 767 C CD1 . LEU 46 46 ? A 24.643 7.426 -1.347 1.000 1 A 91.700 1 ATOM 768 C CD2 . LEU 46 46 ? A 24.133 5.501 -2.818 1.000 1 A 91.700 1 ATOM 769 H H . LEU 46 46 ? A 27.569 7.429 -4.722 1.000 1 A 91.700 1 ATOM 770 H HA . LEU 46 46 ? A 24.906 6.281 -5.422 1.000 1 A 91.700 1 ATOM 771 H HB2 . LEU 46 46 ? A 25.558 8.577 -3.551 1.000 1 A 91.700 1 ATOM 772 H HB3 . LEU 46 46 ? A 23.948 7.998 -3.943 1.000 1 A 91.700 1 ATOM 773 H HG . LEU 46 46 ? A 26.070 6.349 -2.512 1.000 1 A 91.700 1 ATOM 774 H HD11 . LEU 46 46 ? A 23.609 7.765 -1.418 1.000 1 A 91.700 1 ATOM 775 H HD12 . LEU 46 46 ? A 25.292 8.284 -1.174 1.000 1 A 91.700 1 ATOM 776 H HD13 . LEU 46 46 ? A 24.727 6.747 -0.498 1.000 1 A 91.700 1 ATOM 777 H HD21 . LEU 46 46 ? A 24.098 4.918 -1.897 1.000 1 A 91.700 1 ATOM 778 H HD22 . LEU 46 46 ? A 24.546 4.868 -3.603 1.000 1 A 91.700 1 ATOM 779 H HD23 . LEU 46 46 ? A 23.123 5.825 -3.071 1.000 1 A 91.700 1 ATOM 780 N N . ILE 47 47 ? A 24.281 7.992 -7.087 1.000 1 A 90.810 1 ATOM 781 C CA . ILE 47 47 ? A 23.709 8.946 -8.029 1.000 1 A 90.810 1 ATOM 782 C C . ILE 47 47 ? A 22.709 9.826 -7.284 1.000 1 A 90.810 1 ATOM 783 O O . ILE 47 47 ? A 21.673 9.347 -6.829 1.000 1 A 90.810 1 ATOM 784 C CB . ILE 47 47 ? A 23.029 8.190 -9.192 1.000 1 A 90.810 1 ATOM 785 C CG1 . ILE 47 47 ? A 24.002 7.279 -9.969 1.000 1 A 90.810 1 ATOM 786 C CG2 . ILE 47 47 ? A 22.330 9.186 -10.130 1.000 1 A 90.810 1 ATOM 787 C CD1 . ILE 47 47 ? A 25.136 8.025 -10.672 1.000 1 A 90.810 1 ATOM 788 H H . ILE 47 47 ? A 23.765 7.134 -6.956 1.000 1 A 90.810 1 ATOM 789 H HA . ILE 47 47 ? A 24.500 9.582 -8.427 1.000 1 A 90.810 1 ATOM 790 H HB . ILE 47 47 ? A 22.260 7.539 -8.777 1.000 1 A 90.810 1 ATOM 791 H HG12 . ILE 47 47 ? A 24.433 6.541 -9.292 1.000 1 A 90.810 1 ATOM 792 H HG13 . ILE 47 47 ? A 23.440 6.730 -10.725 1.000 1 A 90.810 1 ATOM 793 H HG21 . ILE 47 47 ? A 22.086 8.713 -11.081 1.000 1 A 90.810 1 ATOM 794 H HG22 . ILE 47 47 ? A 22.975 10.051 -10.289 1.000 1 A 90.810 1 ATOM 795 H HG23 . ILE 47 47 ? A 21.401 9.527 -9.672 1.000 1 A 90.810 1 ATOM 796 H HD11 . ILE 47 47 ? A 24.724 8.695 -11.427 1.000 1 A 90.810 1 ATOM 797 H HD12 . ILE 47 47 ? A 25.715 8.607 -9.955 1.000 1 A 90.810 1 ATOM 798 H HD13 . ILE 47 47 ? A 25.787 7.299 -11.159 1.000 1 A 90.810 1 ATOM 799 N N . LYS 48 48 ? A 23.001 11.117 -7.166 1.000 1 A 87.930 1 ATOM 800 C CA . LYS 48 48 ? A 22.110 12.094 -6.541 1.000 1 A 87.930 1 ATOM 801 C C . LYS 48 48 ? A 21.278 12.800 -7.604 1.000 1 A 87.930 1 ATOM 802 O O . LYS 48 48 ? A 21.807 13.316 -8.591 1.000 1 A 87.930 1 ATOM 803 C CB . LYS 48 48 ? A 22.915 13.079 -5.693 1.000 1 A 87.930 1 ATOM 804 C CG . LYS 48 48 ? A 23.561 12.426 -4.470 1.000 1 A 87.930 1 ATOM 805 C CD . LYS 48 48 ? A 24.282 13.492 -3.639 1.000 1 A 87.930 1 ATOM 806 C CE . LYS 48 48 ? A 24.916 12.816 -2.422 1.000 1 A 87.930 1 ATOM 807 N NZ . LYS 48 48 ? A 25.582 13.792 -1.530 1.000 1 A 87.930 1 ATOM 808 H H . LYS 48 48 ? A 23.844 11.454 -7.609 1.000 1 A 87.930 1 ATOM 809 H HA . LYS 48 48 ? A 21.419 11.578 -5.875 1.000 1 A 87.930 1 ATOM 810 H HB2 . LYS 48 48 ? A 22.261 13.888 -5.368 1.000 1 A 87.930 1 ATOM 811 H HB3 . LYS 48 48 ? A 23.722 13.484 -6.302 1.000 1 A 87.930 1 ATOM 812 H HG2 . LYS 48 48 ? A 22.790 11.950 -3.864 1.000 1 A 87.930 1 ATOM 813 H HG3 . LYS 48 48 ? A 24.279 11.670 -4.791 1.000 1 A 87.930 1 ATOM 814 H HD2 . LYS 48 48 ? A 23.559 14.239 -3.311 1.000 1 A 87.930 1 ATOM 815 H HD3 . LYS 48 48 ? A 25.051 13.969 -4.246 1.000 1 A 87.930 1 ATOM 816 H HE2 . LYS 48 48 ? A 25.631 12.070 -2.768 1.000 1 A 87.930 1 ATOM 817 H HE3 . LYS 48 48 ? A 24.135 12.286 -1.876 1.000 1 A 87.930 1 ATOM 818 H HZ1 . LYS 48 48 ? A 26.270 14.328 -2.039 1.000 1 A 87.930 1 ATOM 819 H HZ2 . LYS 48 48 ? A 26.046 13.294 -0.783 1.000 1 A 87.930 1 ATOM 820 H HZ3 . LYS 48 48 ? A 24.897 14.415 -1.127 1.000 1 A 87.930 1 ATOM 821 N N . LEU 49 49 ? A 19.972 12.821 -7.361 1.000 1 A 84.740 1 ATOM 822 C CA . LEU 49 49 ? A 18.950 13.471 -8.176 1.000 1 A 84.740 1 ATOM 823 C C . LEU 49 49 ? A 17.968 14.177 -7.237 1.000 1 A 84.740 1 ATOM 824 O O . LEU 49 49 ? A 17.731 13.666 -6.143 1.000 1 A 84.740 1 ATOM 825 C CB . LEU 49 49 ? A 18.189 12.409 -8.986 1.000 1 A 84.740 1 ATOM 826 C CG . LEU 49 49 ? A 19.017 11.744 -10.092 1.000 1 A 84.740 1 ATOM 827 C CD1 . LEU 49 49 ? A 18.310 10.472 -10.547 1.000 1 A 84.740 1 ATOM 828 C CD2 . LEU 49 49 ? A 19.210 12.677 -11.287 1.000 1 A 84.740 1 ATOM 829 H H . LEU 49 49 ? A 19.651 12.413 -6.496 1.000 1 A 84.740 1 ATOM 830 H HA . LEU 49 49 ? A 19.416 14.194 -8.844 1.000 1 A 84.740 1 ATOM 831 H HB2 . LEU 49 49 ? A 17.303 12.859 -9.436 1.000 1 A 84.740 1 ATOM 832 H HB3 . LEU 49 49 ? A 17.853 11.645 -8.285 1.000 1 A 84.740 1 ATOM 833 H HG . LEU 49 49 ? A 19.994 11.456 -9.706 1.000 1 A 84.740 1 ATOM 834 H HD11 . LEU 49 49 ? A 17.339 10.704 -10.984 1.000 1 A 84.740 1 ATOM 835 H HD12 . LEU 49 49 ? A 18.934 9.968 -11.285 1.000 1 A 84.740 1 ATOM 836 H HD13 . LEU 49 49 ? A 18.181 9.794 -9.703 1.000 1 A 84.740 1 ATOM 837 H HD21 . LEU 49 49 ? A 19.775 12.158 -12.061 1.000 1 A 84.740 1 ATOM 838 H HD22 . LEU 49 49 ? A 18.247 12.986 -11.695 1.000 1 A 84.740 1 ATOM 839 H HD23 . LEU 49 49 ? A 19.776 13.560 -10.990 1.000 1 A 84.740 1 ATOM 840 N N . PRO 50 50 ? A 17.317 15.277 -7.655 1.000 1 A 78.960 1 ATOM 841 C CA . PRO 50 50 ? A 16.317 15.945 -6.820 1.000 1 A 78.960 1 ATOM 842 C C . PRO 50 50 ? A 15.172 15.024 -6.376 1.000 1 A 78.960 1 ATOM 843 O O . PRO 50 50 ? A 14.661 15.164 -5.273 1.000 1 A 78.960 1 ATOM 844 C CB . PRO 50 50 ? A 15.798 17.107 -7.668 1.000 1 A 78.960 1 ATOM 845 C CG . PRO 50 50 ? A 16.974 17.418 -8.589 1.000 1 A 78.960 1 ATOM 846 C CD . PRO 50 50 ? A 17.558 16.035 -8.873 1.000 1 A 78.960 1 ATOM 847 H HA . PRO 50 50 ? A 16.809 16.340 -5.931 1.000 1 A 78.960 1 ATOM 848 H HB2 . PRO 50 50 ? A 15.530 17.965 -7.052 1.000 1 A 78.960 1 ATOM 849 H HB3 . PRO 50 50 ? A 14.945 16.789 -8.268 1.000 1 A 78.960 1 ATOM 850 H HG2 . PRO 50 50 ? A 17.708 18.023 -8.056 1.000 1 A 78.960 1 ATOM 851 H HG3 . PRO 50 50 ? A 16.643 17.927 -9.494 1.000 1 A 78.960 1 ATOM 852 H HD2 . PRO 50 50 ? A 17.027 15.567 -9.702 1.000 1 A 78.960 1 ATOM 853 H HD3 . PRO 50 50 ? A 18.620 16.127 -9.101 1.000 1 A 78.960 1 ATOM 854 N N . SER 51 51 ? A 14.794 14.052 -7.213 1.000 1 A 77.580 1 ATOM 855 C CA . SER 51 51 ? A 13.732 13.080 -6.914 1.000 1 A 77.580 1 ATOM 856 C C . SER 51 51 ? A 14.145 11.963 -5.946 1.000 1 A 77.580 1 ATOM 857 O O . SER 51 51 ? A 13.288 11.195 -5.524 1.000 1 A 77.580 1 ATOM 858 C CB . SER 51 51 ? A 13.231 12.446 -8.215 1.000 1 A 77.580 1 ATOM 859 O OG . SER 51 51 ? A 12.951 13.444 -9.180 1.000 1 A 77.580 1 ATOM 860 H H . SER 51 51 ? A 15.200 14.027 -8.138 1.000 1 A 77.580 1 ATOM 861 H HA . SER 51 51 ? A 12.900 13.607 -6.447 1.000 1 A 77.580 1 ATOM 862 H HB2 . SER 51 51 ? A 12.331 11.865 -8.014 1.000 1 A 77.580 1 ATOM 863 H HB3 . SER 51 51 ? A 13.997 11.778 -8.609 1.000 1 A 77.580 1 ATOM 864 H HG . SER 51 51 ? A 12.264 14.016 -8.830 1.000 1 A 77.580 1 ATOM 865 N N . PHE 52 52 ? A 15.434 11.846 -5.615 1.000 1 A 78.700 1 ATOM 866 C CA . PHE 52 52 ? A 15.984 10.809 -4.740 1.000 1 A 78.700 1 ATOM 867 C C . PHE 52 52 ? A 16.972 11.450 -3.759 1.000 1 A 78.700 1 ATOM 868 O O . PHE 52 52 ? A 18.183 11.414 -3.980 1.000 1 A 78.700 1 ATOM 869 C CB . PHE 52 52 ? A 16.651 9.706 -5.583 1.000 1 A 78.700 1 ATOM 870 C CG . PHE 52 52 ? A 15.713 8.948 -6.503 1.000 1 A 78.700 1 ATOM 871 C CD1 . PHE 52 52 ? A 14.909 7.912 -5.995 1.000 1 A 78.700 1 ATOM 872 C CD2 . PHE 52 52 ? A 15.650 9.269 -7.872 1.000 1 A 78.700 1 ATOM 873 C CE1 . PHE 52 52 ? A 14.066 7.184 -6.855 1.000 1 A 78.700 1 ATOM 874 C CE2 . PHE 52 52 ? A 14.804 8.548 -8.731 1.000 1 A 78.700 1 ATOM 875 C CZ . PHE 52 52 ? A 14.020 7.498 -8.225 1.000 1 A 78.700 1 ATOM 876 H H . PHE 52 52 ? A 16.075 12.562 -5.927 1.000 1 A 78.700 1 ATOM 877 H HA . PHE 52 52 ? A 15.184 10.355 -4.157 1.000 1 A 78.700 1 ATOM 878 H HB2 . PHE 52 52 ? A 17.451 10.145 -6.179 1.000 1 A 78.700 1 ATOM 879 H HB3 . PHE 52 52 ? A 17.112 8.987 -4.905 1.000 1 A 78.700 1 ATOM 880 H HD1 . PHE 52 52 ? A 14.947 7.666 -4.944 1.000 1 A 78.700 1 ATOM 881 H HD2 . PHE 52 52 ? A 16.256 10.071 -8.268 1.000 1 A 78.700 1 ATOM 882 H HE1 . PHE 52 52 ? A 13.463 6.382 -6.456 1.000 1 A 78.700 1 ATOM 883 H HE2 . PHE 52 52 ? A 14.765 8.791 -9.783 1.000 1 A 78.700 1 ATOM 884 H HZ . PHE 52 52 ? A 13.387 6.930 -8.890 1.000 1 A 78.700 1 ATOM 885 N N . ALA 53 53 ? A 16.451 12.057 -2.687 1.000 1 A 72.390 1 ATOM 886 C CA . ALA 53 53 ? A 17.243 12.822 -1.716 1.000 1 A 72.390 1 ATOM 887 C C . ALA 53 53 ? A 18.399 12.011 -1.094 1.000 1 A 72.390 1 ATOM 888 O O . ALA 53 53 ? A 19.506 12.531 -0.953 1.000 1 A 72.390 1 ATOM 889 C CB . ALA 53 53 ? A 16.292 13.353 -0.636 1.000 1 A 72.390 1 ATOM 890 H H . ALA 53 53 ? A 15.446 12.077 -2.585 1.000 1 A 72.390 1 ATOM 891 H HA . ALA 53 53 ? A 17.689 13.674 -2.230 1.000 1 A 72.390 1 ATOM 892 H HB1 . ALA 53 53 ? A 16.853 13.959 0.075 1.000 1 A 72.390 1 ATOM 893 H HB2 . ALA 53 53 ? A 15.831 12.524 -0.099 1.000 1 A 72.390 1 ATOM 894 H HB3 . ALA 53 53 ? A 15.515 13.969 -1.090 1.000 1 A 72.390 1 ATOM 895 N N . ASP 54 54 ? A 18.167 10.725 -0.816 1.000 1 A 77.900 1 ATOM 896 C CA . ASP 54 54 ? A 19.172 9.803 -0.262 1.000 1 A 77.900 1 ATOM 897 C C . ASP 54 54 ? A 20.196 9.316 -1.308 1.000 1 A 77.900 1 ATOM 898 O O . ASP 54 54 ? A 21.204 8.695 -0.974 1.000 1 A 77.900 1 ATOM 899 C CB . ASP 54 54 ? A 18.452 8.612 0.394 1.000 1 A 77.900 1 ATOM 900 C CG . ASP 54 54 ? A 17.498 9.030 1.520 1.000 1 A 77.900 1 ATOM 901 O OD1 . ASP 54 54 ? A 17.839 9.989 2.248 1.000 1 A 77.900 1 ATOM 902 O OD2 . ASP 54 54 ? A 16.415 8.406 1.612 1.000 1 A 77.900 1 ATOM 903 H H . ASP 54 54 ? A 17.215 10.390 -0.865 1.000 1 A 77.900 1 ATOM 904 H HA . ASP 54 54 ? A 19.730 10.324 0.517 1.000 1 A 77.900 1 ATOM 905 H HB2 . ASP 54 54 ? A 19.197 7.934 0.811 1.000 1 A 77.900 1 ATOM 906 H HB3 . ASP 54 54 ? A 17.896 8.073 -0.373 1.000 1 A 77.900 1 ATOM 907 N N . GLY 55 55 ? A 19.964 9.623 -2.588 1.000 1 A 86.910 1 ATOM 908 C CA . GLY 55 55 ? A 20.709 9.093 -3.721 1.000 1 A 86.910 1 ATOM 909 C C . GLY 55 55 ? A 20.348 7.644 -4.065 1.000 1 A 86.910 1 ATOM 910 O O . GLY 55 55 ? A 19.748 6.908 -3.287 1.000 1 A 86.910 1 ATOM 911 H H . GLY 55 55 ? A 19.163 10.206 -2.785 1.000 1 A 86.910 1 ATOM 912 H HA2 . GLY 55 55 ? A 20.495 9.716 -4.590 1.000 1 A 86.910 1 ATOM 913 H HA3 . GLY 55 55 ? A 21.778 9.143 -3.514 1.000 1 A 86.910 1 ATOM 914 N N . LEU 56 56 ? A 20.718 7.227 -5.272 1.000 1 A 91.590 1 ATOM 915 C CA . LEU 56 56 ? A 20.580 5.858 -5.761 1.000 1 A 91.590 1 ATOM 916 C C . LEU 56 56 ? A 21.955 5.224 -5.862 1.000 1 A 91.590 1 ATOM 917 O O . LEU 56 56 ? A 22.826 5.778 -6.525 1.000 1 A 91.590 1 ATOM 918 C CB . LEU 56 56 ? A 19.923 5.866 -7.152 1.000 1 A 91.590 1 ATOM 919 C CG . LEU 56 56 ? A 18.486 6.397 -7.195 1.000 1 A 91.590 1 ATOM 920 C CD1 . LEU 56 56 ? A 17.982 6.327 -8.638 1.000 1 A 91.590 1 ATOM 921 C CD2 . LEU 56 56 ? A 17.575 5.557 -6.305 1.000 1 A 91.590 1 ATOM 922 H H . LEU 56 56 ? A 21.163 7.898 -5.881 1.000 1 A 91.590 1 ATOM 923 H HA . LEU 56 56 ? A 19.978 5.264 -5.074 1.000 1 A 91.590 1 ATOM 924 H HB2 . LEU 56 56 ? A 19.932 4.847 -7.539 1.000 1 A 91.590 1 ATOM 925 H HB3 . LEU 56 56 ? A 20.529 6.478 -7.819 1.000 1 A 91.590 1 ATOM 926 H HG . LEU 56 56 ? A 18.457 7.437 -6.868 1.000 1 A 91.590 1 ATOM 927 H HD11 . LEU 56 56 ? A 16.965 6.717 -8.686 1.000 1 A 91.590 1 ATOM 928 H HD12 . LEU 56 56 ? A 17.981 5.294 -8.986 1.000 1 A 91.590 1 ATOM 929 H HD13 . LEU 56 56 ? A 18.618 6.932 -9.283 1.000 1 A 91.590 1 ATOM 930 H HD21 . LEU 56 56 ? A 17.763 5.794 -5.258 1.000 1 A 91.590 1 ATOM 931 H HD22 . LEU 56 56 ? A 17.766 4.498 -6.475 1.000 1 A 91.590 1 ATOM 932 H HD23 . LEU 56 56 ? A 16.530 5.777 -6.525 1.000 1 A 91.590 1 ATOM 933 N N . ASP 57 57 ? A 22.170 4.041 -5.299 1.000 1 A 92.390 1 ATOM 934 C CA . ASP 57 57 ? A 23.393 3.319 -5.645 1.000 1 A 92.390 1 ATOM 935 C C . ASP 57 57 ? A 23.427 2.981 -7.138 1.000 1 A 92.390 1 ATOM 936 O O . ASP 57 57 ? A 22.397 2.866 -7.808 1.000 1 A 92.390 1 ATOM 937 C CB . ASP 57 57 ? A 23.581 2.080 -4.785 1.000 1 A 92.390 1 ATOM 938 C CG . ASP 57 57 ? A 22.593 1.007 -5.192 1.000 1 A 92.390 1 ATOM 939 O OD1 . ASP 57 57 ? A 22.946 0.137 -6.014 1.000 1 A 92.390 1 ATOM 940 O OD2 . ASP 57 57 ? A 21.499 0.980 -4.592 1.000 1 A 92.390 1 ATOM 941 H H . ASP 57 57 ? A 21.438 3.577 -4.780 1.000 1 A 92.390 1 ATOM 942 H HA . ASP 57 57 ? A 24.243 3.975 -5.458 1.000 1 A 92.390 1 ATOM 943 H HB2 . ASP 57 57 ? A 24.596 1.705 -4.918 1.000 1 A 92.390 1 ATOM 944 H HB3 . ASP 57 57 ? A 23.451 2.334 -3.733 1.000 1 A 92.390 1 ATOM 945 N N . LEU 58 58 ? A 24.639 2.820 -7.657 1.000 1 A 93.090 1 ATOM 946 C CA . LEU 58 58 ? A 24.869 2.709 -9.090 1.000 1 A 93.090 1 ATOM 947 C C . LEU 58 58 ? A 24.112 1.538 -9.758 1.000 1 A 93.090 1 ATOM 948 O O . LEU 58 58 ? A 23.661 1.683 -10.894 1.000 1 A 93.090 1 ATOM 949 C CB . LEU 58 58 ? A 26.391 2.628 -9.285 1.000 1 A 93.090 1 ATOM 950 C CG . LEU 58 58 ? A 26.821 2.839 -10.740 1.000 1 A 93.090 1 ATOM 951 C CD1 . LEU 58 58 ? A 26.574 4.261 -11.246 1.000 1 A 93.090 1 ATOM 952 C CD2 . LEU 58 58 ? A 28.310 2.537 -10.893 1.000 1 A 93.090 1 ATOM 953 H H . LEU 58 58 ? A 25.431 3.011 -7.060 1.000 1 A 93.090 1 ATOM 954 H HA . LEU 58 58 ? A 24.495 3.627 -9.543 1.000 1 A 93.090 1 ATOM 955 H HB2 . LEU 58 58 ? A 26.730 1.648 -8.950 1.000 1 A 93.090 1 ATOM 956 H HB3 . LEU 58 58 ? A 26.878 3.385 -8.671 1.000 1 A 93.090 1 ATOM 957 H HG . LEU 58 58 ? A 26.250 2.151 -11.363 1.000 1 A 93.090 1 ATOM 958 H HD11 . LEU 58 58 ? A 27.059 4.985 -10.590 1.000 1 A 93.090 1 ATOM 959 H HD12 . LEU 58 58 ? A 26.966 4.359 -12.258 1.000 1 A 93.090 1 ATOM 960 H HD13 . LEU 58 58 ? A 25.504 4.465 -11.283 1.000 1 A 93.090 1 ATOM 961 H HD21 . LEU 58 58 ? A 28.575 2.577 -11.950 1.000 1 A 93.090 1 ATOM 962 H HD22 . LEU 58 58 ? A 28.899 3.272 -10.345 1.000 1 A 93.090 1 ATOM 963 H HD23 . LEU 58 58 ? A 28.524 1.538 -10.513 1.000 1 A 93.090 1 ATOM 964 N N . ASN 59 59 ? A 23.921 0.406 -9.068 1.000 1 A 93.510 1 ATOM 965 C CA . ASN 59 59 ? A 23.169 -0.731 -9.616 1.000 1 A 93.510 1 ATOM 966 C C . ASN 59 59 ? A 21.667 -0.441 -9.652 1.000 1 A 93.510 1 ATOM 967 O O . ASN 59 59 ? A 20.999 -0.757 -10.634 1.000 1 A 93.510 1 ATOM 968 C CB . ASN 59 59 ? A 23.454 -1.998 -8.797 1.000 1 A 93.510 1 ATOM 969 C CG . ASN 59 59 ? A 24.858 -2.530 -8.996 1.000 1 A 93.510 1 ATOM 970 O OD1 . ASN 59 59 ? A 25.477 -2.398 -10.039 1.000 1 A 93.510 1 ATOM 971 N ND2 . ASN 59 59 ? A 25.415 -3.167 -7.995 1.000 1 A 93.510 1 ATOM 972 H H . ASN 59 59 ? A 24.163 0.394 -8.087 1.000 1 A 93.510 1 ATOM 973 H HA . ASN 59 59 ? A 23.480 -0.905 -10.646 1.000 1 A 93.510 1 ATOM 974 H HB2 . ASN 59 59 ? A 22.763 -2.784 -9.102 1.000 1 A 93.510 1 ATOM 975 H HB3 . ASN 59 59 ? A 23.281 -1.794 -7.740 1.000 1 A 93.510 1 ATOM 976 H HD21 . ASN 59 59 ? A 24.911 -3.260 -7.125 1.000 1 A 93.510 1 ATOM 977 H HD22 . ASN 59 59 ? A 26.365 -3.481 -8.134 1.000 1 A 93.510 1 ATOM 978 N N . THR 60 60 ? A 21.143 0.215 -8.622 1.000 1 A 93.620 1 ATOM 979 C CA . THR 60 60 ? A 19.746 0.657 -8.582 1.000 1 A 93.620 1 ATOM 980 C C . THR 60 60 ? A 19.448 1.704 -9.655 1.000 1 A 93.620 1 ATOM 981 O O . THR 60 60 ? A 18.435 1.611 -10.349 1.000 1 A 93.620 1 ATOM 982 C CB . THR 60 60 ? A 19.439 1.221 -7.198 1.000 1 A 93.620 1 ATOM 983 O OG1 . THR 60 60 ? A 19.701 0.232 -6.247 1.000 1 A 93.620 1 ATOM 984 C CG2 . THR 60 60 ? A 17.975 1.569 -7.041 1.000 1 A 93.620 1 ATOM 985 H H . THR 60 60 ? A 21.721 0.396 -7.813 1.000 1 A 93.620 1 ATOM 986 H HA . THR 60 60 ? A 19.096 -0.201 -8.756 1.000 1 A 93.620 1 ATOM 987 H HB . THR 60 60 ? A 20.052 2.099 -6.995 1.000 1 A 93.620 1 ATOM 988 H HG1 . THR 60 60 ? A 20.360 0.568 -5.635 1.000 1 A 93.620 1 ATOM 989 H HG21 . THR 60 60 ? A 17.809 1.850 -6.001 1.000 1 A 93.620 1 ATOM 990 H HG22 . THR 60 60 ? A 17.350 0.711 -7.289 1.000 1 A 93.620 1 ATOM 991 H HG23 . THR 60 60 ? A 17.723 2.404 -7.695 1.000 1 A 93.620 1 ATOM 992 N N . ALA 61 61 ? A 20.356 2.665 -9.851 1.000 1 A 94.520 1 ATOM 993 C CA . ALA 61 61 ? A 20.259 3.649 -10.927 1.000 1 A 94.520 1 ATOM 994 C C . ALA 61 61 ? A 20.266 2.977 -12.312 1.000 1 A 94.520 1 ATOM 995 O O . ALA 61 61 ? A 19.450 3.316 -13.168 1.000 1 A 94.520 1 ATOM 996 C CB . ALA 61 61 ? A 21.411 4.647 -10.776 1.000 1 A 94.520 1 ATOM 997 H H . ALA 61 61 ? A 21.154 2.705 -9.233 1.000 1 A 94.520 1 ATOM 998 H HA . ALA 61 61 ? A 19.317 4.188 -10.828 1.000 1 A 94.520 1 ATOM 999 H HB1 . ALA 61 61 ? A 21.335 5.413 -11.548 1.000 1 A 94.520 1 ATOM 1000 H HB2 . ALA 61 61 ? A 21.364 5.124 -9.797 1.000 1 A 94.520 1 ATOM 1001 H HB3 . ALA 61 61 ? A 22.369 4.137 -10.878 1.000 1 A 94.520 1 ATOM 1002 N N . LEU 62 62 ? A 21.131 1.975 -12.514 1.000 1 A 96.090 1 ATOM 1003 C CA . LEU 62 62 ? A 21.151 1.158 -13.727 1.000 1 A 96.090 1 ATOM 1004 C C . LEU 62 62 ? A 19.825 0.416 -13.950 1.000 1 A 96.090 1 ATOM 1005 O O . LEU 62 62 ? A 19.310 0.433 -15.066 1.000 1 A 96.090 1 ATOM 1006 C CB . LEU 62 62 ? A 22.348 0.194 -13.652 1.000 1 A 96.090 1 ATOM 1007 C CG . LEU 62 62 ? A 22.364 -0.845 -14.782 1.000 1 A 96.090 1 ATOM 1008 C CD1 . LEU 62 62 ? A 22.650 -0.216 -16.144 1.000 1 A 96.090 1 ATOM 1009 C CD2 . LEU 62 62 ? A 23.393 -1.927 -14.505 1.000 1 A 96.090 1 ATOM 1010 H H . LEU 62 62 ? A 21.806 1.772 -11.791 1.000 1 A 96.090 1 ATOM 1011 H HA . LEU 62 62 ? A 21.288 1.810 -14.589 1.000 1 A 96.090 1 ATOM 1012 H HB2 . LEU 62 62 ? A 22.304 -0.341 -12.703 1.000 1 A 96.090 1 ATOM 1013 H HB3 . LEU 62 62 ? A 23.275 0.766 -13.669 1.000 1 A 96.090 1 ATOM 1014 H HG . LEU 62 62 ? A 21.400 -1.352 -14.827 1.000 1 A 96.090 1 ATOM 1015 H HD11 . LEU 62 62 ? A 21.830 0.445 -16.426 1.000 1 A 96.090 1 ATOM 1016 H HD12 . LEU 62 62 ? A 23.584 0.345 -16.116 1.000 1 A 96.090 1 ATOM 1017 H HD13 . LEU 62 62 ? A 22.732 -1.002 -16.894 1.000 1 A 96.090 1 ATOM 1018 H HD21 . LEU 62 62 ? A 24.395 -1.592 -14.774 1.000 1 A 96.090 1 ATOM 1019 H HD22 . LEU 62 62 ? A 23.368 -2.228 -13.458 1.000 1 A 96.090 1 ATOM 1020 H HD23 . LEU 62 62 ? A 23.113 -2.786 -15.114 1.000 1 A 96.090 1 ATOM 1021 N N . MET 63 63 ? A 19.263 -0.223 -12.921 1.000 1 A 94.990 1 ATOM 1022 C CA . MET 63 63 ? A 17.979 -0.927 -13.029 1.000 1 A 94.990 1 ATOM 1023 C C . MET 63 63 ? A 16.859 0.008 -13.483 1.000 1 A 94.990 1 ATOM 1024 O O . MET 63 63 ? A 16.111 -0.323 -14.404 1.000 1 A 94.990 1 ATOM 1025 C CB . MET 63 63 ? A 17.595 -1.541 -11.679 1.000 1 A 94.990 1 ATOM 1026 C CG . MET 63 63 ? A 18.440 -2.764 -11.369 1.000 1 A 94.990 1 ATOM 1027 S SD . MET 63 63 ? A 18.107 -3.538 -9.773 1.000 1 A 94.990 1 ATOM 1028 C CE . MET 63 63 ? A 16.480 -4.267 -10.108 1.000 1 A 94.990 1 ATOM 1029 H H . MET 63 63 ? A 19.746 -0.227 -12.034 1.000 1 A 94.990 1 ATOM 1030 H HA . MET 63 63 ? A 18.060 -1.722 -13.770 1.000 1 A 94.990 1 ATOM 1031 H HB2 . MET 63 63 ? A 16.554 -1.862 -11.728 1.000 1 A 94.990 1 ATOM 1032 H HB3 . MET 63 63 ? A 17.698 -0.808 -10.879 1.000 1 A 94.990 1 ATOM 1033 H HG2 . MET 63 63 ? A 18.237 -3.499 -12.148 1.000 1 A 94.990 1 ATOM 1034 H HG3 . MET 63 63 ? A 19.493 -2.488 -11.413 1.000 1 A 94.990 1 ATOM 1035 H HE1 . MET 63 63 ? A 16.158 -4.864 -9.254 1.000 1 A 94.990 1 ATOM 1036 H HE2 . MET 63 63 ? A 16.540 -4.902 -10.991 1.000 1 A 94.990 1 ATOM 1037 H HE3 . MET 63 63 ? A 15.749 -3.477 -10.281 1.000 1 A 94.990 1 ATOM 1038 N N . LEU 64 64 ? A 16.782 1.195 -12.879 1.000 1 A 94.230 1 ATOM 1039 C CA . LEU 64 64 ? A 15.763 2.184 -13.206 1.000 1 A 94.230 1 ATOM 1040 C C . LEU 64 64 ? A 15.952 2.748 -14.624 1.000 1 A 94.230 1 ATOM 1041 O O . LEU 64 64 ? A 15.002 2.750 -15.402 1.000 1 A 94.230 1 ATOM 1042 C CB . LEU 64 64 ? A 15.773 3.251 -12.102 1.000 1 A 94.230 1 ATOM 1043 C CG . LEU 64 64 ? A 14.656 4.304 -12.214 1.000 1 A 94.230 1 ATOM 1044 C CD1 . LEU 64 64 ? A 13.265 3.674 -12.100 1.000 1 A 94.230 1 ATOM 1045 C CD2 . LEU 64 64 ? A 14.825 5.312 -11.077 1.000 1 A 94.230 1 ATOM 1046 H H . LEU 64 64 ? A 17.429 1.399 -12.131 1.000 1 A 94.230 1 ATOM 1047 H HA . LEU 64 64 ? A 14.797 1.679 -13.193 1.000 1 A 94.230 1 ATOM 1048 H HB2 . LEU 64 64 ? A 15.674 2.751 -11.138 1.000 1 A 94.230 1 ATOM 1049 H HB3 . LEU 64 64 ? A 16.742 3.750 -12.105 1.000 1 A 94.230 1 ATOM 1050 H HG . LEU 64 64 ? A 14.732 4.826 -13.168 1.000 1 A 94.230 1 ATOM 1051 H HD11 . LEU 64 64 ? A 12.515 4.466 -12.102 1.000 1 A 94.230 1 ATOM 1052 H HD12 . LEU 64 64 ? A 13.074 3.041 -12.966 1.000 1 A 94.230 1 ATOM 1053 H HD13 . LEU 64 64 ? A 13.186 3.090 -11.183 1.000 1 A 94.230 1 ATOM 1054 H HD21 . LEU 64 64 ? A 14.776 4.810 -10.111 1.000 1 A 94.230 1 ATOM 1055 H HD22 . LEU 64 64 ? A 15.786 5.817 -11.174 1.000 1 A 94.230 1 ATOM 1056 H HD23 . LEU 64 64 ? A 14.039 6.065 -11.136 1.000 1 A 94.230 1 ATOM 1057 N N . ALA 65 65 ? A 17.181 3.109 -15.012 1.000 1 A 95.210 1 ATOM 1058 C CA . ALA 65 65 ? A 17.493 3.532 -16.381 1.000 1 A 95.210 1 ATOM 1059 C C . ALA 65 65 ? A 17.171 2.443 -17.420 1.000 1 A 95.210 1 ATOM 1060 O O . ALA 65 65 ? A 16.719 2.748 -18.524 1.000 1 A 95.210 1 ATOM 1061 C CB . ALA 65 65 ? A 18.976 3.912 -16.446 1.000 1 A 95.210 1 ATOM 1062 H H . ALA 65 65 ? A 17.931 3.092 -14.336 1.000 1 A 95.210 1 ATOM 1063 H HA . ALA 65 65 ? A 16.893 4.408 -16.625 1.000 1 A 95.210 1 ATOM 1064 H HB1 . ALA 65 65 ? A 19.160 4.767 -15.796 1.000 1 A 95.210 1 ATOM 1065 H HB2 . ALA 65 65 ? A 19.235 4.178 -17.471 1.000 1 A 95.210 1 ATOM 1066 H HB3 . ALA 65 65 ? A 19.596 3.073 -16.130 1.000 1 A 95.210 1 ATOM 1067 N N . THR 66 66 ? A 17.369 1.170 -17.058 1.000 1 A 95.530 1 ATOM 1068 C CA . THR 66 66 ? A 17.038 0.033 -17.926 1.000 1 A 95.530 1 ATOM 1069 C C . THR 66 66 ? A 15.533 -0.121 -18.098 1.000 1 A 95.530 1 ATOM 1070 O O . THR 66 66 ? A 15.066 -0.279 -19.225 1.000 1 A 95.530 1 ATOM 1071 C CB . THR 66 66 ? A 17.661 -1.284 -17.444 1.000 1 A 95.530 1 ATOM 1072 O OG1 . THR 66 66 ? A 19.045 -1.138 -17.222 1.000 1 A 95.530 1 ATOM 1073 C CG2 . THR 66 66 ? A 17.515 -2.340 -18.531 1.000 1 A 95.530 1 ATOM 1074 H H . THR 66 66 ? A 17.765 0.990 -16.147 1.000 1 A 95.530 1 ATOM 1075 H HA . THR 66 66 ? A 17.439 0.237 -18.918 1.000 1 A 95.530 1 ATOM 1076 H HB . THR 66 66 ? A 17.182 -1.624 -16.525 1.000 1 A 95.530 1 ATOM 1077 H HG1 . THR 66 66 ? A 19.153 -0.534 -16.484 1.000 1 A 95.530 1 ATOM 1078 H HG21 . THR 66 66 ? A 18.137 -3.208 -18.314 1.000 1 A 95.530 1 ATOM 1079 H HG22 . THR 66 66 ? A 17.869 -1.926 -19.475 1.000 1 A 95.530 1 ATOM 1080 H HG23 . THR 66 66 ? A 16.473 -2.648 -18.622 1.000 1 A 95.530 1 ATOM 1081 N N . LYS 67 67 ? A 14.762 0.004 -17.012 1.000 1 A 93.270 1 ATOM 1082 C CA . LYS 67 67 ? A 13.297 -0.030 -17.081 1.000 1 A 93.270 1 ATOM 1083 C C . LYS 67 67 ? A 12.732 1.096 -17.955 1.000 1 A 93.270 1 ATOM 1084 O O . LYS 67 67 ? A 11.748 0.894 -18.660 1.000 1 A 93.270 1 ATOM 1085 C CB . LYS 67 67 ? A 12.709 0.007 -15.663 1.000 1 A 93.270 1 ATOM 1086 C CG . LYS 67 67 ? A 11.190 -0.186 -15.755 1.000 1 A 93.270 1 ATOM 1087 C CD . LYS 67 67 ? A 10.510 -0.383 -14.407 1.000 1 A 93.270 1 ATOM 1088 C CE . LYS 67 67 ? A 8.994 -0.404 -14.684 1.000 1 A 93.270 1 ATOM 1089 N NZ . LYS 67 67 ? A 8.157 -0.917 -13.577 1.000 1 A 93.270 1 ATOM 1090 H H . LYS 67 67 ? A 15.205 0.148 -16.116 1.000 1 A 93.270 1 ATOM 1091 H HA . LYS 67 67 ? A 13.006 -0.964 -17.561 1.000 1 A 93.270 1 ATOM 1092 H HB2 . LYS 67 67 ? A 13.139 -0.797 -15.065 1.000 1 A 93.270 1 ATOM 1093 H HB3 . LYS 67 67 ? A 12.931 0.961 -15.185 1.000 1 A 93.270 1 ATOM 1094 H HG2 . LYS 67 67 ? A 10.978 -1.055 -16.377 1.000 1 A 93.270 1 ATOM 1095 H HG3 . LYS 67 67 ? A 10.752 0.694 -16.226 1.000 1 A 93.270 1 ATOM 1096 H HD2 . LYS 67 67 ? A 10.838 -1.321 -13.958 1.000 1 A 93.270 1 ATOM 1097 H HD3 . LYS 67 67 ? A 10.775 0.461 -13.771 1.000 1 A 93.270 1 ATOM 1098 H HE2 . LYS 67 67 ? A 8.811 -1.014 -15.569 1.000 1 A 93.270 1 ATOM 1099 H HE3 . LYS 67 67 ? A 8.682 0.612 -14.927 1.000 1 A 93.270 1 ATOM 1100 H HZ1 . LYS 67 67 ? A 8.290 -1.908 -13.437 1.000 1 A 93.270 1 ATOM 1101 H HZ2 . LYS 67 67 ? A 7.182 -0.728 -13.760 1.000 1 A 93.270 1 ATOM 1102 H HZ3 . LYS 67 67 ? A 8.396 -0.434 -12.723 1.000 1 A 93.270 1 ATOM 1103 N N . GLU 68 68 ? A 13.369 2.262 -17.940 1.000 1 A 93.060 1 ATOM 1104 C CA . GLU 68 68 ? A 12.990 3.422 -18.757 1.000 1 A 93.060 1 ATOM 1105 C C . GLU 68 68 ? A 13.485 3.352 -20.211 1.000 1 A 93.060 1 ATOM 1106 O O . GLU 68 68 ? A 13.268 4.286 -20.979 1.000 1 A 93.060 1 ATOM 1107 C CB . GLU 68 68 ? A 13.479 4.702 -18.067 1.000 1 A 93.060 1 ATOM 1108 C CG . GLU 68 68 ? A 12.725 4.919 -16.752 1.000 1 A 93.060 1 ATOM 1109 C CD . GLU 68 68 ? A 13.112 6.216 -16.048 1.000 1 A 93.060 1 ATOM 1110 O OE1 . GLU 68 68 ? A 12.368 6.563 -15.104 1.000 1 A 93.060 1 ATOM 1111 O OE2 . GLU 68 68 ? A 14.110 6.877 -16.423 1.000 1 A 93.060 1 ATOM 1112 H H . GLU 68 68 ? A 14.116 2.381 -17.271 1.000 1 A 93.060 1 ATOM 1113 H HA . GLU 68 68 ? A 11.903 3.469 -18.817 1.000 1 A 93.060 1 ATOM 1114 H HB2 . GLU 68 68 ? A 13.295 5.558 -18.715 1.000 1 A 93.060 1 ATOM 1115 H HB3 . GLU 68 68 ? A 14.550 4.629 -17.878 1.000 1 A 93.060 1 ATOM 1116 H HG2 . GLU 68 68 ? A 11.657 4.940 -16.970 1.000 1 A 93.060 1 ATOM 1117 H HG3 . GLU 68 68 ? A 12.903 4.086 -16.072 1.000 1 A 93.060 1 ATOM 1118 N N . ASN 69 69 ? A 14.140 2.255 -20.611 1.000 1 A 94.320 1 ATOM 1119 C CA . ASN 69 69 ? A 14.774 2.088 -21.921 1.000 1 A 94.320 1 ATOM 1120 C C . ASN 69 69 ? A 15.781 3.216 -22.254 1.000 1 A 94.320 1 ATOM 1121 O O . ASN 69 69 ? A 15.947 3.596 -23.414 1.000 1 A 94.320 1 ATOM 1122 C CB . ASN 69 69 ? A 13.712 1.871 -23.022 1.000 1 A 94.320 1 ATOM 1123 C CG . ASN 69 69 ? A 12.637 0.844 -22.695 1.000 1 A 94.320 1 ATOM 1124 O OD1 . ASN 69 69 ? A 12.861 -0.349 -22.564 1.000 1 A 94.320 1 ATOM 1125 N ND2 . ASN 69 69 ? A 11.400 1.266 -22.605 1.000 1 A 94.320 1 ATOM 1126 H H . ASN 69 69 ? A 14.255 1.505 -19.945 1.000 1 A 94.320 1 ATOM 1127 H HA . ASN 69 69 ? A 15.363 1.173 -21.858 1.000 1 A 94.320 1 ATOM 1128 H HB2 . ASN 69 69 ? A 14.212 1.548 -23.935 1.000 1 A 94.320 1 ATOM 1129 H HB3 . ASN 69 69 ? A 13.234 2.828 -23.234 1.000 1 A 94.320 1 ATOM 1130 H HD21 . ASN 69 69 ? A 10.717 0.595 -22.283 1.000 1 A 94.320 1 ATOM 1131 H HD22 . ASN 69 69 ? A 11.216 2.258 -22.632 1.000 1 A 94.320 1 ATOM 1132 N N . ASN 70 70 ? A 16.467 3.773 -21.248 1.000 1 A 94.550 1 ATOM 1133 C CA . ASN 70 70 ? A 17.419 4.867 -21.433 1.000 1 A 94.550 1 ATOM 1134 C C . ASN 70 70 ? A 18.829 4.341 -21.758 1.000 1 A 94.550 1 ATOM 1135 O O . ASN 70 70 ? A 19.710 4.284 -20.898 1.000 1 A 94.550 1 ATOM 1136 C CB . ASN 70 70 ? A 17.365 5.809 -20.219 1.000 1 A 94.550 1 ATOM 1137 C CG . ASN 70 70 ? A 18.138 7.095 -20.464 1.000 1 A 94.550 1 ATOM 1138 O OD1 . ASN 70 70 ? A 19.102 7.161 -21.217 1.000 1 A 94.550 1 ATOM 1139 N ND2 . ASN 70 70 ? A 17.737 8.169 -19.828 1.000 1 A 94.550 1 ATOM 1140 H H . ASN 70 70 ? A 16.317 3.425 -20.312 1.000 1 A 94.550 1 ATOM 1141 H HA . ASN 70 70 ? A 17.097 5.456 -22.292 1.000 1 A 94.550 1 ATOM 1142 H HB2 . ASN 70 70 ? A 16.323 6.062 -20.019 1.000 1 A 94.550 1 ATOM 1143 H HB3 . ASN 70 70 ? A 17.769 5.312 -19.337 1.000 1 A 94.550 1 ATOM 1144 H HD21 . ASN 70 70 ? A 16.957 8.117 -19.189 1.000 1 A 94.550 1 ATOM 1145 H HD22 . ASN 70 70 ? A 18.250 9.023 -19.996 1.000 1 A 94.550 1 ATOM 1146 N N . TYR 71 71 ? A 19.056 3.976 -23.023 1.000 1 A 95.340 1 ATOM 1147 C CA . TYR 71 71 ? A 20.325 3.425 -23.529 1.000 1 A 95.340 1 ATOM 1148 C C . TYR 71 71 ? A 21.563 4.248 -23.149 1.000 1 A 95.340 1 ATOM 1149 O O . TYR 71 71 ? A 22.612 3.687 -22.822 1.000 1 A 95.340 1 ATOM 1150 C CB . TYR 71 71 ? A 20.247 3.314 -25.058 1.000 1 A 95.340 1 ATOM 1151 C CG . TYR 71 71 ? A 19.207 2.327 -25.543 1.000 1 A 95.340 1 ATOM 1152 C CD1 . TYR 71 71 ? A 19.571 0.989 -25.784 1.000 1 A 95.340 1 ATOM 1153 C CD2 . TYR 71 71 ? A 17.875 2.738 -25.743 1.000 1 A 95.340 1 ATOM 1154 C CE1 . TYR 71 71 ? A 18.605 0.056 -26.202 1.000 1 A 95.340 1 ATOM 1155 C CE2 . TYR 71 71 ? A 16.906 1.809 -26.159 1.000 1 A 95.340 1 ATOM 1156 C CZ . TYR 71 71 ? A 17.271 0.466 -26.390 1.000 1 A 95.340 1 ATOM 1157 O OH . TYR 71 71 ? A 16.335 -0.428 -26.798 1.000 1 A 95.340 1 ATOM 1158 H H . TYR 71 71 ? A 18.254 3.947 -23.637 1.000 1 A 95.340 1 ATOM 1159 H HA . TYR 71 71 ? A 20.468 2.421 -23.129 1.000 1 A 95.340 1 ATOM 1160 H HB2 . TYR 71 71 ? A 20.035 4.294 -25.484 1.000 1 A 95.340 1 ATOM 1161 H HB3 . TYR 71 71 ? A 21.220 2.998 -25.435 1.000 1 A 95.340 1 ATOM 1162 H HD1 . TYR 71 71 ? A 20.600 0.678 -25.673 1.000 1 A 95.340 1 ATOM 1163 H HD2 . TYR 71 71 ? A 17.584 3.764 -25.571 1.000 1 A 95.340 1 ATOM 1164 H HE1 . TYR 71 71 ? A 18.875 -0.970 -26.404 1.000 1 A 95.340 1 ATOM 1165 H HE2 . TYR 71 71 ? A 15.883 2.127 -26.296 1.000 1 A 95.340 1 ATOM 1166 H HH . TYR 71 71 ? A 15.482 -0.007 -26.927 1.000 1 A 95.340 1 ATOM 1167 N N . GLN 72 72 ? A 21.443 5.579 -23.160 1.000 1 A 93.560 1 ATOM 1168 C CA . GLN 72 72 ? A 22.547 6.475 -22.830 1.000 1 A 93.560 1 ATOM 1169 C C . GLN 72 72 ? A 22.978 6.320 -21.366 1.000 1 A 93.560 1 ATOM 1170 O O . GLN 72 72 ? A 24.175 6.186 -21.097 1.000 1 A 93.560 1 ATOM 1171 C CB . GLN 72 72 ? A 22.127 7.915 -23.152 1.000 1 A 93.560 1 ATOM 1172 C CG . GLN 72 72 ? A 23.288 8.907 -22.989 1.000 1 A 93.560 1 ATOM 1173 C CD . GLN 72 72 ? A 22.888 10.326 -23.378 1.000 1 A 93.560 1 ATOM 1174 O OE1 . GLN 72 72 ? A 21.745 10.729 -23.334 1.000 1 A 93.560 1 ATOM 1175 N NE2 . GLN 72 72 ? A 23.816 11.155 -23.799 1.000 1 A 93.560 1 ATOM 1176 H H . GLN 72 72 ? A 20.535 5.979 -23.344 1.000 1 A 93.560 1 ATOM 1177 H HA . GLN 72 72 ? A 23.400 6.213 -23.455 1.000 1 A 93.560 1 ATOM 1178 H HB2 . GLN 72 72 ? A 21.778 7.957 -24.183 1.000 1 A 93.560 1 ATOM 1179 H HB3 . GLN 72 72 ? A 21.306 8.209 -22.498 1.000 1 A 93.560 1 ATOM 1180 H HG2 . GLN 72 72 ? A 23.621 8.924 -21.951 1.000 1 A 93.560 1 ATOM 1181 H HG3 . GLN 72 72 ? A 24.119 8.586 -23.617 1.000 1 A 93.560 1 ATOM 1182 H HE21 . GLN 72 72 ? A 24.753 10.835 -23.999 1.000 1 A 93.560 1 ATOM 1183 H HE22 . GLN 72 72 ? A 23.461 12.061 -24.070 1.000 1 A 93.560 1 ATOM 1184 N N . LEU 73 73 ? A 22.021 6.295 -20.433 1.000 1 A 95.140 1 ATOM 1185 C CA . LEU 73 73 ? A 22.301 6.109 -19.008 1.000 1 A 95.140 1 ATOM 1186 C C . LEU 73 73 ? A 22.712 4.672 -18.675 1.000 1 A 95.140 1 ATOM 1187 O O . LEU 73 73 ? A 23.623 4.483 -17.872 1.000 1 A 95.140 1 ATOM 1188 C CB . LEU 73 73 ? A 21.090 6.542 -18.168 1.000 1 A 95.140 1 ATOM 1189 C CG . LEU 73 73 ? A 20.769 8.045 -18.208 1.000 1 A 95.140 1 ATOM 1190 C CD1 . LEU 73 73 ? A 19.649 8.340 -17.211 1.000 1 A 95.140 1 ATOM 1191 C CD2 . LEU 73 73 ? A 21.962 8.930 -17.848 1.000 1 A 95.140 1 ATOM 1192 H H . LEU 73 73 ? A 21.058 6.387 -20.726 1.000 1 A 95.140 1 ATOM 1193 H HA . LEU 73 73 ? A 23.152 6.731 -18.733 1.000 1 A 95.140 1 ATOM 1194 H HB2 . LEU 73 73 ? A 20.213 5.991 -18.505 1.000 1 A 95.140 1 ATOM 1195 H HB3 . LEU 73 73 ? A 21.283 6.265 -17.131 1.000 1 A 95.140 1 ATOM 1196 H HG . LEU 73 73 ? A 20.438 8.320 -19.210 1.000 1 A 95.140 1 ATOM 1197 H HD11 . LEU 73 73 ? A 18.796 7.685 -17.388 1.000 1 A 95.140 1 ATOM 1198 H HD12 . LEU 73 73 ? A 20.001 8.178 -16.193 1.000 1 A 95.140 1 ATOM 1199 H HD13 . LEU 73 73 ? A 19.327 9.376 -17.317 1.000 1 A 95.140 1 ATOM 1200 H HD21 . LEU 73 73 ? A 22.361 8.647 -16.874 1.000 1 A 95.140 1 ATOM 1201 H HD22 . LEU 73 73 ? A 22.739 8.848 -18.608 1.000 1 A 95.140 1 ATOM 1202 H HD23 . LEU 73 73 ? A 21.640 9.971 -17.836 1.000 1 A 95.140 1 ATOM 1203 N N . ILE 74 74 ? A 22.122 3.667 -19.331 1.000 1 A 96.470 1 ATOM 1204 C CA . ILE 74 74 ? A 22.515 2.255 -19.170 1.000 1 A 96.470 1 ATOM 1205 C C . ILE 74 74 ? A 24.006 2.082 -19.483 1.000 1 A 96.470 1 ATOM 1206 O O . ILE 74 74 ? A 24.755 1.513 -18.683 1.000 1 A 96.470 1 ATOM 1207 C CB . ILE 74 74 ? A 21.659 1.347 -20.082 1.000 1 A 96.470 1 ATOM 1208 C CG1 . ILE 74 74 ? A 20.173 1.350 -19.665 1.000 1 A 96.470 1 ATOM 1209 C CG2 . ILE 74 74 ? A 22.168 -0.108 -20.089 1.000 1 A 96.470 1 ATOM 1210 C CD1 . ILE 74 74 ? A 19.263 0.762 -20.754 1.000 1 A 96.470 1 ATOM 1211 H H . ILE 74 74 ? A 21.357 3.889 -19.951 1.000 1 A 96.470 1 ATOM 1212 H HA . ILE 74 74 ? A 22.360 1.959 -18.133 1.000 1 A 96.470 1 ATOM 1213 H HB . ILE 74 74 ? A 21.732 1.739 -21.096 1.000 1 A 96.470 1 ATOM 1214 H HG12 . ILE 74 74 ? A 20.049 0.783 -18.742 1.000 1 A 96.470 1 ATOM 1215 H HG13 . ILE 74 74 ? A 19.840 2.365 -19.449 1.000 1 A 96.470 1 ATOM 1216 H HG21 . ILE 74 74 ? A 21.569 -0.717 -20.766 1.000 1 A 96.470 1 ATOM 1217 H HG22 . ILE 74 74 ? A 23.201 -0.164 -20.434 1.000 1 A 96.470 1 ATOM 1218 H HG23 . ILE 74 74 ? A 22.101 -0.536 -19.088 1.000 1 A 96.470 1 ATOM 1219 H HD11 . ILE 74 74 ? A 19.603 1.061 -21.745 1.000 1 A 96.470 1 ATOM 1220 H HD12 . ILE 74 74 ? A 18.246 1.134 -20.628 1.000 1 A 96.470 1 ATOM 1221 H HD13 . ILE 74 74 ? A 19.264 -0.326 -20.695 1.000 1 A 96.470 1 ATOM 1222 N N . LYS 75 75 ? A 24.457 2.615 -20.626 1.000 1 A 95.560 1 ATOM 1223 C CA . LYS 75 75 ? A 25.868 2.571 -21.018 1.000 1 A 95.560 1 ATOM 1224 C C . LYS 75 75 ? A 26.743 3.338 -20.029 1.000 1 A 95.560 1 ATOM 1225 O O . LYS 75 75 ? A 27.744 2.801 -19.564 1.000 1 A 95.560 1 ATOM 1226 C CB . LYS 75 75 ? A 26.007 3.101 -22.449 1.000 1 A 95.560 1 ATOM 1227 C CG . LYS 75 75 ? A 27.449 2.967 -22.955 1.000 1 A 95.560 1 ATOM 1228 C CD . LYS 75 75 ? A 27.554 3.368 -24.428 1.000 1 A 95.560 1 ATOM 1229 C CE . LYS 75 75 ? A 29.010 3.216 -24.874 1.000 1 A 95.560 1 ATOM 1230 N NZ . LYS 75 75 ? A 29.168 3.491 -26.322 1.000 1 A 95.560 1 ATOM 1231 H H . LYS 75 75 ? A 23.790 3.058 -21.242 1.000 1 A 95.560 1 ATOM 1232 H HA . LYS 75 75 ? A 26.203 1.534 -20.993 1.000 1 A 95.560 1 ATOM 1233 H HB2 . LYS 75 75 ? A 25.698 4.146 -22.487 1.000 1 A 95.560 1 ATOM 1234 H HB3 . LYS 75 75 ? A 25.347 2.522 -23.096 1.000 1 A 95.560 1 ATOM 1235 H HG2 . LYS 75 75 ? A 27.774 1.933 -22.842 1.000 1 A 95.560 1 ATOM 1236 H HG3 . LYS 75 75 ? A 28.103 3.609 -22.366 1.000 1 A 95.560 1 ATOM 1237 H HD2 . LYS 75 75 ? A 27.232 4.402 -24.547 1.000 1 A 95.560 1 ATOM 1238 H HD3 . LYS 75 75 ? A 26.913 2.715 -25.021 1.000 1 A 95.560 1 ATOM 1239 H HE2 . LYS 75 75 ? A 29.632 3.885 -24.280 1.000 1 A 95.560 1 ATOM 1240 H HE3 . LYS 75 75 ? A 29.336 2.201 -24.646 1.000 1 A 95.560 1 ATOM 1241 H HZ1 . LYS 75 75 ? A 28.880 4.434 -26.538 1.000 1 A 95.560 1 ATOM 1242 H HZ2 . LYS 75 75 ? A 30.137 3.373 -26.584 1.000 1 A 95.560 1 ATOM 1243 H HZ3 . LYS 75 75 ? A 28.612 2.842 -26.860 1.000 1 A 95.560 1 ATOM 1244 N N . LEU 76 76 ? A 26.342 4.560 -19.670 1.000 1 A 94.050 1 ATOM 1245 C CA . LEU 76 76 ? A 27.090 5.413 -18.746 1.000 1 A 94.050 1 ATOM 1246 C C . LEU 76 76 ? A 27.311 4.741 -17.383 1.000 1 A 94.050 1 ATOM 1247 O O . LEU 76 76 ? A 28.442 4.667 -16.908 1.000 1 A 94.050 1 ATOM 1248 C CB . LEU 76 76 ? A 26.327 6.738 -18.583 1.000 1 A 94.050 1 ATOM 1249 C CG . LEU 76 76 ? A 27.027 7.748 -17.658 1.000 1 A 94.050 1 ATOM 1250 C CD1 . LEU 76 76 ? A 28.317 8.279 -18.292 1.000 1 A 94.050 1 ATOM 1251 C CD2 . LEU 76 76 ? A 26.089 8.920 -17.384 1.000 1 A 94.050 1 ATOM 1252 H H . LEU 76 76 ? A 25.493 4.923 -20.078 1.000 1 A 94.050 1 ATOM 1253 H HA . LEU 76 76 ? A 28.071 5.607 -19.178 1.000 1 A 94.050 1 ATOM 1254 H HB2 . LEU 76 76 ? A 25.344 6.518 -18.166 1.000 1 A 94.050 1 ATOM 1255 H HB3 . LEU 76 76 ? A 26.180 7.194 -19.563 1.000 1 A 94.050 1 ATOM 1256 H HG . LEU 76 76 ? A 27.262 7.284 -16.701 1.000 1 A 94.050 1 ATOM 1257 H HD11 . LEU 76 76 ? A 28.109 8.654 -19.294 1.000 1 A 94.050 1 ATOM 1258 H HD12 . LEU 76 76 ? A 28.721 9.081 -17.675 1.000 1 A 94.050 1 ATOM 1259 H HD13 . LEU 76 76 ? A 29.053 7.477 -18.344 1.000 1 A 94.050 1 ATOM 1260 H HD21 . LEU 76 76 ? A 25.157 8.551 -16.957 1.000 1 A 94.050 1 ATOM 1261 H HD22 . LEU 76 76 ? A 25.868 9.467 -18.300 1.000 1 A 94.050 1 ATOM 1262 H HD23 . LEU 76 76 ? A 26.552 9.582 -16.652 1.000 1 A 94.050 1 ATOM 1263 N N . PHE 77 77 ? A 26.250 4.232 -16.754 1.000 1 A 95.070 1 ATOM 1264 C CA . PHE 77 77 ? A 26.346 3.607 -15.435 1.000 1 A 95.070 1 ATOM 1265 C C . PHE 77 77 ? A 27.155 2.309 -15.476 1.000 1 A 95.070 1 ATOM 1266 O O . PHE 77 77 ? A 27.951 2.059 -14.570 1.000 1 A 95.070 1 ATOM 1267 C CB . PHE 77 77 ? A 24.939 3.400 -14.856 1.000 1 A 95.070 1 ATOM 1268 C CG . PHE 77 77 ? A 24.127 4.666 -14.609 1.000 1 A 95.070 1 ATOM 1269 C CD1 . PHE 77 77 ? A 24.746 5.895 -14.290 1.000 1 A 95.070 1 ATOM 1270 C CD2 . PHE 77 77 ? A 22.722 4.608 -14.675 1.000 1 A 95.070 1 ATOM 1271 C CE1 . PHE 77 77 ? A 23.971 7.042 -14.053 1.000 1 A 95.070 1 ATOM 1272 C CE2 . PHE 77 77 ? A 21.945 5.751 -14.418 1.000 1 A 95.070 1 ATOM 1273 C CZ . PHE 77 77 ? A 22.570 6.970 -14.111 1.000 1 A 95.070 1 ATOM 1274 H H . PHE 77 77 ? A 25.338 4.320 -17.178 1.000 1 A 95.070 1 ATOM 1275 H HA . PHE 77 77 ? A 26.898 4.274 -14.772 1.000 1 A 95.070 1 ATOM 1276 H HB2 . PHE 77 77 ? A 25.030 2.878 -13.903 1.000 1 A 95.070 1 ATOM 1277 H HB3 . PHE 77 77 ? A 24.382 2.751 -15.533 1.000 1 A 95.070 1 ATOM 1278 H HD1 . PHE 77 77 ? A 25.821 5.979 -14.229 1.000 1 A 95.070 1 ATOM 1279 H HD2 . PHE 77 77 ? A 22.231 3.681 -14.931 1.000 1 A 95.070 1 ATOM 1280 H HE1 . PHE 77 77 ? A 24.453 7.981 -13.824 1.000 1 A 95.070 1 ATOM 1281 H HE2 . PHE 77 77 ? A 20.868 5.695 -14.463 1.000 1 A 95.070 1 ATOM 1282 H HZ . PHE 77 77 ? A 21.970 7.849 -13.926 1.000 1 A 95.070 1 ATOM 1283 N N . THR 78 78 ? A 27.040 1.535 -16.558 1.000 1 A 95.040 1 ATOM 1284 C CA . THR 78 78 ? A 27.863 0.336 -16.779 1.000 1 A 95.040 1 ATOM 1285 C C . THR 78 78 ? A 29.349 0.686 -16.886 1.000 1 A 95.040 1 ATOM 1286 O O . THR 78 78 ? A 30.178 0.088 -16.203 1.000 1 A 95.040 1 ATOM 1287 C CB . THR 78 78 ? A 27.399 -0.414 -18.032 1.000 1 A 95.040 1 ATOM 1288 O OG1 . THR 78 78 ? A 26.042 -0.752 -17.891 1.000 1 A 95.040 1 ATOM 1289 C CG2 . THR 78 78 ? A 28.160 -1.721 -18.233 1.000 1 A 95.040 1 ATOM 1290 H H . THR 78 78 ? A 26.368 1.794 -17.266 1.000 1 A 95.040 1 ATOM 1291 H HA . THR 78 78 ? A 27.748 -0.337 -15.929 1.000 1 A 95.040 1 ATOM 1292 H HB . THR 78 78 ? A 27.516 0.216 -18.914 1.000 1 A 95.040 1 ATOM 1293 H HG1 . THR 78 78 ? A 25.519 -0.002 -18.187 1.000 1 A 95.040 1 ATOM 1294 H HG21 . THR 78 78 ? A 27.673 -2.308 -19.012 1.000 1 A 95.040 1 ATOM 1295 H HG22 . THR 78 78 ? A 29.187 -1.518 -18.536 1.000 1 A 95.040 1 ATOM 1296 H HG23 . THR 78 78 ? A 28.159 -2.292 -17.304 1.000 1 A 95.040 1 ATOM 1297 N N . GLU 79 79 ? A 29.704 1.712 -17.664 1.000 1 A 93.100 1 ATOM 1298 C CA . GLU 79 79 ? A 31.086 2.204 -17.757 1.000 1 A 93.100 1 ATOM 1299 C C . GLU 79 79 ? A 31.598 2.784 -16.425 1.000 1 A 93.100 1 ATOM 1300 O O . GLU 79 79 ? A 32.797 2.746 -16.140 1.000 1 A 93.100 1 ATOM 1301 C CB . GLU 79 79 ? A 31.180 3.288 -18.837 1.000 1 A 93.100 1 ATOM 1302 C CG . GLU 79 79 ? A 30.999 2.806 -20.288 1.000 1 A 93.100 1 ATOM 1303 C CD . GLU 79 79 ? A 30.941 3.975 -21.291 1.000 1 A 93.100 1 ATOM 1304 O OE1 . GLU 79 79 ? A 31.120 3.739 -22.510 1.000 1 A 93.100 1 ATOM 1305 O OE2 . GLU 79 79 ? A 30.766 5.139 -20.857 1.000 1 A 93.100 1 ATOM 1306 H H . GLU 79 79 ? A 28.995 2.179 -18.211 1.000 1 A 93.100 1 ATOM 1307 H HA . GLU 79 79 ? A 31.746 1.380 -18.026 1.000 1 A 93.100 1 ATOM 1308 H HB2 . GLU 79 79 ? A 32.173 3.733 -18.769 1.000 1 A 93.100 1 ATOM 1309 H HB3 . GLU 79 79 ? A 30.436 4.051 -18.609 1.000 1 A 93.100 1 ATOM 1310 H HG2 . GLU 79 79 ? A 30.085 2.217 -20.375 1.000 1 A 93.100 1 ATOM 1311 H HG3 . GLU 79 79 ? A 31.836 2.154 -20.540 1.000 1 A 93.100 1 ATOM 1312 N N . TRP 80 80 ? A 30.703 3.297 -15.575 1.000 1 A 91.590 1 ATOM 1313 C CA . TRP 80 80 ? A 31.045 3.770 -14.232 1.000 1 A 91.590 1 ATOM 1314 C C . TRP 80 80 ? A 31.255 2.656 -13.204 1.000 1 A 91.590 1 ATOM 1315 O O . TRP 80 80 ? A 31.772 2.962 -12.120 1.000 1 A 91.590 1 ATOM 1316 C CB . TRP 80 80 ? A 30.006 4.787 -13.757 1.000 1 A 91.590 1 ATOM 1317 C CG . TRP 80 80 ? A 30.083 6.134 -14.402 1.000 1 A 91.590 1 ATOM 1318 C CD1 . TRP 80 80 ? A 30.926 6.515 -15.392 1.000 1 A 91.590 1 ATOM 1319 C CD2 . TRP 80 80 ? A 29.237 7.290 -14.138 1.000 1 A 91.590 1 ATOM 1320 N NE1 . TRP 80 80 ? A 30.702 7.835 -15.716 1.000 1 A 91.590 1 ATOM 1321 C CE2 . TRP 80 80 ? A 29.672 8.364 -14.970 1.000 1 A 91.590 1 ATOM 1322 C CE3 . TRP 80 80 ? A 28.139 7.534 -13.284 1.000 1 A 91.590 1 ATOM 1323 C CZ2 . TRP 80 80 ? A 29.068 9.627 -14.935 1.000 1 A 91.590 1 ATOM 1324 C CZ3 . TRP 80 80 ? A 27.515 8.795 -13.261 1.000 1 A 91.590 1 ATOM 1325 C CH2 . TRP 80 80 ? A 27.978 9.838 -14.077 1.000 1 A 91.590 1 ATOM 1326 H H . TRP 80 80 ? A 29.750 3.396 -15.895 1.000 1 A 91.590 1 ATOM 1327 H HA . TRP 80 80 ? A 32.005 4.282 -14.296 1.000 1 A 91.590 1 ATOM 1328 H HB2 . TRP 80 80 ? A 29.006 4.381 -13.911 1.000 1 A 91.590 1 ATOM 1329 H HB3 . TRP 80 80 ? A 30.127 4.943 -12.685 1.000 1 A 91.590 1 ATOM 1330 H HD1 . TRP 80 80 ? A 31.639 5.877 -15.894 1.000 1 A 91.590 1 ATOM 1331 H HE1 . TRP 80 80 ? A 31.195 8.301 -16.464 1.000 1 A 91.590 1 ATOM 1332 H HE3 . TRP 80 80 ? A 27.771 6.739 -12.652 1.000 1 A 91.590 1 ATOM 1333 H HZ2 . TRP 80 80 ? A 29.425 10.423 -15.571 1.000 1 A 91.590 1 ATOM 1334 H HZ3 . TRP 80 80 ? A 26.671 8.977 -12.613 1.000 1 A 91.590 1 ATOM 1335 H HH2 . TRP 80 80 ? A 27.486 10.799 -14.045 1.000 1 A 91.590 1 ATOM 1336 N N . GLY 81 81 ? A 30.935 1.407 -13.554 1.000 1 A 91.180 1 ATOM 1337 C CA . GLY 81 81 ? A 31.156 0.213 -12.739 1.000 1 A 91.180 1 ATOM 1338 C C . GLY 81 81 ? A 29.885 -0.490 -12.259 1.000 1 A 91.180 1 ATOM 1339 O O . GLY 81 81 ? A 29.993 -1.363 -11.400 1.000 1 A 91.180 1 ATOM 1340 H H . GLY 81 81 ? A 30.552 1.263 -14.478 1.000 1 A 91.180 1 ATOM 1341 H HA2 . GLY 81 81 ? A 31.751 0.463 -11.861 1.000 1 A 91.180 1 ATOM 1342 H HA3 . GLY 81 81 ? A 31.715 -0.506 -13.337 1.000 1 A 91.180 1 ATOM 1343 N N . ALA 82 82 ? A 28.699 -0.125 -12.762 1.000 1 A 93.880 1 ATOM 1344 C CA . ALA 82 82 ? A 27.472 -0.862 -12.466 1.000 1 A 93.880 1 ATOM 1345 C C . ALA 82 82 ? A 27.565 -2.286 -13.024 1.000 1 A 93.880 1 ATOM 1346 O O . ALA 82 82 ? A 28.065 -2.503 -14.130 1.000 1 A 93.880 1 ATOM 1347 C CB . ALA 82 82 ? A 26.253 -0.162 -13.076 1.000 1 A 93.880 1 ATOM 1348 H H . ALA 82 82 ? A 28.654 0.599 -13.464 1.000 1 A 93.880 1 ATOM 1349 H HA . ALA 82 82 ? A 27.343 -0.912 -11.385 1.000 1 A 93.880 1 ATOM 1350 H HB1 . ALA 82 82 ? A 26.309 0.919 -12.950 1.000 1 A 93.880 1 ATOM 1351 H HB2 . ALA 82 82 ? A 25.343 -0.538 -12.609 1.000 1 A 93.880 1 ATOM 1352 H HB3 . ALA 82 82 ? A 26.217 -0.360 -14.147 1.000 1 A 93.880 1 ATOM 1353 N N . ASP 83 83 ? A 27.032 -3.260 -12.295 1.000 1 A 93.780 1 ATOM 1354 C CA . ASP 83 83 ? A 26.919 -4.621 -12.801 1.000 1 A 93.780 1 ATOM 1355 C C . ASP 83 83 ? A 25.700 -4.722 -13.725 1.000 1 A 93.780 1 ATOM 1356 O O . ASP 83 83 ? A 24.553 -4.751 -13.273 1.000 1 A 93.780 1 ATOM 1357 C CB . ASP 83 83 ? A 26.920 -5.606 -11.626 1.000 1 A 93.780 1 ATOM 1358 C CG . ASP 83 83 ? A 26.634 -7.059 -12.016 1.000 1 A 93.780 1 ATOM 1359 O OD1 . ASP 83 83 ? A 26.537 -7.408 -13.215 1.000 1 A 93.780 1 ATOM 1360 O OD2 . ASP 83 83 ? A 26.499 -7.898 -11.098 1.000 1 A 93.780 1 ATOM 1361 H H . ASP 83 83 ? A 26.557 -3.016 -11.438 1.000 1 A 93.780 1 ATOM 1362 H HA . ASP 83 83 ? A 27.801 -4.852 -13.397 1.000 1 A 93.780 1 ATOM 1363 H HB2 . ASP 83 83 ? A 27.904 -5.570 -11.158 1.000 1 A 93.780 1 ATOM 1364 H HB3 . ASP 83 83 ? A 26.204 -5.279 -10.872 1.000 1 A 93.780 1 ATOM 1365 N N . ILE 84 84 ? A 25.962 -4.825 -15.030 1.000 1 A 95.530 1 ATOM 1366 C CA . ILE 84 84 ? A 24.946 -4.901 -16.089 1.000 1 A 95.530 1 ATOM 1367 C C . ILE 84 84 ? A 23.923 -6.037 -15.894 1.000 1 A 95.530 1 ATOM 1368 O O . ILE 84 84 ? A 22.799 -5.950 -16.387 1.000 1 A 95.530 1 ATOM 1369 C CB . ILE 84 84 ? A 25.630 -4.929 -17.470 1.000 1 A 95.530 1 ATOM 1370 C CG1 . ILE 84 84 ? A 24.643 -4.769 -18.647 1.000 1 A 95.530 1 ATOM 1371 C CG2 . ILE 84 84 ? A 26.461 -6.209 -17.642 1.000 1 A 95.530 1 ATOM 1372 C CD1 . ILE 84 84 ? A 23.877 -3.442 -18.675 1.000 1 A 95.530 1 ATOM 1373 H H . ILE 84 84 ? A 26.923 -4.707 -15.318 1.000 1 A 95.530 1 ATOM 1374 H HA . ILE 84 84 ? A 24.392 -3.963 -16.055 1.000 1 A 95.530 1 ATOM 1375 H HB . ILE 84 84 ? A 26.318 -4.085 -17.516 1.000 1 A 95.530 1 ATOM 1376 H HG12 . ILE 84 84 ? A 25.206 -4.856 -19.576 1.000 1 A 95.530 1 ATOM 1377 H HG13 . ILE 84 84 ? A 23.905 -5.571 -18.636 1.000 1 A 95.530 1 ATOM 1378 H HG21 . ILE 84 84 ? A 27.248 -6.261 -16.890 1.000 1 A 95.530 1 ATOM 1379 H HG22 . ILE 84 84 ? A 25.820 -7.086 -17.559 1.000 1 A 95.530 1 ATOM 1380 H HG23 . ILE 84 84 ? A 26.935 -6.201 -18.624 1.000 1 A 95.530 1 ATOM 1381 H HD11 . ILE 84 84 ? A 24.581 -2.611 -18.722 1.000 1 A 95.530 1 ATOM 1382 H HD12 . ILE 84 84 ? A 23.249 -3.410 -19.566 1.000 1 A 95.530 1 ATOM 1383 H HD13 . ILE 84 84 ? A 23.237 -3.344 -17.799 1.000 1 A 95.530 1 ATOM 1384 N N . ASN 85 85 ? A 24.242 -7.073 -15.105 1.000 1 A 93.800 1 ATOM 1385 C CA . ASN 85 85 ? A 23.272 -8.114 -14.755 1.000 1 A 93.800 1 ATOM 1386 C C . ASN 85 85 ? A 22.096 -7.577 -13.925 1.000 1 A 93.800 1 ATOM 1387 O O . ASN 85 85 ? A 21.016 -8.154 -13.998 1.000 1 A 93.800 1 ATOM 1388 C CB . ASN 85 85 ? A 23.957 -9.249 -13.985 1.000 1 A 93.800 1 ATOM 1389 C CG . ASN 85 85 ? A 25.000 -9.967 -14.811 1.000 1 A 93.800 1 ATOM 1390 O OD1 . ASN 85 85 ? A 24.703 -10.707 -15.726 1.000 1 A 93.800 1 ATOM 1391 N ND2 . ASN 85 85 ? A 26.260 -9.815 -14.491 1.000 1 A 93.800 1 ATOM 1392 H H . ASN 85 85 ? A 25.138 -7.054 -14.639 1.000 1 A 93.800 1 ATOM 1393 H HA . ASN 85 85 ? A 22.851 -8.520 -15.675 1.000 1 A 93.800 1 ATOM 1394 H HB2 . ASN 85 85 ? A 24.403 -8.840 -13.078 1.000 1 A 93.800 1 ATOM 1395 H HB3 . ASN 85 85 ? A 23.201 -9.981 -13.702 1.000 1 A 93.800 1 ATOM 1396 H HD21 . ASN 85 85 ? A 26.477 -8.997 -13.939 1.000 1 A 93.800 1 ATOM 1397 H HD22 . ASN 85 85 ? A 26.916 -10.089 -15.207 1.000 1 A 93.800 1 ATOM 1398 N N . TYR 86 86 ? A 22.282 -6.500 -13.151 1.000 1 A 93.380 1 ATOM 1399 C CA . TYR 86 86 ? A 21.168 -5.807 -12.501 1.000 1 A 93.380 1 ATOM 1400 C C . TYR 86 86 ? A 20.311 -5.073 -13.529 1.000 1 A 93.380 1 ATOM 1401 O O . TYR 86 86 ? A 19.095 -5.179 -13.471 1.000 1 A 93.380 1 ATOM 1402 C CB . TYR 86 86 ? A 21.657 -4.847 -11.410 1.000 1 A 93.380 1 ATOM 1403 C CG . TYR 86 86 ? A 22.086 -5.536 -10.134 1.000 1 A 93.380 1 ATOM 1404 C CD1 . TYR 86 86 ? A 21.133 -5.880 -9.157 1.000 1 A 93.380 1 ATOM 1405 C CD2 . TYR 86 86 ? A 23.443 -5.823 -9.920 1.000 1 A 93.380 1 ATOM 1406 C CE1 . TYR 86 86 ? A 21.541 -6.514 -7.968 1.000 1 A 93.380 1 ATOM 1407 C CE2 . TYR 86 86 ? A 23.863 -6.435 -8.724 1.000 1 A 93.380 1 ATOM 1408 C CZ . TYR 86 86 ? A 22.906 -6.780 -7.744 1.000 1 A 93.380 1 ATOM 1409 O OH . TYR 86 86 ? A 23.294 -7.378 -6.588 1.000 1 A 93.380 1 ATOM 1410 H H . TYR 86 86 ? A 23.183 -6.043 -13.152 1.000 1 A 93.380 1 ATOM 1411 H HA . TYR 86 86 ? A 20.523 -6.546 -12.028 1.000 1 A 93.380 1 ATOM 1412 H HB2 . TYR 86 86 ? A 20.840 -4.174 -11.149 1.000 1 A 93.380 1 ATOM 1413 H HB3 . TYR 86 86 ? A 22.466 -4.224 -11.793 1.000 1 A 93.380 1 ATOM 1414 H HD1 . TYR 86 86 ? A 20.090 -5.642 -9.311 1.000 1 A 93.380 1 ATOM 1415 H HD2 . TYR 86 86 ? A 24.154 -5.546 -10.683 1.000 1 A 93.380 1 ATOM 1416 H HE1 . TYR 86 86 ? A 20.818 -6.781 -7.211 1.000 1 A 93.380 1 ATOM 1417 H HE2 . TYR 86 86 ? A 24.913 -6.632 -8.565 1.000 1 A 93.380 1 ATOM 1418 H HH . TYR 86 86 ? A 24.248 -7.379 -6.484 1.000 1 A 93.380 1 ATOM 1419 N N . GLY 87 87 ? A 20.914 -4.421 -14.528 1.000 1 A 94.390 1 ATOM 1420 C CA . GLY 87 87 ? A 20.167 -3.842 -15.650 1.000 1 A 94.390 1 ATOM 1421 C C . GLY 87 87 ? A 19.274 -4.884 -16.327 1.000 1 A 94.390 1 ATOM 1422 O O . GLY 87 87 ? A 18.066 -4.686 -16.434 1.000 1 A 94.390 1 ATOM 1423 H H . GLY 87 87 ? A 21.924 -4.400 -14.555 1.000 1 A 94.390 1 ATOM 1424 H HA2 . GLY 87 87 ? A 19.540 -3.026 -15.292 1.000 1 A 94.390 1 ATOM 1425 H HA3 . GLY 87 87 ? A 20.863 -3.451 -16.392 1.000 1 A 94.390 1 ATOM 1426 N N . LEU 88 88 ? A 19.835 -6.057 -16.649 1.000 1 A 93.380 1 ATOM 1427 C CA . LEU 88 88 ? A 19.094 -7.157 -17.273 1.000 1 A 93.380 1 ATOM 1428 C C . LEU 88 88 ? A 17.863 -7.610 -16.462 1.000 1 A 93.380 1 ATOM 1429 O O . LEU 88 88 ? A 16.873 -8.013 -17.070 1.000 1 A 93.380 1 ATOM 1430 C CB . LEU 88 88 ? A 20.056 -8.333 -17.530 1.000 1 A 93.380 1 ATOM 1431 C CG . LEU 88 88 ? A 19.420 -9.505 -18.309 1.000 1 A 93.380 1 ATOM 1432 C CD1 . LEU 88 88 ? A 19.052 -9.131 -19.745 1.000 1 A 93.380 1 ATOM 1433 C CD2 . LEU 88 88 ? A 20.391 -10.678 -18.373 1.000 1 A 93.380 1 ATOM 1434 H H . LEU 88 88 ? A 20.835 -6.143 -16.543 1.000 1 A 93.380 1 ATOM 1435 H HA . LEU 88 88 ? A 18.727 -6.789 -18.231 1.000 1 A 93.380 1 ATOM 1436 H HB2 . LEU 88 88 ? A 20.918 -7.969 -18.089 1.000 1 A 93.380 1 ATOM 1437 H HB3 . LEU 88 88 ? A 20.408 -8.705 -16.568 1.000 1 A 93.380 1 ATOM 1438 H HG . LEU 88 88 ? A 18.526 -9.854 -17.792 1.000 1 A 93.380 1 ATOM 1439 H HD11 . LEU 88 88 ? A 18.633 -9.996 -20.260 1.000 1 A 93.380 1 ATOM 1440 H HD12 . LEU 88 88 ? A 18.303 -8.339 -19.743 1.000 1 A 93.380 1 ATOM 1441 H HD13 . LEU 88 88 ? A 19.933 -8.788 -20.288 1.000 1 A 93.380 1 ATOM 1442 H HD21 . LEU 88 88 ? A 20.716 -10.955 -17.370 1.000 1 A 93.380 1 ATOM 1443 H HD22 . LEU 88 88 ? A 21.262 -10.406 -18.969 1.000 1 A 93.380 1 ATOM 1444 H HD23 . LEU 88 88 ? A 19.902 -11.537 -18.832 1.000 1 A 93.380 1 ATOM 1445 N N . ILE 89 89 ? A 17.878 -7.507 -15.122 1.000 1 A 92.400 1 ATOM 1446 C CA . ILE 89 89 ? A 16.700 -7.798 -14.278 1.000 1 A 92.400 1 ATOM 1447 C C . ILE 89 89 ? A 15.498 -6.959 -14.727 1.000 1 A 92.400 1 ATOM 1448 O O . ILE 89 89 ? A 14.389 -7.480 -14.739 1.000 1 A 92.400 1 ATOM 1449 C CB . ILE 89 89 ? A 16.996 -7.570 -12.768 1.000 1 A 92.400 1 ATOM 1450 C CG1 . ILE 89 89 ? A 18.023 -8.598 -12.247 1.000 1 A 92.400 1 ATOM 1451 C CG2 . ILE 89 89 ? A 15.738 -7.650 -11.887 1.000 1 A 92.400 1 ATOM 1452 C CD1 . ILE 89 89 ? A 18.581 -8.312 -10.846 1.000 1 A 92.400 1 ATOM 1453 H H . ILE 89 89 ? A 18.695 -7.106 -14.685 1.000 1 A 92.400 1 ATOM 1454 H HA . ILE 89 89 ? A 16.423 -8.843 -14.421 1.000 1 A 92.400 1 ATOM 1455 H HB . ILE 89 89 ? A 17.394 -6.564 -12.634 1.000 1 A 92.400 1 ATOM 1456 H HG12 . ILE 89 89 ? A 17.550 -9.579 -12.220 1.000 1 A 92.400 1 ATOM 1457 H HG13 . ILE 89 89 ? A 18.864 -8.646 -12.938 1.000 1 A 92.400 1 ATOM 1458 H HG21 . ILE 89 89 ? A 15.298 -8.643 -11.978 1.000 1 A 92.400 1 ATOM 1459 H HG22 . ILE 89 89 ? A 15.009 -6.896 -12.184 1.000 1 A 92.400 1 ATOM 1460 H HG23 . ILE 89 89 ? A 15.985 -7.454 -10.844 1.000 1 A 92.400 1 ATOM 1461 H HD11 . ILE 89 89 ? A 18.886 -7.268 -10.771 1.000 1 A 92.400 1 ATOM 1462 H HD12 . ILE 89 89 ? A 19.443 -8.954 -10.663 1.000 1 A 92.400 1 ATOM 1463 H HD13 . ILE 89 89 ? A 17.829 -8.516 -10.084 1.000 1 A 92.400 1 ATOM 1464 N N . CYS 90 90 ? A 15.716 -5.700 -15.122 1.000 1 A 92.690 1 ATOM 1465 C CA . CYS 90 90 ? A 14.691 -4.718 -15.489 1.000 1 A 92.690 1 ATOM 1466 C C . CYS 90 90 ? A 14.520 -4.496 -17.004 1.000 1 A 92.690 1 ATOM 1467 O O . CYS 90 90 ? A 13.784 -3.600 -17.417 1.000 1 A 92.690 1 ATOM 1468 C CB . CYS 90 90 ? A 14.965 -3.422 -14.720 1.000 1 A 92.690 1 ATOM 1469 S SG . CYS 90 90 ? A 14.593 -3.676 -12.958 1.000 1 A 92.690 1 ATOM 1470 H H . CYS 90 90 ? A 16.675 -5.385 -15.161 1.000 1 A 92.690 1 ATOM 1471 H HA . CYS 90 90 ? A 13.718 -5.080 -15.158 1.000 1 A 92.690 1 ATOM 1472 H HB2 . CYS 90 90 ? A 16.008 -3.132 -14.847 1.000 1 A 92.690 1 ATOM 1473 H HB3 . CYS 90 90 ? A 14.338 -2.620 -15.110 1.000 1 A 92.690 1 ATOM 1474 H HG . CYS 90 90 ? A 13.260 -3.631 -13.040 1.000 1 A 92.690 1 ATOM 1475 N N . ALA 91 91 ? A 15.172 -5.306 -17.840 1.000 1 A 92.090 1 ATOM 1476 C CA . ALA 91 91 ? A 15.093 -5.211 -19.294 1.000 1 A 92.090 1 ATOM 1477 C C . ALA 91 91 ? A 13.803 -5.863 -19.838 1.000 1 A 92.090 1 ATOM 1478 O O . ALA 91 91 ? A 13.777 -7.020 -20.274 1.000 1 A 92.090 1 ATOM 1479 C CB . ALA 91 91 ? A 16.382 -5.800 -19.866 1.000 1 A 92.090 1 ATOM 1480 H H . ALA 91 91 ? A 15.757 -6.028 -17.447 1.000 1 A 92.090 1 ATOM 1481 H HA . ALA 91 91 ? A 15.065 -4.159 -19.578 1.000 1 A 92.090 1 ATOM 1482 H HB1 . ALA 91 91 ? A 17.240 -5.228 -19.515 1.000 1 A 92.090 1 ATOM 1483 H HB2 . ALA 91 91 ? A 16.486 -6.834 -19.536 1.000 1 A 92.090 1 ATOM 1484 H HB3 . ALA 91 91 ? A 16.352 -5.760 -20.955 1.000 1 A 92.090 1 ATOM 1485 N N . ASN 92 92 ? A 12.704 -5.106 -19.811 1.000 1 A 84.530 1 ATOM 1486 C CA . ASN 92 92 ? A 11.372 -5.605 -20.171 1.000 1 A 84.530 1 ATOM 1487 C C . ASN 92 92 ? A 11.169 -5.805 -21.681 1.000 1 A 84.530 1 ATOM 1488 O O . ASN 92 92 ? A 10.408 -6.685 -22.091 1.000 1 A 84.530 1 ATOM 1489 C CB . ASN 92 92 ? A 10.321 -4.652 -19.582 1.000 1 A 84.530 1 ATOM 1490 C CG . ASN 92 92 ? A 10.144 -4.822 -18.084 1.000 1 A 84.530 1 ATOM 1491 O OD1 . ASN 92 92 ? A 10.676 -5.722 -17.465 1.000 1 A 84.530 1 ATOM 1492 N ND2 . ASN 92 92 ? A 9.335 -3.987 -17.480 1.000 1 A 84.530 1 ATOM 1493 H H . ASN 92 92 ? A 12.773 -4.219 -19.332 1.000 1 A 84.530 1 ATOM 1494 H HA . ASN 92 92 ? A 11.233 -6.586 -19.717 1.000 1 A 84.530 1 ATOM 1495 H HB2 . ASN 92 92 ? A 9.354 -4.859 -20.041 1.000 1 A 84.530 1 ATOM 1496 H HB3 . ASN 92 92 ? A 10.586 -3.617 -19.798 1.000 1 A 84.530 1 ATOM 1497 H HD21 . ASN 92 92 ? A 8.823 -3.314 -18.031 1.000 1 A 84.530 1 ATOM 1498 H HD22 . ASN 92 92 ? A 8.927 -4.314 -16.616 1.000 1 A 84.530 1 ATOM 1499 N N . THR 93 93 ? A 11.876 -5.051 -22.524 1.000 1 A 90.540 1 ATOM 1500 C CA . THR 93 93 ? A 11.747 -5.136 -23.985 1.000 1 A 90.540 1 ATOM 1501 C C . THR 93 93 ? A 12.870 -5.986 -24.599 1.000 1 A 90.540 1 ATOM 1502 O O . THR 93 93 ? A 13.988 -5.990 -24.074 1.000 1 A 90.540 1 ATOM 1503 C CB . THR 93 93 ? A 11.678 -3.744 -24.629 1.000 1 A 90.540 1 ATOM 1504 O OG1 . THR 93 93 ? A 12.898 -3.066 -24.470 1.000 1 A 90.540 1 ATOM 1505 C CG2 . THR 93 93 ? A 10.576 -2.869 -24.034 1.000 1 A 90.540 1 ATOM 1506 H H . THR 93 93 ? A 12.542 -4.391 -22.150 1.000 1 A 90.540 1 ATOM 1507 H HA . THR 93 93 ? A 10.792 -5.612 -24.209 1.000 1 A 90.540 1 ATOM 1508 H HB . THR 93 93 ? A 11.477 -3.864 -25.693 1.000 1 A 90.540 1 ATOM 1509 H HG1 . THR 93 93 ? A 12.747 -2.275 -23.947 1.000 1 A 90.540 1 ATOM 1510 H HG21 . THR 93 93 ? A 9.620 -3.390 -24.090 1.000 1 A 90.540 1 ATOM 1511 H HG22 . THR 93 93 ? A 10.503 -1.943 -24.604 1.000 1 A 90.540 1 ATOM 1512 H HG23 . THR 93 93 ? A 10.794 -2.625 -22.994 1.000 1 A 90.540 1 ATOM 1513 N N . PRO 94 94 ? A 12.616 -6.724 -25.702 1.000 1 A 92.410 1 ATOM 1514 C CA . PRO 94 94 ? A 13.667 -7.480 -26.385 1.000 1 A 92.410 1 ATOM 1515 C C . PRO 94 94 ? A 14.897 -6.635 -26.779 1.000 1 A 92.410 1 ATOM 1516 O O . PRO 94 94 ? A 15.997 -7.074 -26.449 1.000 1 A 92.410 1 ATOM 1517 C CB . PRO 94 94 ? A 13.005 -8.173 -27.583 1.000 1 A 92.410 1 ATOM 1518 C CG . PRO 94 94 ? A 11.519 -8.198 -27.223 1.000 1 A 92.410 1 ATOM 1519 C CD . PRO 94 94 ? A 11.322 -6.974 -26.327 1.000 1 A 92.410 1 ATOM 1520 H HA . PRO 94 94 ? A 14.015 -8.252 -25.699 1.000 1 A 92.410 1 ATOM 1521 H HB2 . PRO 94 94 ? A 13.154 -7.604 -28.501 1.000 1 A 92.410 1 ATOM 1522 H HB3 . PRO 94 94 ? A 13.397 -9.181 -27.719 1.000 1 A 92.410 1 ATOM 1523 H HG2 . PRO 94 94 ? A 11.297 -9.104 -26.658 1.000 1 A 92.410 1 ATOM 1524 H HG3 . PRO 94 94 ? A 10.891 -8.148 -28.111 1.000 1 A 92.410 1 ATOM 1525 H HD2 . PRO 94 94 ? A 10.549 -7.187 -25.588 1.000 1 A 92.410 1 ATOM 1526 H HD3 . PRO 94 94 ? A 11.036 -6.115 -26.933 1.000 1 A 92.410 1 ATOM 1527 N N . PRO 95 95 ? A 14.754 -5.420 -27.357 1.000 1 A 95.780 1 ATOM 1528 C CA . PRO 95 95 ? A 15.910 -4.596 -27.727 1.000 1 A 95.780 1 ATOM 1529 C C . PRO 95 95 ? A 16.793 -4.196 -26.537 1.000 1 A 95.780 1 ATOM 1530 O O . PRO 95 95 ? A 18.016 -4.208 -26.633 1.000 1 A 95.780 1 ATOM 1531 C CB . PRO 95 95 ? A 15.327 -3.359 -28.420 1.000 1 A 95.780 1 ATOM 1532 C CG . PRO 95 95 ? A 13.999 -3.856 -28.979 1.000 1 A 95.780 1 ATOM 1533 C CD . PRO 95 95 ? A 13.538 -4.801 -27.878 1.000 1 A 95.780 1 ATOM 1534 H HA . PRO 95 95 ? A 16.522 -5.149 -28.440 1.000 1 A 95.780 1 ATOM 1535 H HB2 . PRO 95 95 ? A 15.126 -2.576 -27.688 1.000 1 A 95.780 1 ATOM 1536 H HB3 . PRO 95 95 ? A 15.986 -2.990 -29.205 1.000 1 A 95.780 1 ATOM 1537 H HG2 . PRO 95 95 ? A 13.293 -3.041 -29.139 1.000 1 A 95.780 1 ATOM 1538 H HG3 . PRO 95 95 ? A 14.170 -4.412 -29.901 1.000 1 A 95.780 1 ATOM 1539 H HD2 . PRO 95 95 ? A 13.065 -4.221 -27.086 1.000 1 A 95.780 1 ATOM 1540 H HD3 . PRO 95 95 ? A 12.834 -5.522 -28.294 1.000 1 A 95.780 1 ATOM 1541 N N . VAL 96 96 ? A 16.196 -3.895 -25.378 1.000 1 A 95.050 1 ATOM 1542 C CA . VAL 96 96 ? A 16.977 -3.547 -24.181 1.000 1 A 95.050 1 ATOM 1543 C C . VAL 96 96 ? A 17.698 -4.767 -23.605 1.000 1 A 95.050 1 ATOM 1544 O O . VAL 96 96 ? A 18.822 -4.631 -23.129 1.000 1 A 95.050 1 ATOM 1545 C CB . VAL 96 96 ? A 16.096 -2.843 -23.138 1.000 1 A 95.050 1 ATOM 1546 C CG1 . VAL 96 96 ? A 16.829 -2.567 -21.826 1.000 1 A 95.050 1 ATOM 1547 C CG2 . VAL 96 96 ? A 15.676 -1.473 -23.675 1.000 1 A 95.050 1 ATOM 1548 H H . VAL 96 96 ? A 15.187 -3.885 -25.325 1.000 1 A 95.050 1 ATOM 1549 H HA . VAL 96 96 ? A 17.759 -2.847 -24.475 1.000 1 A 95.050 1 ATOM 1550 H HB . VAL 96 96 ? A 15.214 -3.447 -22.925 1.000 1 A 95.050 1 ATOM 1551 H HG11 . VAL 96 96 ? A 17.723 -1.973 -22.016 1.000 1 A 95.050 1 ATOM 1552 H HG12 . VAL 96 96 ? A 17.124 -3.500 -21.345 1.000 1 A 95.050 1 ATOM 1553 H HG13 . VAL 96 96 ? A 16.171 -2.024 -21.148 1.000 1 A 95.050 1 ATOM 1554 H HG21 . VAL 96 96 ? A 15.149 -0.924 -22.894 1.000 1 A 95.050 1 ATOM 1555 H HG22 . VAL 96 96 ? A 16.558 -0.898 -23.956 1.000 1 A 95.050 1 ATOM 1556 H HG23 . VAL 96 96 ? A 15.031 -1.579 -24.548 1.000 1 A 95.050 1 ATOM 1557 N N . ARG 97 97 ? A 17.108 -5.970 -23.680 1.000 1 A 94.190 1 ATOM 1558 C CA . ARG 97 97 ? A 17.800 -7.208 -23.273 1.000 1 A 94.190 1 ATOM 1559 C C . ARG 97 97 ? A 19.021 -7.485 -24.136 1.000 1 A 94.190 1 ATOM 1560 O O . ARG 97 97 ? A 20.076 -7.798 -23.590 1.000 1 A 94.190 1 ATOM 1561 C CB . ARG 97 97 ? A 16.869 -8.426 -23.326 1.000 1 A 94.190 1 ATOM 1562 C CG . ARG 97 97 ? A 15.876 -8.414 -22.168 1.000 1 A 94.190 1 ATOM 1563 C CD . ARG 97 97 ? A 15.115 -9.735 -22.051 1.000 1 A 94.190 1 ATOM 1564 N NE . ARG 97 97 ? A 14.133 -9.915 -23.135 1.000 1 A 94.190 1 ATOM 1565 C CZ . ARG 97 97 ? A 12.871 -9.523 -23.099 1.000 1 A 94.190 1 ATOM 1566 N NH1 . ARG 97 97 ? A 12.385 -8.823 -22.113 1.000 1 A 94.190 1 ATOM 1567 N NH2 . ARG 97 97 ? A 12.060 -9.834 -24.070 1.000 1 A 94.190 1 ATOM 1568 H H . ARG 97 97 ? A 16.202 -6.029 -24.123 1.000 1 A 94.190 1 ATOM 1569 H HA . ARG 97 97 ? A 18.186 -7.085 -22.260 1.000 1 A 94.190 1 ATOM 1570 H HB2 . ARG 97 97 ? A 16.338 -8.456 -24.277 1.000 1 A 94.190 1 ATOM 1571 H HB3 . ARG 97 97 ? A 17.478 -9.326 -23.245 1.000 1 A 94.190 1 ATOM 1572 H HG2 . ARG 97 97 ? A 16.432 -8.280 -21.240 1.000 1 A 94.190 1 ATOM 1573 H HG3 . ARG 97 97 ? A 15.180 -7.585 -22.295 1.000 1 A 94.190 1 ATOM 1574 H HD2 . ARG 97 97 ? A 14.612 -9.758 -21.084 1.000 1 A 94.190 1 ATOM 1575 H HD3 . ARG 97 97 ? A 15.830 -10.557 -22.065 1.000 1 A 94.190 1 ATOM 1576 H HE . ARG 97 97 ? A 14.458 -10.381 -23.970 1.000 1 A 94.190 1 ATOM 1577 H HH11 . ARG 97 97 ? A 13.021 -8.449 -21.423 1.000 1 A 94.190 1 ATOM 1578 H HH12 . ARG 97 97 ? A 11.461 -8.417 -22.152 1.000 1 A 94.190 1 ATOM 1579 H HH21 . ARG 97 97 ? A 12.383 -10.398 -24.843 1.000 1 A 94.190 1 ATOM 1580 H HH22 . ARG 97 97 ? A 11.090 -9.563 -23.995 1.000 1 A 94.190 1 ATOM 1581 N N . GLU 98 98 ? A 18.871 -7.346 -25.449 1.000 1 A 95.590 1 ATOM 1582 C CA . GLU 98 98 ? A 19.968 -7.501 -26.403 1.000 1 A 95.590 1 ATOM 1583 C C . GLU 98 98 ? A 21.089 -6.503 -26.109 1.000 1 A 95.590 1 ATOM 1584 O O . GLU 98 98 ? A 22.235 -6.906 -25.922 1.000 1 A 95.590 1 ATOM 1585 C CB . GLU 98 98 ? A 19.404 -7.368 -27.820 1.000 1 A 95.590 1 ATOM 1586 C CG . GLU 98 98 ? A 20.450 -7.663 -28.903 1.000 1 A 95.590 1 ATOM 1587 C CD . GLU 98 98 ? A 19.819 -7.767 -30.302 1.000 1 A 95.590 1 ATOM 1588 O OE1 . GLU 98 98 ? A 20.488 -8.336 -31.191 1.000 1 A 95.590 1 ATOM 1589 O OE2 . GLU 98 98 ? A 18.641 -7.358 -30.458 1.000 1 A 95.590 1 ATOM 1590 H H . GLU 98 98 ? A 17.965 -7.089 -25.815 1.000 1 A 95.590 1 ATOM 1591 H HA . GLU 98 98 ? A 20.396 -8.498 -26.298 1.000 1 A 95.590 1 ATOM 1592 H HB2 . GLU 98 98 ? A 19.004 -6.364 -27.961 1.000 1 A 95.590 1 ATOM 1593 H HB3 . GLU 98 98 ? A 18.589 -8.085 -27.919 1.000 1 A 95.590 1 ATOM 1594 H HG2 . GLU 98 98 ? A 21.202 -6.874 -28.897 1.000 1 A 95.590 1 ATOM 1595 H HG3 . GLU 98 98 ? A 20.939 -8.606 -28.660 1.000 1 A 95.590 1 ATOM 1596 N N . PHE 99 99 ? A 20.740 -5.234 -25.891 1.000 1 A 97.170 1 ATOM 1597 C CA . PHE 99 99 ? A 21.705 -4.212 -25.495 1.000 1 A 97.170 1 ATOM 1598 C C . PHE 99 99 ? A 22.416 -4.530 -24.167 1.000 1 A 97.170 1 ATOM 1599 O O . PHE 99 99 ? A 23.624 -4.336 -24.036 1.000 1 A 97.170 1 ATOM 1600 C CB . PHE 99 99 ? A 20.978 -2.869 -25.422 1.000 1 A 97.170 1 ATOM 1601 C CG . PHE 99 99 ? A 21.915 -1.706 -25.195 1.000 1 A 97.170 1 ATOM 1602 C CD1 . PHE 99 99 ? A 21.850 -0.944 -24.013 1.000 1 A 97.170 1 ATOM 1603 C CD2 . PHE 99 99 ? A 22.862 -1.389 -26.185 1.000 1 A 97.170 1 ATOM 1604 C CE1 . PHE 99 99 ? A 22.712 0.155 -23.842 1.000 1 A 97.170 1 ATOM 1605 C CE2 . PHE 99 99 ? A 23.731 -0.303 -26.006 1.000 1 A 97.170 1 ATOM 1606 C CZ . PHE 99 99 ? A 23.649 0.476 -24.840 1.000 1 A 97.170 1 ATOM 1607 H H . PHE 99 99 ? A 19.795 -4.949 -26.107 1.000 1 A 97.170 1 ATOM 1608 H HA . PHE 99 99 ? A 22.471 -4.156 -26.269 1.000 1 A 97.170 1 ATOM 1609 H HB2 . PHE 99 99 ? A 20.230 -2.900 -24.630 1.000 1 A 97.170 1 ATOM 1610 H HB3 . PHE 99 99 ? A 20.461 -2.705 -26.367 1.000 1 A 97.170 1 ATOM 1611 H HD1 . PHE 99 99 ? A 21.127 -1.193 -23.250 1.000 1 A 97.170 1 ATOM 1612 H HD2 . PHE 99 99 ? A 22.932 -1.985 -27.083 1.000 1 A 97.170 1 ATOM 1613 H HE1 . PHE 99 99 ? A 22.657 0.753 -22.944 1.000 1 A 97.170 1 ATOM 1614 H HE2 . PHE 99 99 ? A 24.457 -0.081 -26.774 1.000 1 A 97.170 1 ATOM 1615 H HZ . PHE 99 99 ? A 24.309 1.322 -24.712 1.000 1 A 97.170 1 ATOM 1616 N N . CYS 100 100 ? A 21.709 -5.071 -23.167 1.000 1 A 96.490 1 ATOM 1617 C CA . CYS 100 100 ? A 22.352 -5.540 -21.938 1.000 1 A 96.490 1 ATOM 1618 C C . CYS 100 100 ? A 23.353 -6.681 -22.202 1.000 1 A 96.490 1 ATOM 1619 O O . CYS 100 100 ? A 24.400 -6.719 -21.553 1.000 1 A 96.490 1 ATOM 1620 C CB . CYS 100 100 ? A 21.296 -5.976 -20.910 1.000 1 A 96.490 1 ATOM 1621 S SG . CYS 100 100 ? A 20.379 -4.560 -20.235 1.000 1 A 96.490 1 ATOM 1622 H H . CYS 100 100 ? A 20.711 -5.176 -23.278 1.000 1 A 96.490 1 ATOM 1623 H HA . CYS 100 100 ? A 22.931 -4.717 -21.518 1.000 1 A 96.490 1 ATOM 1624 H HB2 . CYS 100 100 ? A 21.800 -6.482 -20.086 1.000 1 A 96.490 1 ATOM 1625 H HB3 . CYS 100 100 ? A 20.601 -6.675 -21.375 1.000 1 A 96.490 1 ATOM 1626 H HG . CYS 100 100 ? A 21.423 -3.744 -20.064 1.000 1 A 96.490 1 ATOM 1627 N N . TRP 101 101 ? A 23.069 -7.599 -23.132 1.000 1 A 95.600 1 ATOM 1628 C CA . TRP 101 101 ? A 24.002 -8.668 -23.515 1.000 1 A 95.600 1 ATOM 1629 C C . TRP 101 101 ? A 25.226 -8.137 -24.260 1.000 1 A 95.600 1 ATOM 1630 O O . TRP 101 101 ? A 26.336 -8.564 -23.948 1.000 1 A 95.600 1 ATOM 1631 C CB . TRP 101 101 ? A 23.296 -9.739 -24.354 1.000 1 A 95.600 1 ATOM 1632 C CG . TRP 101 101 ? A 22.194 -10.497 -23.679 1.000 1 A 95.600 1 ATOM 1633 C CD1 . TRP 101 101 ? A 22.147 -10.840 -22.371 1.000 1 A 95.600 1 ATOM 1634 C CD2 . TRP 101 101 ? A 20.983 -11.045 -24.280 1.000 1 A 95.600 1 ATOM 1635 N NE1 . TRP 101 101 ? A 20.977 -11.525 -22.111 1.000 1 A 95.600 1 ATOM 1636 C CE2 . TRP 101 101 ? A 20.231 -11.696 -23.258 1.000 1 A 95.600 1 ATOM 1637 C CE3 . TRP 101 101 ? A 20.455 -11.080 -25.589 1.000 1 A 95.600 1 ATOM 1638 C CZ2 . TRP 101 101 ? A 19.013 -12.342 -23.516 1.000 1 A 95.600 1 ATOM 1639 C CZ3 . TRP 101 101 ? A 19.226 -11.710 -25.859 1.000 1 A 95.600 1 ATOM 1640 C CH2 . TRP 101 101 ? A 18.506 -12.341 -24.828 1.000 1 A 95.600 1 ATOM 1641 H H . TRP 101 101 ? A 22.209 -7.513 -23.656 1.000 1 A 95.600 1 ATOM 1642 H HA . TRP 101 101 ? A 24.383 -9.145 -22.613 1.000 1 A 95.600 1 ATOM 1643 H HB2 . TRP 101 101 ? A 24.042 -10.468 -24.670 1.000 1 A 95.600 1 ATOM 1644 H HB3 . TRP 101 101 ? A 22.896 -9.280 -25.258 1.000 1 A 95.600 1 ATOM 1645 H HD1 . TRP 101 101 ? A 22.911 -10.598 -21.647 1.000 1 A 95.600 1 ATOM 1646 H HE1 . TRP 101 101 ? A 20.705 -11.825 -21.186 1.000 1 A 95.600 1 ATOM 1647 H HE3 . TRP 101 101 ? A 21.009 -10.618 -26.393 1.000 1 A 95.600 1 ATOM 1648 H HZ2 . TRP 101 101 ? A 18.480 -12.837 -22.717 1.000 1 A 95.600 1 ATOM 1649 H HZ3 . TRP 101 101 ? A 18.842 -11.710 -26.868 1.000 1 A 95.600 1 ATOM 1650 H HH2 . TRP 101 101 ? A 17.569 -12.829 -25.051 1.000 1 A 95.600 1 ATOM 1651 N N . GLU 102 102 ? A 25.059 -7.167 -25.163 1.000 1 A 96.070 1 ATOM 1652 C CA . GLU 102 102 ? A 26.176 -6.478 -25.831 1.000 1 A 96.070 1 ATOM 1653 C C . GLU 102 102 ? A 27.121 -5.809 -24.825 1.000 1 A 96.070 1 ATOM 1654 O O . GLU 102 102 ? A 28.342 -5.835 -24.981 1.000 1 A 96.070 1 ATOM 1655 C CB . GLU 102 102 ? A 25.643 -5.391 -26.770 1.000 1 A 96.070 1 ATOM 1656 C CG . GLU 102 102 ? A 24.905 -5.933 -27.999 1.000 1 A 96.070 1 ATOM 1657 C CD . GLU 102 102 ? A 24.384 -4.800 -28.900 1.000 1 A 96.070 1 ATOM 1658 O OE1 . GLU 102 102 ? A 23.937 -5.121 -30.018 1.000 1 A 96.070 1 ATOM 1659 O OE2 . GLU 102 102 ? A 24.466 -3.615 -28.488 1.000 1 A 96.070 1 ATOM 1660 H H . GLU 102 102 ? A 24.118 -6.904 -25.421 1.000 1 A 96.070 1 ATOM 1661 H HA . GLU 102 102 ? A 26.758 -7.193 -26.413 1.000 1 A 96.070 1 ATOM 1662 H HB2 . GLU 102 102 ? A 24.981 -4.733 -26.207 1.000 1 A 96.070 1 ATOM 1663 H HB3 . GLU 102 102 ? A 26.490 -4.801 -27.120 1.000 1 A 96.070 1 ATOM 1664 H HG2 . GLU 102 102 ? A 24.068 -6.554 -27.680 1.000 1 A 96.070 1 ATOM 1665 H HG3 . GLU 102 102 ? A 25.594 -6.560 -28.564 1.000 1 A 96.070 1 ATOM 1666 N N . LEU 103 103 ? A 26.563 -5.260 -23.743 1.000 1 A 95.940 1 ATOM 1667 C CA . LEU 103 103 ? A 27.320 -4.686 -22.629 1.000 1 A 95.940 1 ATOM 1668 C C . LEU 103 103 ? A 27.910 -5.738 -21.665 1.000 1 A 95.940 1 ATOM 1669 O O . LEU 103 103 ? A 28.569 -5.376 -20.688 1.000 1 A 95.940 1 ATOM 1670 C CB . LEU 103 103 ? A 26.425 -3.666 -21.907 1.000 1 A 95.940 1 ATOM 1671 C CG . LEU 103 103 ? A 26.076 -2.401 -22.711 1.000 1 A 95.940 1 ATOM 1672 C CD1 . LEU 103 103 ? A 25.205 -1.501 -21.832 1.000 1 A 95.940 1 ATOM 1673 C CD2 . LEU 103 103 ? A 27.307 -1.596 -23.135 1.000 1 A 95.940 1 ATOM 1674 H H . LEU 103 103 ? A 25.555 -5.213 -23.721 1.000 1 A 95.940 1 ATOM 1675 H HA . LEU 103 103 ? A 28.185 -4.164 -23.040 1.000 1 A 95.940 1 ATOM 1676 H HB2 . LEU 103 103 ? A 25.491 -4.163 -21.645 1.000 1 A 95.940 1 ATOM 1677 H HB3 . LEU 103 103 ? A 26.919 -3.360 -20.984 1.000 1 A 95.940 1 ATOM 1678 H HG . LEU 103 103 ? A 25.515 -2.663 -23.608 1.000 1 A 95.940 1 ATOM 1679 H HD11 . LEU 103 103 ? A 24.954 -0.591 -22.376 1.000 1 A 95.940 1 ATOM 1680 H HD12 . LEU 103 103 ? A 25.726 -1.247 -20.909 1.000 1 A 95.940 1 ATOM 1681 H HD13 . LEU 103 103 ? A 24.280 -2.029 -21.598 1.000 1 A 95.940 1 ATOM 1682 H HD21 . LEU 103 103 ? A 26.987 -0.670 -23.612 1.000 1 A 95.940 1 ATOM 1683 H HD22 . LEU 103 103 ? A 27.929 -1.375 -22.267 1.000 1 A 95.940 1 ATOM 1684 H HD23 . LEU 103 103 ? A 27.880 -2.168 -23.865 1.000 1 A 95.940 1 ATOM 1685 N N . GLY 104 104 ? A 27.712 -7.033 -21.928 1.000 1 A 95.000 1 ATOM 1686 C CA . GLY 104 104 ? A 28.325 -8.139 -21.191 1.000 1 A 95.000 1 ATOM 1687 C C . GLY 104 104 ? A 27.460 -8.761 -20.091 1.000 1 A 95.000 1 ATOM 1688 O O . GLY 104 104 ? A 27.994 -9.455 -19.219 1.000 1 A 95.000 1 ATOM 1689 H H . GLY 104 104 ? A 27.199 -7.263 -22.767 1.000 1 A 95.000 1 ATOM 1690 H HA2 . GLY 104 104 ? A 29.262 -7.807 -20.742 1.000 1 A 95.000 1 ATOM 1691 H HA3 . GLY 104 104 ? A 28.554 -8.927 -21.908 1.000 1 A 95.000 1 ATOM 1692 N N . ALA 105 105 ? A 26.140 -8.538 -20.087 1.000 1 A 94.510 1 ATOM 1693 C CA . ALA 105 105 ? A 25.249 -9.256 -19.177 1.000 1 A 94.510 1 ATOM 1694 C C . ALA 105 105 ? A 25.247 -10.757 -19.469 1.000 1 A 94.510 1 ATOM 1695 O O . ALA 105 105 ? A 25.278 -11.202 -20.617 1.000 1 A 94.510 1 ATOM 1696 C CB . ALA 105 105 ? A 23.827 -8.693 -19.221 1.000 1 A 94.510 1 ATOM 1697 H H . ALA 105 105 ? A 25.739 -7.938 -20.793 1.000 1 A 94.510 1 ATOM 1698 H HA . ALA 105 105 ? A 25.627 -9.129 -18.163 1.000 1 A 94.510 1 ATOM 1699 H HB1 . ALA 105 105 ? A 23.845 -7.624 -19.012 1.000 1 A 94.510 1 ATOM 1700 H HB2 . ALA 105 105 ? A 23.388 -8.857 -20.206 1.000 1 A 94.510 1 ATOM 1701 H HB3 . ALA 105 105 ? A 23.214 -9.186 -18.466 1.000 1 A 94.510 1 ATOM 1702 N N . LYS 106 106 ? A 25.151 -11.562 -18.410 1.000 1 A 92.250 1 ATOM 1703 C CA . LYS 106 106 ? A 24.979 -13.007 -18.542 1.000 1 A 92.250 1 ATOM 1704 C C . LYS 106 106 ? A 23.594 -13.295 -19.108 1.000 1 A 92.250 1 ATOM 1705 O O . LYS 106 106 ? A 22.617 -12.675 -18.710 1.000 1 A 92.250 1 ATOM 1706 C CB . LYS 106 106 ? A 25.171 -13.701 -17.188 1.000 1 A 92.250 1 ATOM 1707 C CG . LYS 106 106 ? A 26.598 -13.526 -16.653 1.000 1 A 92.250 1 ATOM 1708 C CD . LYS 106 106 ? A 26.773 -14.271 -15.326 1.000 1 A 92.250 1 ATOM 1709 C CE . LYS 106 106 ? A 28.212 -14.095 -14.833 1.000 1 A 92.250 1 ATOM 1710 N NZ . LYS 106 106 ? A 28.468 -14.864 -13.589 1.000 1 A 92.250 1 ATOM 1711 H H . LYS 106 106 ? A 25.021 -11.140 -17.502 1.000 1 A 92.250 1 ATOM 1712 H HA . LYS 106 106 ? A 25.717 -13.375 -19.255 1.000 1 A 92.250 1 ATOM 1713 H HB2 . LYS 106 106 ? A 24.456 -13.297 -16.471 1.000 1 A 92.250 1 ATOM 1714 H HB3 . LYS 106 106 ? A 24.966 -14.765 -17.309 1.000 1 A 92.250 1 ATOM 1715 H HG2 . LYS 106 106 ? A 27.305 -13.920 -17.384 1.000 1 A 92.250 1 ATOM 1716 H HG3 . LYS 106 106 ? A 26.808 -12.468 -16.496 1.000 1 A 92.250 1 ATOM 1717 H HD2 . LYS 106 106 ? A 26.559 -15.329 -15.480 1.000 1 A 92.250 1 ATOM 1718 H HD3 . LYS 106 106 ? A 26.075 -13.864 -14.594 1.000 1 A 92.250 1 ATOM 1719 H HE2 . LYS 106 106 ? A 28.889 -14.425 -15.621 1.000 1 A 92.250 1 ATOM 1720 H HE3 . LYS 106 106 ? A 28.395 -13.033 -14.670 1.000 1 A 92.250 1 ATOM 1721 H HZ1 . LYS 106 106 ? A 27.843 -14.571 -12.852 1.000 1 A 92.250 1 ATOM 1722 H HZ2 . LYS 106 106 ? A 29.420 -14.725 -13.283 1.000 1 A 92.250 1 ATOM 1723 H HZ3 . LYS 106 106 ? A 28.334 -15.851 -13.754 1.000 1 A 92.250 1 ATOM 1724 N N . TYR 107 107 ? A 23.493 -14.315 -19.953 1.000 1 A 84.840 1 ATOM 1725 C CA . TYR 107 107 ? A 22.220 -14.717 -20.556 1.000 1 A 84.840 1 ATOM 1726 C C . TYR 107 107 ? A 21.133 -15.064 -19.520 1.000 1 A 84.840 1 ATOM 1727 O O . TYR 107 107 ? A 19.949 -14.836 -19.747 1.000 1 A 84.840 1 ATOM 1728 C CB . TYR 107 107 ? A 22.491 -15.912 -21.474 1.000 1 A 84.840 1 ATOM 1729 C CG . TYR 107 107 ? A 21.306 -16.273 -22.340 1.000 1 A 84.840 1 ATOM 1730 C CD1 . TYR 107 107 ? A 20.451 -17.333 -21.978 1.000 1 A 84.840 1 ATOM 1731 C CD2 . TYR 107 107 ? A 21.047 -15.518 -23.499 1.000 1 A 84.840 1 ATOM 1732 C CE1 . TYR 107 107 ? A 19.341 -17.643 -22.786 1.000 1 A 84.840 1 ATOM 1733 C CE2 . TYR 107 107 ? A 19.941 -15.829 -24.310 1.000 1 A 84.840 1 ATOM 1734 C CZ . TYR 107 107 ? A 19.089 -16.895 -23.955 1.000 1 A 84.840 1 ATOM 1735 O OH . TYR 107 107 ? A 18.020 -17.207 -24.731 1.000 1 A 84.840 1 ATOM 1736 H H . TYR 107 107 ? A 24.345 -14.707 -20.329 1.000 1 A 84.840 1 ATOM 1737 H HA . TYR 107 107 ? A 21.846 -13.894 -21.165 1.000 1 A 84.840 1 ATOM 1738 H HB2 . TYR 107 107 ? A 22.783 -16.775 -20.876 1.000 1 A 84.840 1 ATOM 1739 H HB3 . TYR 107 107 ? A 23.325 -15.670 -22.134 1.000 1 A 84.840 1 ATOM 1740 H HD1 . TYR 107 107 ? A 20.638 -17.899 -21.078 1.000 1 A 84.840 1 ATOM 1741 H HD2 . TYR 107 107 ? A 21.686 -14.692 -23.771 1.000 1 A 84.840 1 ATOM 1742 H HE1 . TYR 107 107 ? A 18.668 -18.448 -22.531 1.000 1 A 84.840 1 ATOM 1743 H HE2 . TYR 107 107 ? A 19.745 -15.242 -25.195 1.000 1 A 84.840 1 ATOM 1744 H HH . TYR 107 107 ? A 17.972 -16.650 -25.511 1.000 1 A 84.840 1 ATOM 1745 N N . ARG 108 108 ? A 21.531 -15.607 -18.359 1.000 1 A 85.130 1 ATOM 1746 C CA . ARG 108 108 ? A 20.617 -15.965 -17.266 1.000 1 A 85.130 1 ATOM 1747 C C . ARG 108 108 ? A 20.690 -14.952 -16.130 1.000 1 A 85.130 1 ATOM 1748 O O . ARG 108 108 ? A 21.769 -14.681 -15.604 1.000 1 A 85.130 1 ATOM 1749 C CB . ARG 108 108 ? A 20.893 -17.384 -16.751 1.000 1 A 85.130 1 ATOM 1750 C CG . ARG 108 108 ? A 20.614 -18.452 -17.818 1.000 1 A 85.130 1 ATOM 1751 C CD . ARG 108 108 ? A 20.769 -19.852 -17.215 1.000 1 A 85.130 1 ATOM 1752 N NE . ARG 108 108 ? A 20.514 -20.903 -18.218 1.000 1 A 85.130 1 ATOM 1753 C CZ . ARG 108 108 ? A 20.481 -22.207 -18.000 1.000 1 A 85.130 1 ATOM 1754 N NH1 . ARG 108 108 ? A 20.676 -22.717 -16.815 1.000 1 A 85.130 1 ATOM 1755 N NH2 . ARG 108 108 ? A 20.250 -23.033 -18.981 1.000 1 A 85.130 1 ATOM 1756 H H . ARG 108 108 ? A 22.526 -15.655 -18.190 1.000 1 A 85.130 1 ATOM 1757 H HA . ARG 108 108 ? A 19.596 -15.939 -17.646 1.000 1 A 85.130 1 ATOM 1758 H HB2 . ARG 108 108 ? A 20.246 -17.569 -15.894 1.000 1 A 85.130 1 ATOM 1759 H HB3 . ARG 108 108 ? A 21.929 -17.457 -16.422 1.000 1 A 85.130 1 ATOM 1760 H HG2 . ARG 108 108 ? A 19.598 -18.332 -18.193 1.000 1 A 85.130 1 ATOM 1761 H HG3 . ARG 108 108 ? A 21.315 -18.337 -18.644 1.000 1 A 85.130 1 ATOM 1762 H HD2 . ARG 108 108 ? A 21.782 -19.958 -16.828 1.000 1 A 85.130 1 ATOM 1763 H HD3 . ARG 108 108 ? A 20.062 -19.956 -16.391 1.000 1 A 85.130 1 ATOM 1764 H HE . ARG 108 108 ? A 20.344 -20.599 -19.165 1.000 1 A 85.130 1 ATOM 1765 H HH11 . ARG 108 108 ? A 20.658 -23.718 -16.683 1.000 1 A 85.130 1 ATOM 1766 H HH12 . ARG 108 108 ? A 20.875 -22.099 -16.041 1.000 1 A 85.130 1 ATOM 1767 H HH21 . ARG 108 108 ? A 20.098 -22.689 -19.918 1.000 1 A 85.130 1 ATOM 1768 H HH22 . ARG 108 108 ? A 20.226 -24.030 -18.821 1.000 1 A 85.130 1 ATOM 1769 N N . VAL 109 109 ? A 19.521 -14.490 -15.700 1.000 1 A 82.340 1 ATOM 1770 C CA . VAL 109 109 ? A 19.364 -13.652 -14.510 1.000 1 A 82.340 1 ATOM 1771 C C . VAL 109 109 ? A 19.496 -14.503 -13.245 1.000 1 A 82.340 1 ATOM 1772 O O . VAL 109 109 ? A 18.880 -15.564 -13.123 1.000 1 A 82.340 1 ATOM 1773 C CB . VAL 109 109 ? A 18.020 -12.906 -14.543 1.000 1 A 82.340 1 ATOM 1774 C CG1 . VAL 109 109 ? A 17.884 -11.991 -13.326 1.000 1 A 82.340 1 ATOM 1775 C CG2 . VAL 109 109 ? A 17.890 -12.028 -15.794 1.000 1 A 82.340 1 ATOM 1776 H H . VAL 109 109 ? A 18.688 -14.747 -16.210 1.000 1 A 82.340 1 ATOM 1777 H HA . VAL 109 109 ? A 20.158 -12.906 -14.510 1.000 1 A 82.340 1 ATOM 1778 H HB . VAL 109 109 ? A 17.207 -13.632 -14.540 1.000 1 A 82.340 1 ATOM 1779 H HG11 . VAL 109 109 ? A 16.984 -11.385 -13.433 1.000 1 A 82.340 1 ATOM 1780 H HG12 . VAL 109 109 ? A 18.747 -11.328 -13.261 1.000 1 A 82.340 1 ATOM 1781 H HG13 . VAL 109 109 ? A 17.801 -12.574 -12.409 1.000 1 A 82.340 1 ATOM 1782 H HG21 . VAL 109 109 ? A 18.693 -11.291 -15.817 1.000 1 A 82.340 1 ATOM 1783 H HG22 . VAL 109 109 ? A 17.932 -12.631 -16.702 1.000 1 A 82.340 1 ATOM 1784 H HG23 . VAL 109 109 ? A 16.935 -11.503 -15.785 1.000 1 A 82.340 1 ATOM 1785 N N . ASP 110 110 ? A 20.293 -14.030 -12.288 1.000 1 A 86.670 1 ATOM 1786 C CA . ASP 110 110 ? A 20.466 -14.690 -10.995 1.000 1 A 86.670 1 ATOM 1787 C C . ASP 110 110 ? A 19.325 -14.320 -10.035 1.000 1 A 86.670 1 ATOM 1788 O O . ASP 110 110 ? A 19.177 -13.165 -9.628 1.000 1 A 86.670 1 ATOM 1789 C CB . ASP 110 110 ? A 21.846 -14.346 -10.416 1.000 1 A 86.670 1 ATOM 1790 C CG . ASP 110 110 ? A 22.176 -15.108 -9.125 1.000 1 A 86.670 1 ATOM 1791 O OD1 . ASP 110 110 ? A 21.286 -15.811 -8.588 1.000 1 A 86.670 1 ATOM 1792 O OD2 . ASP 110 110 ? A 23.329 -14.961 -8.672 1.000 1 A 86.670 1 ATOM 1793 H H . ASP 110 110 ? A 20.742 -13.137 -12.431 1.000 1 A 86.670 1 ATOM 1794 H HA . ASP 110 110 ? A 20.446 -15.769 -11.148 1.000 1 A 86.670 1 ATOM 1795 H HB2 . ASP 110 110 ? A 21.895 -13.275 -10.224 1.000 1 A 86.670 1 ATOM 1796 H HB3 . ASP 110 110 ? A 22.604 -14.588 -11.161 1.000 1 A 86.670 1 ATOM 1797 N N . LYS 111 111 ? A 18.548 -15.325 -9.619 1.000 1 A 89.920 1 ATOM 1798 C CA . LYS 111 111 ? A 17.473 -15.175 -8.628 1.000 1 A 89.920 1 ATOM 1799 C C . LYS 111 111 ? A 17.976 -14.573 -7.311 1.000 1 A 89.920 1 ATOM 1800 O O . LYS 111 111 ? A 17.265 -13.776 -6.707 1.000 1 A 89.920 1 ATOM 1801 C CB . LYS 111 111 ? A 16.827 -16.539 -8.351 1.000 1 A 89.920 1 ATOM 1802 C CG . LYS 111 111 ? A 16.101 -17.139 -9.567 1.000 1 A 89.920 1 ATOM 1803 C CD . LYS 111 111 ? A 15.585 -18.535 -9.196 1.000 1 A 89.920 1 ATOM 1804 C CE . LYS 111 111 ? A 14.798 -19.185 -10.341 1.000 1 A 89.920 1 ATOM 1805 N NZ . LYS 111 111 ? A 14.194 -20.470 -9.898 1.000 1 A 89.920 1 ATOM 1806 H H . LYS 111 111 ? A 18.771 -16.247 -9.964 1.000 1 A 89.920 1 ATOM 1807 H HA . LYS 111 111 ? A 16.719 -14.488 -9.011 1.000 1 A 89.920 1 ATOM 1808 H HB2 . LYS 111 111 ? A 17.599 -17.230 -8.013 1.000 1 A 89.920 1 ATOM 1809 H HB3 . LYS 111 111 ? A 16.105 -16.421 -7.544 1.000 1 A 89.920 1 ATOM 1810 H HG2 . LYS 111 111 ? A 16.782 -17.221 -10.414 1.000 1 A 89.920 1 ATOM 1811 H HG3 . LYS 111 111 ? A 15.263 -16.497 -9.840 1.000 1 A 89.920 1 ATOM 1812 H HD2 . LYS 111 111 ? A 16.434 -19.169 -8.941 1.000 1 A 89.920 1 ATOM 1813 H HD3 . LYS 111 111 ? A 14.953 -18.446 -8.313 1.000 1 A 89.920 1 ATOM 1814 H HE2 . LYS 111 111 ? A 15.471 -19.347 -11.182 1.000 1 A 89.920 1 ATOM 1815 H HE3 . LYS 111 111 ? A 14.020 -18.493 -10.665 1.000 1 A 89.920 1 ATOM 1816 H HZ1 . LYS 111 111 ? A 13.584 -20.317 -9.108 1.000 1 A 89.920 1 ATOM 1817 H HZ2 . LYS 111 111 ? A 14.909 -21.118 -9.598 1.000 1 A 89.920 1 ATOM 1818 H HZ3 . LYS 111 111 ? A 13.661 -20.907 -10.636 1.000 1 A 89.920 1 ATOM 1819 N N . LYS 112 112 ? A 19.205 -14.894 -6.878 1.000 1 A 90.920 1 ATOM 1820 C CA . LYS 112 112 ? A 19.786 -14.341 -5.644 1.000 1 A 90.920 1 ATOM 1821 C C . LYS 112 112 ? A 19.988 -12.831 -5.740 1.000 1 A 90.920 1 ATOM 1822 O O . LYS 112 112 ? A 19.779 -12.142 -4.748 1.000 1 A 90.920 1 ATOM 1823 C CB . LYS 112 112 ? A 21.123 -15.019 -5.308 1.000 1 A 90.920 1 ATOM 1824 C CG . LYS 112 112 ? A 20.966 -16.498 -4.929 1.000 1 A 90.920 1 ATOM 1825 C CD . LYS 112 112 ? A 22.321 -17.080 -4.505 1.000 1 A 90.920 1 ATOM 1826 C CE . LYS 112 112 ? A 22.165 -18.545 -4.083 1.000 1 A 90.920 1 ATOM 1827 N NZ . LYS 112 112 ? A 23.455 -19.122 -3.627 1.000 1 A 90.920 1 ATOM 1828 H H . LYS 112 112 ? A 19.794 -15.454 -7.477 1.000 1 A 90.920 1 ATOM 1829 H HA . LYS 112 112 ? A 19.094 -14.500 -4.818 1.000 1 A 90.920 1 ATOM 1830 H HB2 . LYS 112 112 ? A 21.806 -14.926 -6.152 1.000 1 A 90.920 1 ATOM 1831 H HB3 . LYS 112 112 ? A 21.565 -14.495 -4.461 1.000 1 A 90.920 1 ATOM 1832 H HG2 . LYS 112 112 ? A 20.260 -16.586 -4.103 1.000 1 A 90.920 1 ATOM 1833 H HG3 . LYS 112 112 ? A 20.585 -17.057 -5.785 1.000 1 A 90.920 1 ATOM 1834 H HD2 . LYS 112 112 ? A 23.014 -17.007 -5.343 1.000 1 A 90.920 1 ATOM 1835 H HD3 . LYS 112 112 ? A 22.711 -16.500 -3.669 1.000 1 A 90.920 1 ATOM 1836 H HE2 . LYS 112 112 ? A 21.428 -18.599 -3.283 1.000 1 A 90.920 1 ATOM 1837 H HE3 . LYS 112 112 ? A 21.777 -19.110 -4.931 1.000 1 A 90.920 1 ATOM 1838 H HZ1 . LYS 112 112 ? A 23.805 -18.612 -2.829 1.000 1 A 90.920 1 ATOM 1839 H HZ2 . LYS 112 112 ? A 24.145 -19.078 -4.364 1.000 1 A 90.920 1 ATOM 1840 H HZ3 . LYS 112 112 ? A 23.336 -20.087 -3.353 1.000 1 A 90.920 1 ATOM 1841 N N . LYS 113 113 ? A 20.334 -12.306 -6.923 1.000 1 A 90.150 1 ATOM 1842 C CA . LYS 113 113 ? A 20.467 -10.856 -7.145 1.000 1 A 90.150 1 ATOM 1843 C C . LYS 113 113 ? A 19.121 -10.144 -7.079 1.000 1 A 90.150 1 ATOM 1844 O O . LYS 113 113 ? A 19.045 -9.082 -6.471 1.000 1 A 90.150 1 ATOM 1845 C CB . LYS 113 113 ? A 21.156 -10.552 -8.480 1.000 1 A 90.150 1 ATOM 1846 C CG . LYS 113 113 ? A 22.637 -10.943 -8.467 1.000 1 A 90.150 1 ATOM 1847 C CD . LYS 113 113 ? A 23.312 -10.458 -9.753 1.000 1 A 90.150 1 ATOM 1848 C CE . LYS 113 113 ? A 24.787 -10.855 -9.732 1.000 1 A 90.150 1 ATOM 1849 N NZ . LYS 113 113 ? A 25.507 -10.299 -10.899 1.000 1 A 90.150 1 ATOM 1850 H H . LYS 113 113 ? A 20.426 -12.933 -7.709 1.000 1 A 90.150 1 ATOM 1851 H HA . LYS 113 113 ? A 21.067 -10.424 -6.344 1.000 1 A 90.150 1 ATOM 1852 H HB2 . LYS 113 113 ? A 21.089 -9.479 -8.659 1.000 1 A 90.150 1 ATOM 1853 H HB3 . LYS 113 113 ? A 20.643 -11.062 -9.296 1.000 1 A 90.150 1 ATOM 1854 H HG2 . LYS 113 113 ? A 22.735 -12.025 -8.380 1.000 1 A 90.150 1 ATOM 1855 H HG3 . LYS 113 113 ? A 23.123 -10.474 -7.612 1.000 1 A 90.150 1 ATOM 1856 H HD2 . LYS 113 113 ? A 22.819 -10.904 -10.617 1.000 1 A 90.150 1 ATOM 1857 H HD3 . LYS 113 113 ? A 23.226 -9.373 -9.815 1.000 1 A 90.150 1 ATOM 1858 H HE2 . LYS 113 113 ? A 25.233 -10.473 -8.813 1.000 1 A 90.150 1 ATOM 1859 H HE3 . LYS 113 113 ? A 24.856 -11.943 -9.715 1.000 1 A 90.150 1 ATOM 1860 H HZ1 . LYS 113 113 ? A 26.491 -10.528 -10.891 1.000 1 A 90.150 1 ATOM 1861 H HZ2 . LYS 113 113 ? A 25.534 -9.290 -10.859 1.000 1 A 90.150 1 ATOM 1862 H HZ3 . LYS 113 113 ? A 25.090 -10.548 -11.784 1.000 1 A 90.150 1 ATOM 1863 N N . ILE 114 114 ? A 18.067 -10.748 -7.636 1.000 1 A 91.300 1 ATOM 1864 C CA . ILE 114 114 ? A 16.696 -10.222 -7.521 1.000 1 A 91.300 1 ATOM 1865 C C . ILE 114 114 ? A 16.294 -10.132 -6.047 1.000 1 A 91.300 1 ATOM 1866 O O . ILE 114 114 ? A 15.896 -9.064 -5.590 1.000 1 A 91.300 1 ATOM 1867 C CB . ILE 114 114 ? A 15.688 -11.077 -8.324 1.000 1 A 91.300 1 ATOM 1868 C CG1 . ILE 114 114 ? A 16.006 -10.993 -9.829 1.000 1 A 91.300 1 ATOM 1869 C CG2 . ILE 114 114 ? A 14.250 -10.592 -8.050 1.000 1 A 91.300 1 ATOM 1870 C CD1 . ILE 114 114 ? A 15.248 -12.008 -10.687 1.000 1 A 91.300 1 ATOM 1871 H H . ILE 114 114 ? A 18.221 -11.609 -8.141 1.000 1 A 91.300 1 ATOM 1872 H HA . ILE 114 114 ? A 16.675 -9.207 -7.917 1.000 1 A 91.300 1 ATOM 1873 H HB . ILE 114 114 ? A 15.765 -12.117 -8.007 1.000 1 A 91.300 1 ATOM 1874 H HG12 . ILE 114 114 ? A 15.764 -9.989 -10.178 1.000 1 A 91.300 1 ATOM 1875 H HG13 . ILE 114 114 ? A 17.070 -11.160 -9.999 1.000 1 A 91.300 1 ATOM 1876 H HG21 . ILE 114 114 ? A 14.157 -9.528 -8.266 1.000 1 A 91.300 1 ATOM 1877 H HG22 . ILE 114 114 ? A 13.983 -10.758 -7.006 1.000 1 A 91.300 1 ATOM 1878 H HG23 . ILE 114 114 ? A 13.520 -11.144 -8.642 1.000 1 A 91.300 1 ATOM 1879 H HD11 . ILE 114 114 ? A 15.465 -11.790 -11.733 1.000 1 A 91.300 1 ATOM 1880 H HD12 . ILE 114 114 ? A 15.576 -13.020 -10.449 1.000 1 A 91.300 1 ATOM 1881 H HD13 . ILE 114 114 ? A 14.170 -11.931 -10.548 1.000 1 A 91.300 1 ATOM 1882 N N . MET 115 115 ? A 16.462 -11.222 -5.292 1.000 1 A 92.650 1 ATOM 1883 C CA . MET 115 115 ? A 16.101 -11.249 -3.872 1.000 1 A 92.650 1 ATOM 1884 C C . MET 115 115 ? A 16.935 -10.281 -3.036 1.000 1 A 92.650 1 ATOM 1885 O O . MET 115 115 ? A 16.384 -9.560 -2.210 1.000 1 A 92.650 1 ATOM 1886 C CB . MET 115 115 ? A 16.236 -12.671 -3.308 1.000 1 A 92.650 1 ATOM 1887 C CG . MET 115 115 ? A 15.215 -13.642 -3.907 1.000 1 A 92.650 1 ATOM 1888 S SD . MET 115 115 ? A 13.495 -13.070 -3.904 1.000 1 A 92.650 1 ATOM 1889 C CE . MET 115 115 ? A 13.204 -12.829 -2.134 1.000 1 A 92.650 1 ATOM 1890 H H . MET 115 115 ? A 16.763 -12.079 -5.734 1.000 1 A 92.650 1 ATOM 1891 H HA . MET 115 115 ? A 15.067 -10.919 -3.769 1.000 1 A 92.650 1 ATOM 1892 H HB2 . MET 115 115 ? A 17.241 -13.049 -3.494 1.000 1 A 92.650 1 ATOM 1893 H HB3 . MET 115 115 ? A 16.083 -12.636 -2.230 1.000 1 A 92.650 1 ATOM 1894 H HG2 . MET 115 115 ? A 15.271 -14.581 -3.356 1.000 1 A 92.650 1 ATOM 1895 H HG3 . MET 115 115 ? A 15.490 -13.850 -4.941 1.000 1 A 92.650 1 ATOM 1896 H HE1 . MET 115 115 ? A 13.459 -13.736 -1.586 1.000 1 A 92.650 1 ATOM 1897 H HE2 . MET 115 115 ? A 12.150 -12.597 -1.975 1.000 1 A 92.650 1 ATOM 1898 H HE3 . MET 115 115 ? A 13.802 -11.987 -1.785 1.000 1 A 92.650 1 ATOM 1899 N N . HIS 116 116 ? A 18.249 -10.228 -3.268 1.000 1 A 91.280 1 ATOM 1900 C CA . HIS 116 116 ? A 19.128 -9.272 -2.601 1.000 1 A 91.280 1 ATOM 1901 C C . HIS 116 116 ? A 18.659 -7.833 -2.834 1.000 1 A 91.280 1 ATOM 1902 O O . HIS 116 116 ? A 18.542 -7.064 -1.885 1.000 1 A 91.280 1 ATOM 1903 C CB . HIS 116 116 ? A 20.564 -9.465 -3.106 1.000 1 A 91.280 1 ATOM 1904 C CG . HIS 116 116 ? A 21.514 -8.433 -2.558 1.000 1 A 91.280 1 ATOM 1905 N ND1 . HIS 116 116 ? A 21.929 -8.335 -1.251 1.000 1 A 91.280 1 ATOM 1906 C CD2 . HIS 116 116 ? A 22.058 -7.373 -3.235 1.000 1 A 91.280 1 ATOM 1907 C CE1 . HIS 116 116 ? A 22.711 -7.250 -1.143 1.000 1 A 91.280 1 ATOM 1908 N NE2 . HIS 116 116 ? A 22.830 -6.636 -2.331 1.000 1 A 91.280 1 ATOM 1909 H H . HIS 116 116 ? A 18.656 -10.863 -3.941 1.000 1 A 91.280 1 ATOM 1910 H HA . HIS 116 116 ? A 19.102 -9.452 -1.527 1.000 1 A 91.280 1 ATOM 1911 H HB2 . HIS 116 116 ? A 20.914 -10.454 -2.811 1.000 1 A 91.280 1 ATOM 1912 H HB3 . HIS 116 116 ? A 20.580 -9.408 -4.194 1.000 1 A 91.280 1 ATOM 1913 H HD1 . HIS 116 116 ? A 21.632 -8.922 -0.485 1.000 1 A 91.280 1 ATOM 1914 H HD2 . HIS 116 116 ? A 21.900 -7.134 -4.276 1.000 1 A 91.280 1 ATOM 1915 H HE1 . HIS 116 116 ? A 23.163 -6.901 -0.226 1.000 1 A 91.280 1 ATOM 1916 N N . MET 117 117 ? A 18.338 -7.488 -4.082 1.000 1 A 91.140 1 ATOM 1917 C CA . MET 117 117 ? A 17.877 -6.151 -4.431 1.000 1 A 91.140 1 ATOM 1918 C C . MET 117 117 ? A 16.517 -5.823 -3.810 1.000 1 A 91.140 1 ATOM 1919 O O . MET 117 117 ? A 16.320 -4.730 -3.288 1.000 1 A 91.140 1 ATOM 1920 C CB . MET 117 117 ? A 17.824 -6.035 -5.957 1.000 1 A 91.140 1 ATOM 1921 C CG . MET 117 117 ? A 17.544 -4.597 -6.366 1.000 1 A 91.140 1 ATOM 1922 S SD . MET 117 117 ? A 18.816 -3.433 -5.812 1.000 1 A 91.140 1 ATOM 1923 C CE . MET 117 117 ? A 17.778 -1.959 -5.807 1.000 1 A 91.140 1 ATOM 1924 H H . MET 117 117 ? A 18.440 -8.166 -4.824 1.000 1 A 91.140 1 ATOM 1925 H HA . MET 117 117 ? A 18.597 -5.435 -4.035 1.000 1 A 91.140 1 ATOM 1926 H HB2 . MET 117 117 ? A 18.783 -6.334 -6.380 1.000 1 A 91.140 1 ATOM 1927 H HB3 . MET 117 117 ? A 17.046 -6.684 -6.358 1.000 1 A 91.140 1 ATOM 1928 H HG2 . MET 117 117 ? A 17.472 -4.555 -7.453 1.000 1 A 91.140 1 ATOM 1929 H HG3 . MET 117 117 ? A 16.576 -4.300 -5.962 1.000 1 A 91.140 1 ATOM 1930 H HE1 . MET 117 117 ? A 17.729 -1.541 -6.813 1.000 1 A 91.140 1 ATOM 1931 H HE2 . MET 117 117 ? A 16.775 -2.223 -5.472 1.000 1 A 91.140 1 ATOM 1932 H HE3 . MET 117 117 ? A 18.182 -1.228 -5.107 1.000 1 A 91.140 1 ATOM 1933 N N . PHE 118 118 ? A 15.586 -6.775 -3.826 1.000 1 A 92.670 1 ATOM 1934 C CA . PHE 118 118 ? A 14.283 -6.597 -3.204 1.000 1 A 92.670 1 ATOM 1935 C C . PHE 118 118 ? A 14.401 -6.334 -1.697 1.000 1 A 92.670 1 ATOM 1936 O O . PHE 118 118 ? A 13.889 -5.329 -1.213 1.000 1 A 92.670 1 ATOM 1937 C CB . PHE 118 118 ? A 13.419 -7.821 -3.498 1.000 1 A 92.670 1 ATOM 1938 C CG . PHE 118 118 ? A 12.084 -7.747 -2.796 1.000 1 A 92.670 1 ATOM 1939 C CD1 . PHE 118 118 ? A 11.866 -8.482 -1.616 1.000 1 A 92.670 1 ATOM 1940 C CD2 . PHE 118 118 ? A 11.098 -6.863 -3.266 1.000 1 A 92.670 1 ATOM 1941 C CE1 . PHE 118 118 ? A 10.647 -8.358 -0.931 1.000 1 A 92.670 1 ATOM 1942 C CE2 . PHE 118 118 ? A 9.878 -6.749 -2.583 1.000 1 A 92.670 1 ATOM 1943 C CZ . PHE 118 118 ? A 9.643 -7.512 -1.430 1.000 1 A 92.670 1 ATOM 1944 H H . PHE 118 118 ? A 15.784 -7.651 -4.289 1.000 1 A 92.670 1 ATOM 1945 H HA . PHE 118 118 ? A 13.798 -5.723 -3.639 1.000 1 A 92.670 1 ATOM 1946 H HB2 . PHE 118 118 ? A 13.940 -8.724 -3.181 1.000 1 A 92.670 1 ATOM 1947 H HB3 . PHE 118 118 ? A 13.256 -7.888 -4.573 1.000 1 A 92.670 1 ATOM 1948 H HD1 . PHE 118 118 ? A 12.638 -9.126 -1.222 1.000 1 A 92.670 1 ATOM 1949 H HD2 . PHE 118 118 ? A 11.278 -6.259 -4.143 1.000 1 A 92.670 1 ATOM 1950 H HE1 . PHE 118 118 ? A 10.493 -8.906 -0.013 1.000 1 A 92.670 1 ATOM 1951 H HE2 . PHE 118 118 ? A 9.129 -6.049 -2.923 1.000 1 A 92.670 1 ATOM 1952 H HZ . PHE 118 118 ? A 8.694 -7.427 -0.920 1.000 1 A 92.670 1 ATOM 1953 N N . PHE 119 119 ? A 15.134 -7.176 -0.960 1.000 1 A 92.090 1 ATOM 1954 C CA . PHE 119 119 ? A 15.309 -7.004 0.488 1.000 1 A 92.090 1 ATOM 1955 C C . PHE 119 119 ? A 16.155 -5.788 0.861 1.000 1 A 92.090 1 ATOM 1956 O O . PHE 119 119 ? A 16.007 -5.251 1.955 1.000 1 A 92.090 1 ATOM 1957 C CB . PHE 119 119 ? A 15.916 -8.272 1.094 1.000 1 A 92.090 1 ATOM 1958 C CG . PHE 119 119 ? A 14.956 -9.440 1.170 1.000 1 A 92.090 1 ATOM 1959 C CD1 . PHE 119 119 ? A 13.740 -9.303 1.867 1.000 1 A 92.090 1 ATOM 1960 C CD2 . PHE 119 119 ? A 15.296 -10.677 0.594 1.000 1 A 92.090 1 ATOM 1961 C CE1 . PHE 119 119 ? A 12.859 -10.392 1.969 1.000 1 A 92.090 1 ATOM 1962 C CE2 . PHE 119 119 ? A 14.425 -11.773 0.719 1.000 1 A 92.090 1 ATOM 1963 C CZ . PHE 119 119 ? A 13.202 -11.628 1.395 1.000 1 A 92.090 1 ATOM 1964 H H . PHE 119 119 ? A 15.549 -7.982 -1.406 1.000 1 A 92.090 1 ATOM 1965 H HA . PHE 119 119 ? A 14.332 -6.830 0.937 1.000 1 A 92.090 1 ATOM 1966 H HB2 . PHE 119 119 ? A 16.805 -8.551 0.529 1.000 1 A 92.090 1 ATOM 1967 H HB3 . PHE 119 119 ? A 16.231 -8.053 2.114 1.000 1 A 92.090 1 ATOM 1968 H HD1 . PHE 119 119 ? A 13.482 -8.362 2.329 1.000 1 A 92.090 1 ATOM 1969 H HD2 . PHE 119 119 ? A 16.239 -10.793 0.081 1.000 1 A 92.090 1 ATOM 1970 H HE1 . PHE 119 119 ? A 11.926 -10.281 2.501 1.000 1 A 92.090 1 ATOM 1971 H HE2 . PHE 119 119 ? A 14.702 -12.732 0.308 1.000 1 A 92.090 1 ATOM 1972 H HZ . PHE 119 119 ? A 12.536 -12.473 1.490 1.000 1 A 92.090 1 ATOM 1973 N N . LYS 120 120 ? A 17.012 -5.313 -0.048 1.000 1 A 90.930 1 ATOM 1974 C CA . LYS 120 120 ? A 17.702 -4.034 0.123 1.000 1 A 90.930 1 ATOM 1975 C C . LYS 120 120 ? A 16.727 -2.852 0.130 1.000 1 A 90.930 1 ATOM 1976 O O . LYS 120 120 ? A 16.971 -1.887 0.841 1.000 1 A 90.930 1 ATOM 1977 C CB . LYS 120 120 ? A 18.758 -3.896 -0.978 1.000 1 A 90.930 1 ATOM 1978 C CG . LYS 120 120 ? A 19.572 -2.612 -0.814 1.000 1 A 90.930 1 ATOM 1979 C CD . LYS 120 120 ? A 20.566 -2.465 -1.960 1.000 1 A 90.930 1 ATOM 1980 C CE . LYS 120 120 ? A 21.342 -1.175 -1.724 1.000 1 A 90.930 1 ATOM 1981 N NZ . LYS 120 120 ? A 22.233 -0.886 -2.861 1.000 1 A 90.930 1 ATOM 1982 H H . LYS 120 120 ? A 17.157 -5.836 -0.899 1.000 1 A 90.930 1 ATOM 1983 H HA . LYS 120 120 ? A 18.195 -4.026 1.095 1.000 1 A 90.930 1 ATOM 1984 H HB2 . LYS 120 120 ? A 18.271 -3.883 -1.953 1.000 1 A 90.930 1 ATOM 1985 H HB3 . LYS 120 120 ? A 19.435 -4.749 -0.934 1.000 1 A 90.930 1 ATOM 1986 H HG2 . LYS 120 120 ? A 20.102 -2.637 0.138 1.000 1 A 90.930 1 ATOM 1987 H HG3 . LYS 120 120 ? A 18.913 -1.744 -0.835 1.000 1 A 90.930 1 ATOM 1988 H HD2 . LYS 120 120 ? A 21.244 -3.319 -1.975 1.000 1 A 90.930 1 ATOM 1989 H HD3 . LYS 120 120 ? A 20.024 -2.409 -2.904 1.000 1 A 90.930 1 ATOM 1990 H HE2 . LYS 120 120 ? A 21.915 -1.275 -0.802 1.000 1 A 90.930 1 ATOM 1991 H HE3 . LYS 120 120 ? A 20.636 -0.355 -1.595 1.000 1 A 90.930 1 ATOM 1992 H HZ1 . LYS 120 120 ? A 22.749 -1.697 -3.170 1.000 1 A 90.930 1 ATOM 1993 H HZ2 . LYS 120 120 ? A 21.692 -0.535 -3.639 1.000 1 A 90.930 1 ATOM 1994 H HZ3 . LYS 120 120 ? A 22.856 -0.122 -2.643 1.000 1 A 90.930 1 ATOM 1995 N N . LEU 121 121 ? A 15.645 -2.915 -0.647 1.000 1 A 91.840 1 ATOM 1996 C CA . LEU 121 121 ? A 14.627 -1.861 -0.688 1.000 1 A 91.840 1 ATOM 1997 C C . LEU 121 121 ? A 13.541 -2.058 0.373 1.000 1 A 91.840 1 ATOM 1998 O O . LEU 121 121 ? A 13.020 -1.085 0.911 1.000 1 A 91.840 1 ATOM 1999 C CB . LEU 121 121 ? A 13.999 -1.804 -2.089 1.000 1 A 91.840 1 ATOM 2000 C CG . LEU 121 121 ? A 14.977 -1.449 -3.221 1.000 1 A 91.840 1 ATOM 2001 C CD1 . LEU 121 121 ? A 14.215 -1.437 -4.543 1.000 1 A 91.840 1 ATOM 2002 C CD2 . LEU 121 121 ? A 15.621 -0.074 -3.039 1.000 1 A 91.840 1 ATOM 2003 H H . LEU 121 121 ? A 15.511 -3.738 -1.217 1.000 1 A 91.840 1 ATOM 2004 H HA . LEU 121 121 ? A 15.089 -0.898 -0.470 1.000 1 A 91.840 1 ATOM 2005 H HB2 . LEU 121 121 ? A 13.542 -2.768 -2.309 1.000 1 A 91.840 1 ATOM 2006 H HB3 . LEU 121 121 ? A 13.207 -1.055 -2.073 1.000 1 A 91.840 1 ATOM 2007 H HG . LEU 121 121 ? A 15.768 -2.197 -3.281 1.000 1 A 91.840 1 ATOM 2008 H HD11 . LEU 121 121 ? A 14.891 -1.155 -5.350 1.000 1 A 91.840 1 ATOM 2009 H HD12 . LEU 121 121 ? A 13.802 -2.427 -4.739 1.000 1 A 91.840 1 ATOM 2010 H HD13 . LEU 121 121 ? A 13.410 -0.704 -4.490 1.000 1 A 91.840 1 ATOM 2011 H HD21 . LEU 121 121 ? A 14.852 0.691 -2.928 1.000 1 A 91.840 1 ATOM 2012 H HD22 . LEU 121 121 ? A 16.254 -0.070 -2.151 1.000 1 A 91.840 1 ATOM 2013 H HD23 . LEU 121 121 ? A 16.248 0.161 -3.899 1.000 1 A 91.840 1 ATOM 2014 N N . ILE 122 122 ? A 13.186 -3.304 0.679 1.000 1 A 90.930 1 ATOM 2015 C CA . ILE 122 122 ? A 12.083 -3.636 1.582 1.000 1 A 90.930 1 ATOM 2016 C C . ILE 122 122 ? A 12.612 -4.412 2.790 1.000 1 A 90.930 1 ATOM 2017 O O . ILE 122 122 ? A 12.779 -5.632 2.751 1.000 1 A 90.930 1 ATOM 2018 C CB . ILE 122 122 ? A 10.960 -4.378 0.826 1.000 1 A 90.930 1 ATOM 2019 C CG1 . ILE 122 122 ? A 10.466 -3.640 -0.440 1.000 1 A 90.930 1 ATOM 2020 C CG2 . ILE 122 122 ? A 9.776 -4.615 1.781 1.000 1 A 90.930 1 ATOM 2021 C CD1 . ILE 122 122 ? A 9.810 -2.273 -0.199 1.000 1 A 90.930 1 ATOM 2022 H H . ILE 122 122 ? A 13.623 -4.060 0.172 1.000 1 A 90.930 1 ATOM 2023 H HA . ILE 122 122 ? A 11.645 -2.715 1.967 1.000 1 A 90.930 1 ATOM 2024 H HB . ILE 122 122 ? A 11.338 -5.348 0.502 1.000 1 A 90.930 1 ATOM 2025 H HG12 . ILE 122 122 ? A 11.297 -3.513 -1.134 1.000 1 A 90.930 1 ATOM 2026 H HG13 . ILE 122 122 ? A 9.735 -4.276 -0.938 1.000 1 A 90.930 1 ATOM 2027 H HG21 . ILE 122 122 ? A 9.531 -3.698 2.318 1.000 1 A 90.930 1 ATOM 2028 H HG22 . ILE 122 122 ? A 10.027 -5.392 2.502 1.000 1 A 90.930 1 ATOM 2029 H HG23 . ILE 122 122 ? A 8.899 -4.919 1.209 1.000 1 A 90.930 1 ATOM 2030 H HD11 . ILE 122 122 ? A 9.478 -1.863 -1.153 1.000 1 A 90.930 1 ATOM 2031 H HD12 . ILE 122 122 ? A 10.518 -1.579 0.253 1.000 1 A 90.930 1 ATOM 2032 H HD13 . ILE 122 122 ? A 8.936 -2.375 0.445 1.000 1 A 90.930 1 ATOM 2033 N N . HIS 123 123 ? A 12.835 -3.684 3.882 1.000 1 A 86.160 1 ATOM 2034 C CA . HIS 123 123 ? A 13.253 -4.194 5.187 1.000 1 A 86.160 1 ATOM 2035 C C . HIS 123 123 ? A 12.617 -3.351 6.311 1.000 1 A 86.160 1 ATOM 2036 O O . HIS 123 123 ? A 12.111 -2.262 6.032 1.000 1 A 86.160 1 ATOM 2037 C CB . HIS 123 123 ? A 14.790 -4.181 5.263 1.000 1 A 86.160 1 ATOM 2038 C CG . HIS 123 123 ? A 15.408 -2.807 5.163 1.000 1 A 86.160 1 ATOM 2039 N ND1 . HIS 123 123 ? A 15.498 -1.866 6.166 1.000 1 A 86.160 1 ATOM 2040 C CD2 . HIS 123 123 ? A 15.972 -2.252 4.046 1.000 1 A 86.160 1 ATOM 2041 C CE1 . HIS 123 123 ? A 16.087 -0.771 5.663 1.000 1 A 86.160 1 ATOM 2042 N NE2 . HIS 123 123 ? A 16.401 -0.961 4.374 1.000 1 A 86.160 1 ATOM 2043 H H . HIS 123 123 ? A 12.677 -2.688 3.832 1.000 1 A 86.160 1 ATOM 2044 H HA . HIS 123 123 ? A 12.909 -5.224 5.288 1.000 1 A 86.160 1 ATOM 2045 H HB2 . HIS 123 123 ? A 15.118 -4.634 6.199 1.000 1 A 86.160 1 ATOM 2046 H HB3 . HIS 123 123 ? A 15.184 -4.800 4.457 1.000 1 A 86.160 1 ATOM 2047 H HD1 . HIS 123 123 ? A 15.117 -1.924 7.100 1.000 1 A 86.160 1 ATOM 2048 H HD2 . HIS 123 123 ? A 16.056 -2.725 3.079 1.000 1 A 86.160 1 ATOM 2049 H HE1 . HIS 123 123 ? A 16.250 0.148 6.207 1.000 1 A 86.160 1 ATOM 2050 N N . PRO 124 124 ? A 12.635 -3.809 7.579 1.000 1 A 79.140 1 ATOM 2051 C CA . PRO 124 124 ? A 12.209 -2.981 8.708 1.000 1 A 79.140 1 ATOM 2052 C C . PRO 124 124 ? A 12.969 -1.647 8.740 1.000 1 A 79.140 1 ATOM 2053 O O . PRO 124 124 ? A 14.198 -1.647 8.648 1.000 1 A 79.140 1 ATOM 2054 C CB . PRO 124 124 ? A 12.484 -3.825 9.959 1.000 1 A 79.140 1 ATOM 2055 C CG . PRO 124 124 ? A 12.437 -5.261 9.437 1.000 1 A 79.140 1 ATOM 2056 C CD . PRO 124 124 ? A 13.035 -5.131 8.039 1.000 1 A 79.140 1 ATOM 2057 H HA . PRO 124 124 ? A 11.139 -2.791 8.623 1.000 1 A 79.140 1 ATOM 2058 H HB2 . PRO 124 124 ? A 11.735 -3.651 10.732 1.000 1 A 79.140 1 ATOM 2059 H HB3 . PRO 124 124 ? A 13.482 -3.618 10.346 1.000 1 A 79.140 1 ATOM 2060 H HG2 . PRO 124 124 ? A 13.016 -5.940 10.064 1.000 1 A 79.140 1 ATOM 2061 H HG3 . PRO 124 124 ? A 11.401 -5.591 9.364 1.000 1 A 79.140 1 ATOM 2062 H HD2 . PRO 124 124 ? A 12.654 -5.920 7.391 1.000 1 A 79.140 1 ATOM 2063 H HD3 . PRO 124 124 ? A 14.122 -5.182 8.107 1.000 1 A 79.140 1 ATOM 2064 N N . GLY 125 125 ? A 12.254 -0.524 8.848 1.000 1 A 81.620 1 ATOM 2065 C CA . GLY 125 125 ? A 12.854 0.817 8.808 1.000 1 A 81.620 1 ATOM 2066 C C . GLY 125 125 ? A 13.165 1.334 7.398 1.000 1 A 81.620 1 ATOM 2067 O O . GLY 125 125 ? A 14.045 2.178 7.238 1.000 1 A 81.620 1 ATOM 2068 H H . GLY 125 125 ? A 11.246 -0.581 8.880 1.000 1 A 81.620 1 ATOM 2069 H HA2 . GLY 125 125 ? A 12.157 1.519 9.266 1.000 1 A 81.620 1 ATOM 2070 H HA3 . GLY 125 125 ? A 13.778 0.826 9.387 1.000 1 A 81.620 1 ATOM 2071 N N . THR 126 126 ? A 12.489 0.812 6.371 1.000 1 A 91.120 1 ATOM 2072 C CA . THR 126 126 ? A 12.591 1.346 5.006 1.000 1 A 91.120 1 ATOM 2073 C C . THR 126 126 ? A 11.960 2.741 4.887 1.000 1 A 91.120 1 ATOM 2074 O O . THR 126 126 ? A 11.169 3.162 5.728 1.000 1 A 91.120 1 ATOM 2075 C CB . THR 126 126 ? A 12.022 0.358 3.979 1.000 1 A 91.120 1 ATOM 2076 O OG1 . THR 126 126 ? A 12.422 0.782 2.700 1.000 1 A 91.120 1 ATOM 2077 C CG2 . THR 126 126 ? A 10.497 0.238 4.006 1.000 1 A 91.120 1 ATOM 2078 H H . THR 126 126 ? A 11.781 0.118 6.564 1.000 1 A 91.120 1 ATOM 2079 H HA . THR 126 126 ? A 13.651 1.457 4.780 1.000 1 A 91.120 1 ATOM 2080 H HB . THR 126 126 ? A 12.463 -0.622 4.158 1.000 1 A 91.120 1 ATOM 2081 H HG1 . THR 126 126 ? A 12.512 0.017 2.127 1.000 1 A 91.120 1 ATOM 2082 H HG21 . THR 126 126 ? A 10.163 -0.036 5.007 1.000 1 A 91.120 1 ATOM 2083 H HG22 . THR 126 126 ? A 10.179 -0.533 3.304 1.000 1 A 91.120 1 ATOM 2084 H HG23 . THR 126 126 ? A 10.040 1.188 3.730 1.000 1 A 91.120 1 ATOM 2085 N N . THR 127 127 ? A 12.314 3.480 3.836 1.000 1 A 91.370 1 ATOM 2086 C CA . THR 127 127 ? A 11.802 4.830 3.564 1.000 1 A 91.370 1 ATOM 2087 C C . THR 127 127 ? A 10.721 4.810 2.487 1.000 1 A 91.370 1 ATOM 2088 O O . THR 127 127 ? A 10.629 3.876 1.684 1.000 1 A 91.370 1 ATOM 2089 C CB . THR 127 127 ? A 12.929 5.799 3.164 1.000 1 A 91.370 1 ATOM 2090 O OG1 . THR 127 127 ? A 13.478 5.454 1.911 1.000 1 A 91.370 1 ATOM 2091 C CG2 . THR 127 127 ? A 14.068 5.835 4.182 1.000 1 A 91.370 1 ATOM 2092 H H . THR 127 127 ? A 12.883 3.042 3.125 1.000 1 A 91.370 1 ATOM 2093 H HA . THR 127 127 ? A 11.349 5.225 4.473 1.000 1 A 91.370 1 ATOM 2094 H HB . THR 127 127 ? A 12.511 6.803 3.088 1.000 1 A 91.370 1 ATOM 2095 H HG1 . THR 127 127 ? A 14.309 5.931 1.841 1.000 1 A 91.370 1 ATOM 2096 H HG21 . THR 127 127 ? A 13.669 6.050 5.173 1.000 1 A 91.370 1 ATOM 2097 H HG22 . THR 127 127 ? A 14.775 6.619 3.911 1.000 1 A 91.370 1 ATOM 2098 H HG23 . THR 127 127 ? A 14.590 4.879 4.208 1.000 1 A 91.370 1 ATOM 2099 N N . SER 128 128 ? A 9.926 5.883 2.405 1.000 1 A 92.790 1 ATOM 2100 C CA . SER 128 128 ? A 8.945 6.050 1.325 1.000 1 A 92.790 1 ATOM 2101 C C . SER 128 128 ? A 9.588 5.908 -0.059 1.000 1 A 92.790 1 ATOM 2102 O O . SER 128 128 ? A 9.063 5.200 -0.918 1.000 1 A 92.790 1 ATOM 2103 C CB . SER 128 128 ? A 8.293 7.431 1.385 1.000 1 A 92.790 1 ATOM 2104 O OG . SER 128 128 ? A 7.616 7.647 2.608 1.000 1 A 92.790 1 ATOM 2105 H H . SER 128 128 ? A 9.977 6.596 3.118 1.000 1 A 92.790 1 ATOM 2106 H HA . SER 128 128 ? A 8.179 5.283 1.437 1.000 1 A 92.790 1 ATOM 2107 H HB2 . SER 128 128 ? A 7.586 7.518 0.560 1.000 1 A 92.790 1 ATOM 2108 H HB3 . SER 128 128 ? A 9.057 8.199 1.263 1.000 1 A 92.790 1 ATOM 2109 H HG . SER 128 128 ? A 7.708 8.583 2.800 1.000 1 A 92.790 1 ATOM 2110 N N . SER 129 129 ? A 10.757 6.528 -0.255 1.000 1 A 90.770 1 ATOM 2111 C CA . SER 129 129 ? A 11.527 6.477 -1.502 1.000 1 A 90.770 1 ATOM 2112 C C . SER 129 129 ? A 11.870 5.046 -1.913 1.000 1 A 90.770 1 ATOM 2113 O O . SER 129 129 ? A 11.711 4.693 -3.081 1.000 1 A 90.770 1 ATOM 2114 C CB . SER 129 129 ? A 12.828 7.270 -1.336 1.000 1 A 90.770 1 ATOM 2115 O OG . SER 129 129 ? A 12.527 8.606 -0.995 1.000 1 A 90.770 1 ATOM 2116 H H . SER 129 129 ? A 11.115 7.129 0.473 1.000 1 A 90.770 1 ATOM 2117 H HA . SER 129 129 ? A 10.944 6.932 -2.301 1.000 1 A 90.770 1 ATOM 2118 H HB2 . SER 129 129 ? A 13.392 7.250 -2.269 1.000 1 A 90.770 1 ATOM 2119 H HB3 . SER 129 129 ? A 13.432 6.822 -0.547 1.000 1 A 90.770 1 ATOM 2120 H HG . SER 129 129 ? A 13.281 8.993 -0.544 1.000 1 A 90.770 1 ATOM 2121 N N . ASN 130 130 ? A 12.278 4.203 -0.963 1.000 1 A 92.160 1 ATOM 2122 C CA . ASN 130 130 ? A 12.622 2.809 -1.232 1.000 1 A 92.160 1 ATOM 2123 C C . ASN 130 130 ? A 11.398 1.965 -1.608 1.000 1 A 92.160 1 ATOM 2124 O O . ASN 130 130 ? A 11.486 1.154 -2.530 1.000 1 A 92.160 1 ATOM 2125 C CB . ASN 130 130 ? A 13.316 2.224 -0.002 1.000 1 A 92.160 1 ATOM 2126 C CG . ASN 130 130 ? A 14.758 2.649 0.165 1.000 1 A 92.160 1 ATOM 2127 O OD1 . ASN 130 130 ? A 15.370 3.246 -0.705 1.000 1 A 92.160 1 ATOM 2128 N ND2 . ASN 130 130 ? A 15.354 2.305 1.281 1.000 1 A 92.160 1 ATOM 2129 H H . ASN 130 130 ? A 12.367 4.538 -0.014 1.000 1 A 92.160 1 ATOM 2130 H HA . ASN 130 130 ? A 13.309 2.765 -2.077 1.000 1 A 92.160 1 ATOM 2131 H HB2 . ASN 130 130 ? A 12.760 2.505 0.893 1.000 1 A 92.160 1 ATOM 2132 H HB3 . ASN 130 130 ? A 13.319 1.137 -0.087 1.000 1 A 92.160 1 ATOM 2133 H HD21 . ASN 130 130 ? A 14.868 1.740 1.963 1.000 1 A 92.160 1 ATOM 2134 H HD22 . ASN 130 130 ? A 16.314 2.594 1.397 1.000 1 A 92.160 1 ATOM 2135 N N . ILE 131 131 ? A 10.248 2.176 -0.958 1.000 1 A 93.780 1 ATOM 2136 C CA . ILE 131 131 ? A 9.000 1.487 -1.328 1.000 1 A 93.780 1 ATOM 2137 C C . ILE 131 131 ? A 8.555 1.893 -2.734 1.000 1 A 93.780 1 ATOM 2138 O O . ILE 131 131 ? A 8.261 1.033 -3.566 1.000 1 A 93.780 1 ATOM 2139 C CB . ILE 131 131 ? A 7.884 1.736 -0.290 1.000 1 A 93.780 1 ATOM 2140 C CG1 . ILE 131 131 ? A 8.311 1.125 1.061 1.000 1 A 93.780 1 ATOM 2141 C CG2 . ILE 131 131 ? A 6.551 1.130 -0.779 1.000 1 A 93.780 1 ATOM 2142 C CD1 . ILE 131 131 ? A 7.231 1.169 2.142 1.000 1 A 93.780 1 ATOM 2143 H H . ILE 131 131 ? A 10.243 2.826 -0.186 1.000 1 A 93.780 1 ATOM 2144 H HA . ILE 131 131 ? A 9.196 0.415 -1.360 1.000 1 A 93.780 1 ATOM 2145 H HB . ILE 131 131 ? A 7.746 2.809 -0.162 1.000 1 A 93.780 1 ATOM 2146 H HG12 . ILE 131 131 ? A 9.178 1.667 1.437 1.000 1 A 93.780 1 ATOM 2147 H HG13 . ILE 131 131 ? A 8.601 0.084 0.918 1.000 1 A 93.780 1 ATOM 2148 H HG21 . ILE 131 131 ? A 6.228 1.582 -1.716 1.000 1 A 93.780 1 ATOM 2149 H HG22 . ILE 131 131 ? A 6.674 0.055 -0.915 1.000 1 A 93.780 1 ATOM 2150 H HG23 . ILE 131 131 ? A 5.754 1.310 -0.057 1.000 1 A 93.780 1 ATOM 2151 H HD11 . ILE 131 131 ? A 7.675 0.885 3.096 1.000 1 A 93.780 1 ATOM 2152 H HD12 . ILE 131 131 ? A 6.443 0.451 1.917 1.000 1 A 93.780 1 ATOM 2153 H HD13 . ILE 131 131 ? A 6.814 2.174 2.208 1.000 1 A 93.780 1 ATOM 2154 N N . ILE 132 132 ? A 8.552 3.196 -3.027 1.000 1 A 93.900 1 ATOM 2155 C CA . ILE 132 132 ? A 8.204 3.721 -4.354 1.000 1 A 93.900 1 ATOM 2156 C C . ILE 132 132 ? A 9.139 3.134 -5.410 1.000 1 A 93.900 1 ATOM 2157 O O . ILE 132 132 ? A 8.690 2.692 -6.467 1.000 1 A 93.900 1 ATOM 2158 C CB . ILE 132 132 ? A 8.262 5.265 -4.343 1.000 1 A 93.900 1 ATOM 2159 C CG1 . ILE 132 132 ? A 7.120 5.817 -3.462 1.000 1 A 93.900 1 ATOM 2160 C CG2 . ILE 132 132 ? A 8.168 5.834 -5.774 1.000 1 A 93.900 1 ATOM 2161 C CD1 . ILE 132 132 ? A 7.232 7.316 -3.158 1.000 1 A 93.900 1 ATOM 2162 H H . ILE 132 132 ? A 8.805 3.849 -2.300 1.000 1 A 93.900 1 ATOM 2163 H HA . ILE 132 132 ? A 7.191 3.411 -4.607 1.000 1 A 93.900 1 ATOM 2164 H HB . ILE 132 132 ? A 9.215 5.577 -3.915 1.000 1 A 93.900 1 ATOM 2165 H HG12 . ILE 132 132 ? A 6.164 5.618 -3.948 1.000 1 A 93.900 1 ATOM 2166 H HG13 . ILE 132 132 ? A 7.101 5.293 -2.506 1.000 1 A 93.900 1 ATOM 2167 H HG21 . ILE 132 132 ? A 8.131 6.923 -5.747 1.000 1 A 93.900 1 ATOM 2168 H HG22 . ILE 132 132 ? A 9.045 5.547 -6.354 1.000 1 A 93.900 1 ATOM 2169 H HG23 . ILE 132 132 ? A 7.267 5.455 -6.256 1.000 1 A 93.900 1 ATOM 2170 H HD11 . ILE 132 132 ? A 6.466 7.594 -2.435 1.000 1 A 93.900 1 ATOM 2171 H HD12 . ILE 132 132 ? A 8.211 7.537 -2.734 1.000 1 A 93.900 1 ATOM 2172 H HD13 . ILE 132 132 ? A 7.079 7.907 -4.061 1.000 1 A 93.900 1 ATOM 2173 N N . LEU 133 133 ? A 10.438 3.089 -5.120 1.000 1 A 92.470 1 ATOM 2174 C CA . LEU 133 133 ? A 11.431 2.522 -6.017 1.000 1 A 92.470 1 ATOM 2175 C C . LEU 133 133 ? A 11.240 1.017 -6.217 1.000 1 A 92.470 1 ATOM 2176 O O . LEU 133 133 ? A 11.323 0.545 -7.344 1.000 1 A 92.470 1 ATOM 2177 C CB . LEU 133 133 ? A 12.809 2.865 -5.457 1.000 1 A 92.470 1 ATOM 2178 C CG . LEU 133 133 ? A 13.982 2.470 -6.358 1.000 1 A 92.470 1 ATOM 2179 C CD1 . LEU 133 133 ? A 13.904 3.089 -7.758 1.000 1 A 92.470 1 ATOM 2180 C CD2 . LEU 133 133 ? A 15.238 2.981 -5.665 1.000 1 A 92.470 1 ATOM 2181 H H . LEU 133 133 ? A 10.754 3.489 -4.249 1.000 1 A 92.470 1 ATOM 2182 H HA . LEU 133 133 ? A 11.314 3.005 -6.987 1.000 1 A 92.470 1 ATOM 2183 H HB2 . LEU 133 133 ? A 12.934 2.381 -4.488 1.000 1 A 92.470 1 ATOM 2184 H HB3 . LEU 133 133 ? A 12.844 3.944 -5.303 1.000 1 A 92.470 1 ATOM 2185 H HG . LEU 133 133 ? A 14.041 1.385 -6.452 1.000 1 A 92.470 1 ATOM 2186 H HD11 . LEU 133 133 ? A 13.821 4.173 -7.684 1.000 1 A 92.470 1 ATOM 2187 H HD12 . LEU 133 133 ? A 14.803 2.836 -8.320 1.000 1 A 92.470 1 ATOM 2188 H HD13 . LEU 133 133 ? A 13.050 2.684 -8.302 1.000 1 A 92.470 1 ATOM 2189 H HD21 . LEU 133 133 ? A 15.081 3.975 -5.248 1.000 1 A 92.470 1 ATOM 2190 H HD22 . LEU 133 133 ? A 16.039 3.067 -6.398 1.000 1 A 92.470 1 ATOM 2191 H HD23 . LEU 133 133 ? A 15.526 2.304 -4.861 1.000 1 A 92.470 1 ATOM 2192 N N . CYS 134 134 ? A 10.913 0.270 -5.164 1.000 1 A 93.360 1 ATOM 2193 C CA . CYS 134 134 ? A 10.586 -1.151 -5.253 1.000 1 A 93.360 1 ATOM 2194 C C . CYS 134 134 ? A 9.411 -1.388 -6.212 1.000 1 A 93.360 1 ATOM 2195 O O . CYS 134 134 ? A 9.518 -2.189 -7.142 1.000 1 A 93.360 1 ATOM 2196 C CB . CYS 134 134 ? A 10.295 -1.657 -3.836 1.000 1 A 93.360 1 ATOM 2197 S SG . CYS 134 134 ? A 9.890 -3.420 -3.857 1.000 1 A 93.360 1 ATOM 2198 H H . CYS 134 134 ? A 10.882 0.709 -4.255 1.000 1 A 93.360 1 ATOM 2199 H HA . CYS 134 134 ? A 11.444 -1.694 -5.651 1.000 1 A 93.360 1 ATOM 2200 H HB2 . CYS 134 134 ? A 11.172 -1.498 -3.208 1.000 1 A 93.360 1 ATOM 2201 H HB3 . CYS 134 134 ? A 9.462 -1.104 -3.401 1.000 1 A 93.360 1 ATOM 2202 H HG . CYS 134 134 ? A 8.678 -3.318 -4.410 1.000 1 A 93.360 1 ATOM 2203 N N . LEU 135 135 ? A 8.319 -0.638 -6.050 1.000 1 A 93.880 1 ATOM 2204 C CA . LEU 135 135 ? A 7.160 -0.710 -6.946 1.000 1 A 93.880 1 ATOM 2205 C C . LEU 135 135 ? A 7.538 -0.338 -8.381 1.000 1 A 93.880 1 ATOM 2206 O O . LEU 135 135 ? A 7.221 -1.070 -9.321 1.000 1 A 93.880 1 ATOM 2207 C CB . LEU 135 135 ? A 6.061 0.225 -6.421 1.000 1 A 93.880 1 ATOM 2208 C CG . LEU 135 135 ? A 5.448 -0.241 -5.093 1.000 1 A 93.880 1 ATOM 2209 C CD1 . LEU 135 135 ? A 4.534 0.847 -4.541 1.000 1 A 93.880 1 ATOM 2210 C CD2 . LEU 135 135 ? A 4.632 -1.515 -5.276 1.000 1 A 93.880 1 ATOM 2211 H H . LEU 135 135 ? A 8.295 0.012 -5.277 1.000 1 A 93.880 1 ATOM 2212 H HA . LEU 135 135 ? A 6.788 -1.734 -6.974 1.000 1 A 93.880 1 ATOM 2213 H HB2 . LEU 135 135 ? A 6.480 1.222 -6.287 1.000 1 A 93.880 1 ATOM 2214 H HB3 . LEU 135 135 ? A 5.267 0.294 -7.165 1.000 1 A 93.880 1 ATOM 2215 H HG . LEU 135 135 ? A 6.232 -0.432 -4.360 1.000 1 A 93.880 1 ATOM 2216 H HD11 . LEU 135 135 ? A 5.095 1.772 -4.403 1.000 1 A 93.880 1 ATOM 2217 H HD12 . LEU 135 135 ? A 4.140 0.534 -3.574 1.000 1 A 93.880 1 ATOM 2218 H HD13 . LEU 135 135 ? A 3.703 1.016 -5.225 1.000 1 A 93.880 1 ATOM 2219 H HD21 . LEU 135 135 ? A 5.271 -2.365 -5.516 1.000 1 A 93.880 1 ATOM 2220 H HD22 . LEU 135 135 ? A 3.891 -1.387 -6.065 1.000 1 A 93.880 1 ATOM 2221 H HD23 . LEU 135 135 ? A 4.106 -1.724 -4.344 1.000 1 A 93.880 1 ATOM 2222 N N . LYS 136 136 ? A 8.290 0.756 -8.546 1.000 1 A 92.080 1 ATOM 2223 C CA . LYS 136 136 ? A 8.806 1.178 -9.847 1.000 1 A 92.080 1 ATOM 2224 C C . LYS 136 136 ? A 9.700 0.132 -10.481 1.000 1 A 92.080 1 ATOM 2225 O O . LYS 136 136 ? A 9.681 0.058 -11.691 1.000 1 A 92.080 1 ATOM 2226 C CB . LYS 136 136 ? A 9.590 2.489 -9.744 1.000 1 A 92.080 1 ATOM 2227 C CG . LYS 136 136 ? A 8.663 3.700 -9.639 1.000 1 A 92.080 1 ATOM 2228 C CD . LYS 136 136 ? A 9.501 4.978 -9.572 1.000 1 A 92.080 1 ATOM 2229 C CE . LYS 136 136 ? A 8.573 6.192 -9.517 1.000 1 A 92.080 1 ATOM 2230 N NZ . LYS 136 136 ? A 9.345 7.458 -9.555 1.000 1 A 92.080 1 ATOM 2231 H H . LYS 136 136 ? A 8.512 1.306 -7.729 1.000 1 A 92.080 1 ATOM 2232 H HA . LYS 136 136 ? A 7.968 1.319 -10.529 1.000 1 A 92.080 1 ATOM 2233 H HB2 . LYS 136 136 ? A 10.198 2.610 -10.640 1.000 1 A 92.080 1 ATOM 2234 H HB3 . LYS 136 136 ? A 10.259 2.452 -8.884 1.000 1 A 92.080 1 ATOM 2235 H HG2 . LYS 136 136 ? A 8.040 3.622 -8.747 1.000 1 A 92.080 1 ATOM 2236 H HG3 . LYS 136 136 ? A 8.020 3.737 -10.518 1.000 1 A 92.080 1 ATOM 2237 H HD2 . LYS 136 136 ? A 10.129 4.951 -8.681 1.000 1 A 92.080 1 ATOM 2238 H HD3 . LYS 136 136 ? A 10.134 5.038 -10.457 1.000 1 A 92.080 1 ATOM 2239 H HE2 . LYS 136 136 ? A 7.971 6.132 -8.611 1.000 1 A 92.080 1 ATOM 2240 H HE3 . LYS 136 136 ? A 7.888 6.142 -10.364 1.000 1 A 92.080 1 ATOM 2241 H HZ1 . LYS 136 136 ? A 9.957 7.525 -8.754 1.000 1 A 92.080 1 ATOM 2242 H HZ2 . LYS 136 136 ? A 8.718 8.249 -9.545 1.000 1 A 92.080 1 ATOM 2243 H HZ3 . LYS 136 136 ? A 9.905 7.504 -10.394 1.000 1 A 92.080 1 ATOM 2244 N N . LEU 137 137 ? A 10.461 -0.675 -9.756 1.000 1 A 92.550 1 ATOM 2245 C CA . LEU 137 137 ? A 11.343 -1.671 -10.373 1.000 1 A 92.550 1 ATOM 2246 C C . LEU 137 137 ? A 10.619 -2.977 -10.705 1.000 1 A 92.550 1 ATOM 2247 O O . LEU 137 137 ? A 10.905 -3.582 -11.741 1.000 1 A 92.550 1 ATOM 2248 C CB . LEU 137 137 ? A 12.557 -1.898 -9.463 1.000 1 A 92.550 1 ATOM 2249 C CG . LEU 137 137 ? A 13.519 -0.693 -9.420 1.000 1 A 92.550 1 ATOM 2250 C CD1 . LEU 137 137 ? A 14.624 -0.972 -8.407 1.000 1 A 92.550 1 ATOM 2251 C CD2 . LEU 137 137 ? A 14.148 -0.393 -10.780 1.000 1 A 92.550 1 ATOM 2252 H H . LEU 137 137 ? A 10.497 -0.536 -8.756 1.000 1 A 92.550 1 ATOM 2253 H HA . LEU 137 137 ? A 11.704 -1.291 -11.329 1.000 1 A 92.550 1 ATOM 2254 H HB2 . LEU 137 137 ? A 13.107 -2.769 -9.820 1.000 1 A 92.550 1 ATOM 2255 H HB3 . LEU 137 137 ? A 12.206 -2.119 -8.455 1.000 1 A 92.550 1 ATOM 2256 H HG . LEU 137 137 ? A 12.990 0.206 -9.105 1.000 1 A 92.550 1 ATOM 2257 H HD11 . LEU 137 137 ? A 14.165 -1.171 -7.439 1.000 1 A 92.550 1 ATOM 2258 H HD12 . LEU 137 137 ? A 15.270 -0.099 -8.318 1.000 1 A 92.550 1 ATOM 2259 H HD13 . LEU 137 137 ? A 15.216 -1.834 -8.713 1.000 1 A 92.550 1 ATOM 2260 H HD21 . LEU 137 137 ? A 14.498 -1.318 -11.238 1.000 1 A 92.550 1 ATOM 2261 H HD22 . LEU 137 137 ? A 13.415 0.076 -11.436 1.000 1 A 92.550 1 ATOM 2262 H HD23 . LEU 137 137 ? A 14.983 0.297 -10.659 1.000 1 A 92.550 1 ATOM 2263 N N . PHE 138 138 ? A 9.676 -3.396 -9.862 1.000 1 A 92.440 1 ATOM 2264 C CA . PHE 138 138 ? A 9.176 -4.767 -9.886 1.000 1 A 92.440 1 ATOM 2265 C C . PHE 138 138 ? A 7.718 -4.921 -10.333 1.000 1 A 92.440 1 ATOM 2266 O O . PHE 138 138 ? A 7.415 -5.949 -10.922 1.000 1 A 92.440 1 ATOM 2267 C CB . PHE 138 138 ? A 9.429 -5.382 -8.508 1.000 1 A 92.440 1 ATOM 2268 C CG . PHE 138 138 ? A 10.886 -5.444 -8.075 1.000 1 A 92.440 1 ATOM 2269 C CD1 . PHE 138 138 ? A 11.840 -6.104 -8.865 1.000 1 A 92.440 1 ATOM 2270 C CD2 . PHE 138 138 ? A 11.298 -4.846 -6.874 1.000 1 A 92.440 1 ATOM 2271 C CE1 . PHE 138 138 ? A 13.175 -6.221 -8.439 1.000 1 A 92.440 1 ATOM 2272 C CE2 . PHE 138 138 ? A 12.637 -4.927 -6.455 1.000 1 A 92.440 1 ATOM 2273 C CZ . PHE 138 138 ? A 13.574 -5.632 -7.227 1.000 1 A 92.440 1 ATOM 2274 H H . PHE 138 138 ? A 9.513 -2.853 -9.026 1.000 1 A 92.440 1 ATOM 2275 H HA . PHE 138 138 ? A 9.751 -5.351 -10.604 1.000 1 A 92.440 1 ATOM 2276 H HB2 . PHE 138 138 ? A 8.877 -4.785 -7.783 1.000 1 A 92.440 1 ATOM 2277 H HB3 . PHE 138 138 ? A 9.032 -6.397 -8.501 1.000 1 A 92.440 1 ATOM 2278 H HD1 . PHE 138 138 ? A 11.544 -6.488 -9.830 1.000 1 A 92.440 1 ATOM 2279 H HD2 . PHE 138 138 ? A 10.572 -4.328 -6.265 1.000 1 A 92.440 1 ATOM 2280 H HE1 . PHE 138 138 ? A 13.896 -6.739 -9.054 1.000 1 A 92.440 1 ATOM 2281 H HE2 . PHE 138 138 ? A 12.935 -4.467 -5.524 1.000 1 A 92.440 1 ATOM 2282 H HZ . PHE 138 138 ? A 14.598 -5.713 -6.893 1.000 1 A 92.440 1 ATOM 2283 N N . ASN 139 139 ? A 6.828 -3.939 -10.146 1.000 1 A 87.850 1 ATOM 2284 C CA . ASN 139 139 ? A 5.398 -4.143 -10.432 1.000 1 A 87.850 1 ATOM 2285 C C . ASN 139 139 ? A 5.104 -4.434 -11.919 1.000 1 A 87.850 1 ATOM 2286 O O . ASN 139 139 ? A 4.428 -5.403 -12.241 1.000 1 A 87.850 1 ATOM 2287 C CB . ASN 139 139 ? A 4.593 -2.947 -9.912 1.000 1 A 87.850 1 ATOM 2288 C CG . ASN 139 139 ? A 3.119 -3.270 -10.014 1.000 1 A 87.850 1 ATOM 2289 O OD1 . ASN 139 139 ? A 2.635 -4.167 -9.355 1.000 1 A 87.850 1 ATOM 2290 N ND2 . ASN 139 139 ? A 2.389 -2.639 -10.895 1.000 1 A 87.850 1 ATOM 2291 H H . ASN 139 139 ? A 7.109 -3.078 -9.698 1.000 1 A 87.850 1 ATOM 2292 H HA . ASN 139 139 ? A 5.066 -5.025 -9.884 1.000 1 A 87.850 1 ATOM 2293 H HB2 . ASN 139 139 ? A 4.816 -2.050 -10.490 1.000 1 A 87.850 1 ATOM 2294 H HB3 . ASN 139 139 ? A 4.818 -2.765 -8.861 1.000 1 A 87.850 1 ATOM 2295 H HD21 . ASN 139 139 ? A 2.800 -2.090 -11.636 1.000 1 A 87.850 1 ATOM 2296 H HD22 . ASN 139 139 ? A 1.426 -2.938 -10.948 1.000 1 A 87.850 1 ATOM 2297 N N . ASP 140 140 ? A 5.695 -3.662 -12.837 1.000 1 A 84.420 1 ATOM 2298 C CA . ASP 140 140 ? A 5.518 -3.870 -14.293 1.000 1 A 84.420 1 ATOM 2299 C C . ASP 140 140 ? A 6.590 -4.786 -14.894 1.000 1 A 84.420 1 ATOM 2300 O O . ASP 140 140 ? A 6.915 -4.704 -16.080 1.000 1 A 84.420 1 ATOM 2301 C CB . ASP 140 140 ? A 5.439 -2.551 -15.072 1.000 1 A 84.420 1 ATOM 2302 C CG . ASP 140 140 ? A 4.739 -1.454 -14.292 1.000 1 A 84.420 1 ATOM 2303 O OD1 . ASP 140 140 ? A 3.608 -1.674 -13.818 1.000 1 A 84.420 1 ATOM 2304 O OD2 . ASP 140 140 ? A 5.459 -0.455 -14.051 1.000 1 A 84.420 1 ATOM 2305 H H . ASP 140 140 ? A 6.095 -2.795 -12.508 1.000 1 A 84.420 1 ATOM 2306 H HA . ASP 140 140 ? A 4.559 -4.367 -14.440 1.000 1 A 84.420 1 ATOM 2307 H HB2 . ASP 140 140 ? A 4.911 -2.721 -16.010 1.000 1 A 84.420 1 ATOM 2308 H HB3 . ASP 140 140 ? A 6.449 -2.222 -15.315 1.000 1 A 84.420 1 ATOM 2309 N N . ASN 141 141 ? A 7.230 -5.602 -14.062 1.000 1 A 85.750 1 ATOM 2310 C CA . ASN 141 141 ? A 8.208 -6.571 -14.514 1.000 1 A 85.750 1 ATOM 2311 C C . ASN 141 141 ? A 7.845 -7.956 -13.968 1.000 1 A 85.750 1 ATOM 2312 O O . ASN 141 141 ? A 8.205 -8.290 -12.834 1.000 1 A 85.750 1 ATOM 2313 C CB . ASN 141 141 ? A 9.601 -6.097 -14.129 1.000 1 A 85.750 1 ATOM 2314 C CG . ASN 141 141 ? A 10.653 -6.947 -14.799 1.000 1 A 85.750 1 ATOM 2315 O OD1 . ASN 141 141 ? A 10.421 -8.005 -15.372 1.000 1 A 85.750 1 ATOM 2316 N ND2 . ASN 141 141 ? A 11.866 -6.502 -14.663 1.000 1 A 85.750 1 ATOM 2317 H H . ASN 141 141 ? A 6.915 -5.658 -13.104 1.000 1 A 85.750 1 ATOM 2318 H HA . ASN 141 141 ? A 8.201 -6.612 -15.604 1.000 1 A 85.750 1 ATOM 2319 H HB2 . ASN 141 141 ? A 9.730 -6.141 -13.047 1.000 1 A 85.750 1 ATOM 2320 H HB3 . ASN 141 141 ? A 9.734 -5.066 -14.457 1.000 1 A 85.750 1 ATOM 2321 H HD21 . ASN 141 141 ? A 12.623 -7.059 -15.033 1.000 1 A 85.750 1 ATOM 2322 H HD22 . ASN 141 141 ? A 12.020 -5.640 -14.161 1.000 1 A 85.750 1 ATOM 2323 N N . PRO 142 142 ? A 7.136 -8.778 -14.763 1.000 1 A 81.170 1 ATOM 2324 C CA . PRO 142 142 ? A 6.542 -10.006 -14.258 1.000 1 A 81.170 1 ATOM 2325 C C . PRO 142 142 ? A 7.594 -11.014 -13.794 1.000 1 A 81.170 1 ATOM 2326 O O . PRO 142 142 ? A 7.325 -11.775 -12.874 1.000 1 A 81.170 1 ATOM 2327 C CB . PRO 142 142 ? A 5.683 -10.546 -15.407 1.000 1 A 81.170 1 ATOM 2328 C CG . PRO 142 142 ? A 6.314 -9.942 -16.660 1.000 1 A 81.170 1 ATOM 2329 C CD . PRO 142 142 ? A 6.805 -8.584 -16.168 1.000 1 A 81.170 1 ATOM 2330 H HA . PRO 142 142 ? A 5.896 -9.779 -13.410 1.000 1 A 81.170 1 ATOM 2331 H HB2 . PRO 142 142 ? A 4.666 -10.170 -15.299 1.000 1 A 81.170 1 ATOM 2332 H HB3 . PRO 142 142 ? A 5.675 -11.636 -15.441 1.000 1 A 81.170 1 ATOM 2333 H HG2 . PRO 142 142 ? A 7.163 -10.548 -16.974 1.000 1 A 81.170 1 ATOM 2334 H HG3 . PRO 142 142 ? A 5.591 -9.842 -17.469 1.000 1 A 81.170 1 ATOM 2335 H HD2 . PRO 142 142 ? A 6.008 -7.845 -16.256 1.000 1 A 81.170 1 ATOM 2336 H HD3 . PRO 142 142 ? A 7.674 -8.279 -16.751 1.000 1 A 81.170 1 ATOM 2337 N N . PHE 143 143 ? A 8.804 -11.026 -14.367 1.000 1 A 86.210 1 ATOM 2338 C CA . PHE 143 143 ? A 9.803 -12.031 -14.000 1.000 1 A 86.210 1 ATOM 2339 C C . PHE 143 143 ? A 10.382 -11.822 -12.586 1.000 1 A 86.210 1 ATOM 2340 O O . PHE 143 143 ? A 10.306 -12.749 -11.777 1.000 1 A 86.210 1 ATOM 2341 C CB . PHE 143 143 ? A 10.863 -12.185 -15.099 1.000 1 A 86.210 1 ATOM 2342 C CG . PHE 143 143 ? A 12.017 -13.070 -14.676 1.000 1 A 86.210 1 ATOM 2343 C CD1 . PHE 143 143 ? A 13.237 -12.514 -14.247 1.000 1 A 86.210 1 ATOM 2344 C CD2 . PHE 143 143 ? A 11.850 -14.465 -14.682 1.000 1 A 86.210 1 ATOM 2345 C CE1 . PHE 143 143 ? A 14.284 -13.360 -13.842 1.000 1 A 86.210 1 ATOM 2346 C CE2 . PHE 143 143 ? A 12.898 -15.308 -14.275 1.000 1 A 86.210 1 ATOM 2347 C CZ . PHE 143 143 ? A 14.119 -14.754 -13.854 1.000 1 A 86.210 1 ATOM 2348 H H . PHE 143 143 ? A 9.033 -10.317 -15.049 1.000 1 A 86.210 1 ATOM 2349 H HA . PHE 143 143 ? A 9.285 -12.989 -13.948 1.000 1 A 86.210 1 ATOM 2350 H HB2 . PHE 143 143 ? A 10.385 -12.635 -15.969 1.000 1 A 86.210 1 ATOM 2351 H HB3 . PHE 143 143 ? A 11.239 -11.217 -15.432 1.000 1 A 86.210 1 ATOM 2352 H HD1 . PHE 143 143 ? A 13.376 -11.443 -14.246 1.000 1 A 86.210 1 ATOM 2353 H HD2 . PHE 143 143 ? A 10.910 -14.890 -15.004 1.000 1 A 86.210 1 ATOM 2354 H HE1 . PHE 143 143 ? A 15.230 -12.933 -13.541 1.000 1 A 86.210 1 ATOM 2355 H HE2 . PHE 143 143 ? A 12.763 -16.379 -14.299 1.000 1 A 86.210 1 ATOM 2356 H HZ . PHE 143 143 ? A 14.935 -15.395 -13.555 1.000 1 A 86.210 1 ATOM 2357 N N . PRO 144 144 ? A 10.934 -10.649 -12.225 1.000 1 A 84.510 1 ATOM 2358 C CA . PRO 144 144 ? A 11.365 -10.384 -10.861 1.000 1 A 84.510 1 ATOM 2359 C C . PRO 144 144 ? A 10.214 -10.400 -9.863 1.000 1 A 84.510 1 ATOM 2360 O O . PRO 144 144 ? A 10.406 -10.949 -8.782 1.000 1 A 84.510 1 ATOM 2361 C CB . PRO 144 144 ? A 12.019 -9.010 -10.895 1.000 1 A 84.510 1 ATOM 2362 C CG . PRO 144 144 ? A 12.497 -8.897 -12.329 1.000 1 A 84.510 1 ATOM 2363 C CD . PRO 144 144 ? A 11.328 -9.534 -13.056 1.000 1 A 84.510 1 ATOM 2364 H HA . PRO 144 144 ? A 12.100 -11.134 -10.569 1.000 1 A 84.510 1 ATOM 2365 H HB2 . PRO 144 144 ? A 12.832 -8.914 -10.176 1.000 1 A 84.510 1 ATOM 2366 H HB3 . PRO 144 144 ? A 11.244 -8.260 -10.736 1.000 1 A 84.510 1 ATOM 2367 H HG2 . PRO 144 144 ? A 13.386 -9.508 -12.484 1.000 1 A 84.510 1 ATOM 2368 H HG3 . PRO 144 144 ? A 12.665 -7.858 -12.612 1.000 1 A 84.510 1 ATOM 2369 H HD2 . PRO 144 144 ? A 11.647 -9.819 -14.059 1.000 1 A 84.510 1 ATOM 2370 H HD3 . PRO 144 144 ? A 10.499 -8.827 -13.089 1.000 1 A 84.510 1 ATOM 2371 N N . ALA 145 145 ? A 9.036 -9.866 -10.222 1.000 1 A 84.100 1 ATOM 2372 C CA . ALA 145 145 ? A 7.849 -9.948 -9.373 1.000 1 A 84.100 1 ATOM 2373 C C . ALA 145 145 ? A 7.521 -11.407 -9.043 1.000 1 A 84.100 1 ATOM 2374 O O . ALA 145 145 ? A 7.461 -11.761 -7.870 1.000 1 A 84.100 1 ATOM 2375 C CB . ALA 145 145 ? A 6.665 -9.264 -10.062 1.000 1 A 84.100 1 ATOM 2376 H H . ALA 145 145 ? A 8.933 -9.416 -11.121 1.000 1 A 84.100 1 ATOM 2377 H HA . ALA 145 145 ? A 8.046 -9.431 -8.434 1.000 1 A 84.100 1 ATOM 2378 H HB1 . ALA 145 145 ? A 5.780 -9.334 -9.429 1.000 1 A 84.100 1 ATOM 2379 H HB2 . ALA 145 145 ? A 6.890 -8.210 -10.225 1.000 1 A 84.100 1 ATOM 2380 H HB3 . ALA 145 145 ? A 6.452 -9.737 -11.021 1.000 1 A 84.100 1 ATOM 2381 N N . TYR 146 146 ? A 7.442 -12.274 -10.056 1.000 1 A 87.590 1 ATOM 2382 C CA . TYR 146 146 ? A 7.233 -13.710 -9.881 1.000 1 A 87.590 1 ATOM 2383 C C . TYR 146 146 ? A 8.311 -14.360 -9.007 1.000 1 A 87.590 1 ATOM 2384 O O . TYR 146 146 ? A 7.997 -15.179 -8.147 1.000 1 A 87.590 1 ATOM 2385 C CB . TYR 146 146 ? A 7.206 -14.386 -11.257 1.000 1 A 87.590 1 ATOM 2386 C CG . TYR 146 146 ? A 7.273 -15.896 -11.185 1.000 1 A 87.590 1 ATOM 2387 C CD1 . TYR 146 146 ? A 8.448 -16.574 -11.569 1.000 1 A 87.590 1 ATOM 2388 C CD2 . TYR 146 146 ? A 6.171 -16.612 -10.689 1.000 1 A 87.590 1 ATOM 2389 C CE1 . TYR 146 146 ? A 8.505 -17.978 -11.485 1.000 1 A 87.590 1 ATOM 2390 C CE2 . TYR 146 146 ? A 6.240 -18.010 -10.560 1.000 1 A 87.590 1 ATOM 2391 C CZ . TYR 146 146 ? A 7.402 -18.694 -10.968 1.000 1 A 87.590 1 ATOM 2392 O OH . TYR 146 146 ? A 7.467 -20.049 -10.877 1.000 1 A 87.590 1 ATOM 2393 H H . TYR 146 146 ? A 7.445 -11.919 -11.001 1.000 1 A 87.590 1 ATOM 2394 H HA . TYR 146 146 ? A 6.268 -13.872 -9.401 1.000 1 A 87.590 1 ATOM 2395 H HB2 . TYR 146 146 ? A 6.289 -14.098 -11.773 1.000 1 A 87.590 1 ATOM 2396 H HB3 . TYR 146 146 ? A 8.049 -14.034 -11.852 1.000 1 A 87.590 1 ATOM 2397 H HD1 . TYR 146 146 ? A 9.279 -16.005 -11.959 1.000 1 A 87.590 1 ATOM 2398 H HD2 . TYR 146 146 ? A 5.275 -16.082 -10.401 1.000 1 A 87.590 1 ATOM 2399 H HE1 . TYR 146 146 ? A 9.378 -18.505 -11.841 1.000 1 A 87.590 1 ATOM 2400 H HE2 . TYR 146 146 ? A 5.390 -18.559 -10.181 1.000 1 A 87.590 1 ATOM 2401 H HH . TYR 146 146 ? A 7.945 -20.432 -11.616 1.000 1 A 87.590 1 ATOM 2402 N N . VAL 147 147 ? A 9.593 -14.016 -9.194 1.000 1 A 88.370 1 ATOM 2403 C CA . VAL 147 147 ? A 10.672 -14.545 -8.344 1.000 1 A 88.370 1 ATOM 2404 C C . VAL 147 147 ? A 10.459 -14.127 -6.893 1.000 1 A 88.370 1 ATOM 2405 O O . VAL 147 147 ? A 10.422 -15.004 -6.038 1.000 1 A 88.370 1 ATOM 2406 C CB . VAL 147 147 ? A 12.072 -14.142 -8.847 1.000 1 A 88.370 1 ATOM 2407 C CG1 . VAL 147 147 ? A 13.190 -14.496 -7.852 1.000 1 A 88.370 1 ATOM 2408 C CG2 . VAL 147 147 ? A 12.401 -14.880 -10.153 1.000 1 A 88.370 1 ATOM 2409 H H . VAL 147 147 ? A 9.800 -13.339 -9.915 1.000 1 A 88.370 1 ATOM 2410 H HA . VAL 147 147 ? A 10.606 -15.633 -8.354 1.000 1 A 88.370 1 ATOM 2411 H HB . VAL 147 147 ? A 12.100 -13.068 -9.034 1.000 1 A 88.370 1 ATOM 2412 H HG11 . VAL 147 147 ? A 13.099 -13.876 -6.959 1.000 1 A 88.370 1 ATOM 2413 H HG12 . VAL 147 147 ? A 14.165 -14.291 -8.294 1.000 1 A 88.370 1 ATOM 2414 H HG13 . VAL 147 147 ? A 13.124 -15.543 -7.555 1.000 1 A 88.370 1 ATOM 2415 H HG21 . VAL 147 147 ? A 13.349 -14.518 -10.552 1.000 1 A 88.370 1 ATOM 2416 H HG22 . VAL 147 147 ? A 12.456 -15.954 -9.977 1.000 1 A 88.370 1 ATOM 2417 H HG23 . VAL 147 147 ? A 11.628 -14.684 -10.896 1.000 1 A 88.370 1 ATOM 2418 N N . ILE 148 148 ? A 10.278 -12.831 -6.626 1.000 1 A 88.560 1 ATOM 2419 C CA . ILE 148 148 ? A 10.050 -12.298 -5.278 1.000 1 A 88.560 1 ATOM 2420 C C . ILE 148 148 ? A 8.850 -12.993 -4.656 1.000 1 A 88.560 1 ATOM 2421 O O . ILE 148 148 ? A 8.980 -13.608 -3.602 1.000 1 A 88.560 1 ATOM 2422 C CB . ILE 148 148 ? A 9.849 -10.767 -5.320 1.000 1 A 88.560 1 ATOM 2423 C CG1 . ILE 148 148 ? A 11.166 -10.067 -5.717 1.000 1 A 88.560 1 ATOM 2424 C CG2 . ILE 148 148 ? A 9.361 -10.225 -3.962 1.000 1 A 88.560 1 ATOM 2425 C CD1 . ILE 148 148 ? A 10.941 -8.664 -6.293 1.000 1 A 88.560 1 ATOM 2426 H H . ILE 148 148 ? A 10.242 -12.181 -7.399 1.000 1 A 88.560 1 ATOM 2427 H HA . ILE 148 148 ? A 10.912 -12.522 -4.649 1.000 1 A 88.560 1 ATOM 2428 H HB . ILE 148 148 ? A 9.092 -10.539 -6.070 1.000 1 A 88.560 1 ATOM 2429 H HG12 . ILE 148 148 ? A 11.825 -10.007 -4.850 1.000 1 A 88.560 1 ATOM 2430 H HG13 . ILE 148 148 ? A 11.683 -10.649 -6.480 1.000 1 A 88.560 1 ATOM 2431 H HG21 . ILE 148 148 ? A 8.366 -10.605 -3.729 1.000 1 A 88.560 1 ATOM 2432 H HG22 . ILE 148 148 ? A 9.286 -9.138 -3.994 1.000 1 A 88.560 1 ATOM 2433 H HG23 . ILE 148 148 ? A 10.053 -10.507 -3.169 1.000 1 A 88.560 1 ATOM 2434 H HD11 . ILE 148 148 ? A 10.347 -8.729 -7.205 1.000 1 A 88.560 1 ATOM 2435 H HD12 . ILE 148 148 ? A 10.416 -8.027 -5.583 1.000 1 A 88.560 1 ATOM 2436 H HD13 . ILE 148 148 ? A 11.904 -8.214 -6.535 1.000 1 A 88.560 1 ATOM 2437 N N . ILE 149 149 ? A 7.709 -12.960 -5.340 1.000 1 A 86.790 1 ATOM 2438 C CA . ILE 149 149 ? A 6.470 -13.546 -4.852 1.000 1 A 86.790 1 ATOM 2439 C C . ILE 149 149 ? A 6.675 -15.013 -4.596 1.000 1 A 86.790 1 ATOM 2440 O O . ILE 149 149 ? A 6.344 -15.425 -3.508 1.000 1 A 86.790 1 ATOM 2441 C CB . ILE 149 149 ? A 5.314 -13.308 -5.822 1.000 1 A 86.790 1 ATOM 2442 C CG1 . ILE 149 149 ? A 5.025 -11.800 -5.771 1.000 1 A 86.790 1 ATOM 2443 C CG2 . ILE 149 149 ? A 4.046 -14.117 -5.474 1.000 1 A 86.790 1 ATOM 2444 C CD1 . ILE 149 149 ? A 4.309 -11.392 -7.027 1.000 1 A 86.790 1 ATOM 2445 H H . ILE 149 149 ? A 7.687 -12.473 -6.226 1.000 1 A 86.790 1 ATOM 2446 H HA . ILE 149 149 ? A 6.217 -13.085 -3.897 1.000 1 A 86.790 1 ATOM 2447 H HB . ILE 149 149 ? A 5.645 -13.603 -6.818 1.000 1 A 86.790 1 ATOM 2448 H HG12 . ILE 149 149 ? A 4.424 -11.547 -4.898 1.000 1 A 86.790 1 ATOM 2449 H HG13 . ILE 149 149 ? A 5.944 -11.216 -5.727 1.000 1 A 86.790 1 ATOM 2450 H HG21 . ILE 149 149 ? A 3.721 -13.892 -4.459 1.000 1 A 86.790 1 ATOM 2451 H HG22 . ILE 149 149 ? A 3.246 -13.857 -6.168 1.000 1 A 86.790 1 ATOM 2452 H HG23 . ILE 149 149 ? A 4.239 -15.185 -5.579 1.000 1 A 86.790 1 ATOM 2453 H HD11 . ILE 149 149 ? A 4.747 -11.898 -7.888 1.000 1 A 86.790 1 ATOM 2454 H HD12 . ILE 149 149 ? A 3.257 -11.653 -6.916 1.000 1 A 86.790 1 ATOM 2455 H HD13 . ILE 149 149 ? A 4.456 -10.320 -7.157 1.000 1 A 86.790 1 ATOM 2456 N N . ARG 150 150 ? A 7.284 -15.803 -5.482 1.000 1 A 88.850 1 ATOM 2457 C CA . ARG 150 150 ? A 7.535 -17.220 -5.193 1.000 1 A 88.850 1 ATOM 2458 C C . ARG 150 150 ? A 8.343 -17.422 -3.905 1.000 1 A 88.850 1 ATOM 2459 O O . ARG 150 150 ? A 8.016 -18.328 -3.146 1.000 1 A 88.850 1 ATOM 2460 C CB . ARG 150 150 ? A 8.215 -17.887 -6.392 1.000 1 A 88.850 1 ATOM 2461 C CG . ARG 150 150 ? A 8.232 -19.415 -6.210 1.000 1 A 88.850 1 ATOM 2462 C CD . ARG 150 150 ? A 9.007 -20.118 -7.320 1.000 1 A 88.850 1 ATOM 2463 N NE . ARG 150 150 ? A 10.447 -19.818 -7.203 1.000 1 A 88.850 1 ATOM 2464 C CZ . ARG 150 150 ? A 11.228 -19.422 -8.172 1.000 1 A 88.850 1 ATOM 2465 N NH1 . ARG 150 150 ? A 10.873 -19.525 -9.426 1.000 1 A 88.850 1 ATOM 2466 N NH2 . ARG 150 150 ? A 12.374 -18.883 -7.870 1.000 1 A 88.850 1 ATOM 2467 H H . ARG 150 150 ? A 7.566 -15.415 -6.371 1.000 1 A 88.850 1 ATOM 2468 H HA . ARG 150 150 ? A 6.572 -17.701 -5.022 1.000 1 A 88.850 1 ATOM 2469 H HB2 . ARG 150 150 ? A 9.229 -17.499 -6.489 1.000 1 A 88.850 1 ATOM 2470 H HB3 . ARG 150 150 ? A 7.659 -17.654 -7.299 1.000 1 A 88.850 1 ATOM 2471 H HG2 . ARG 150 150 ? A 8.687 -19.685 -5.257 1.000 1 A 88.850 1 ATOM 2472 H HG3 . ARG 150 150 ? A 7.205 -19.780 -6.214 1.000 1 A 88.850 1 ATOM 2473 H HD2 . ARG 150 150 ? A 8.855 -21.193 -7.219 1.000 1 A 88.850 1 ATOM 2474 H HD3 . ARG 150 150 ? A 8.592 -19.797 -8.275 1.000 1 A 88.850 1 ATOM 2475 H HE . ARG 150 150 ? A 10.799 -19.688 -6.266 1.000 1 A 88.850 1 ATOM 2476 H HH11 . ARG 150 150 ? A 9.930 -19.862 -9.562 1.000 1 A 88.850 1 ATOM 2477 H HH12 . ARG 150 150 ? A 11.244 -18.877 -10.106 1.000 1 A 88.850 1 ATOM 2478 H HH21 . ARG 150 150 ? A 12.589 -18.017 -8.343 1.000 1 A 88.850 1 ATOM 2479 H HH22 . ARG 150 150 ? A 12.535 -18.808 -6.876 1.000 1 A 88.850 1 ATOM 2480 N N . GLU 151 151 ? A 9.360 -16.600 -3.647 1.000 1 A 89.010 1 ATOM 2481 C CA . GLU 151 151 ? A 10.196 -16.729 -2.445 1.000 1 A 89.010 1 ATOM 2482 C C . GLU 151 151 ? A 9.495 -16.240 -1.162 1.000 1 A 89.010 1 ATOM 2483 O O . GLU 151 151 ? A 9.707 -16.812 -0.095 1.000 1 A 89.010 1 ATOM 2484 C CB . GLU 151 151 ? A 11.531 -15.985 -2.625 1.000 1 A 89.010 1 ATOM 2485 C CG . GLU 151 151 ? A 12.443 -16.430 -3.789 1.000 1 A 89.010 1 ATOM 2486 C CD . GLU 151 151 ? A 12.683 -17.937 -3.927 1.000 1 A 89.010 1 ATOM 2487 O OE1 . GLU 151 151 ? A 12.691 -18.438 -5.094 1.000 1 A 89.010 1 ATOM 2488 O OE2 . GLU 151 151 ? A 12.928 -18.577 -2.886 1.000 1 A 89.010 1 ATOM 2489 H H . GLU 151 151 ? A 9.555 -15.852 -4.298 1.000 1 A 89.010 1 ATOM 2490 H HA . GLU 151 151 ? A 10.425 -17.782 -2.281 1.000 1 A 89.010 1 ATOM 2491 H HB2 . GLU 151 151 ? A 12.100 -16.095 -1.702 1.000 1 A 89.010 1 ATOM 2492 H HB3 . GLU 151 151 ? A 11.318 -14.923 -2.747 1.000 1 A 89.010 1 ATOM 2493 H HG2 . GLU 151 151 ? A 12.050 -16.056 -4.735 1.000 1 A 89.010 1 ATOM 2494 H HG3 . GLU 151 151 ? A 13.414 -15.955 -3.652 1.000 1 A 89.010 1 ATOM 2495 N N . ILE 152 152 ? A 8.646 -15.206 -1.238 1.000 1 A 84.190 1 ATOM 2496 C CA . ILE 152 152 ? A 7.939 -14.646 -0.068 1.000 1 A 84.190 1 ATOM 2497 C C . ILE 152 152 ? A 6.426 -14.905 -0.076 1.000 1 A 84.190 1 ATOM 2498 O O . ILE 152 152 ? A 5.705 -14.322 0.736 1.000 1 A 84.190 1 ATOM 2499 C CB . ILE 152 152 ? A 8.321 -13.172 0.211 1.000 1 A 84.190 1 ATOM 2500 C CG1 . ILE 152 152 ? A 7.830 -12.194 -0.874 1.000 1 A 84.190 1 ATOM 2501 C CG2 . ILE 152 152 ? A 9.843 -13.055 0.416 1.000 1 A 84.190 1 ATOM 2502 C CD1 . ILE 152 152 ? A 7.910 -10.722 -0.460 1.000 1 A 84.190 1 ATOM 2503 H H . ILE 152 152 ? A 8.544 -14.747 -2.132 1.000 1 A 84.190 1 ATOM 2504 H HA . ILE 152 152 ? A 8.279 -15.193 0.811 1.000 1 A 84.190 1 ATOM 2505 H HB . ILE 152 152 ? A 7.847 -12.890 1.152 1.000 1 A 84.190 1 ATOM 2506 H HG12 . ILE 152 152 ? A 8.451 -12.300 -1.763 1.000 1 A 84.190 1 ATOM 2507 H HG13 . ILE 152 152 ? A 6.799 -12.429 -1.139 1.000 1 A 84.190 1 ATOM 2508 H HG21 . ILE 152 152 ? A 10.184 -13.821 1.113 1.000 1 A 84.190 1 ATOM 2509 H HG22 . ILE 152 152 ? A 10.097 -12.075 0.822 1.000 1 A 84.190 1 ATOM 2510 H HG23 . ILE 152 152 ? A 10.358 -13.191 -0.535 1.000 1 A 84.190 1 ATOM 2511 H HD11 . ILE 152 152 ? A 7.288 -10.545 0.417 1.000 1 A 84.190 1 ATOM 2512 H HD12 . ILE 152 152 ? A 8.943 -10.459 -0.232 1.000 1 A 84.190 1 ATOM 2513 H HD13 . ILE 152 152 ? A 7.570 -10.089 -1.279 1.000 1 A 84.190 1 ATOM 2514 N N . ARG 153 153 ? A 5.933 -15.802 -0.945 1.000 1 A 83.770 1 ATOM 2515 C CA . ARG 153 153 ? A 4.494 -16.007 -1.207 1.000 1 A 83.770 1 ATOM 2516 C C . ARG 153 153 ? A 3.787 -16.380 0.062 1.000 1 A 83.770 1 ATOM 2517 O O . ARG 153 153 ? A 2.769 -15.790 0.373 1.000 1 A 83.770 1 ATOM 2518 C CB . ARG 153 153 ? A 4.197 -17.119 -2.243 1.000 1 A 83.770 1 ATOM 2519 C CG . ARG 153 153 ? A 2.742 -17.023 -2.727 1.000 1 A 83.770 1 ATOM 2520 C CD . ARG 153 153 ? A 2.482 -18.005 -3.874 1.000 1 A 83.770 1 ATOM 2521 N NE . ARG 153 153 ? A 1.066 -17.980 -4.292 1.000 1 A 83.770 1 ATOM 2522 C CZ . ARG 153 153 ? A 0.523 -17.236 -5.246 1.000 1 A 83.770 1 ATOM 2523 N NH1 . ARG 153 153 ? A 1.224 -16.399 -5.961 1.000 1 A 83.770 1 ATOM 2524 N NH2 . ARG 153 153 ? A -0.753 -17.334 -5.500 1.000 1 A 83.770 1 ATOM 2525 H H . ARG 153 153 ? A 6.576 -16.149 -1.642 1.000 1 A 83.770 1 ATOM 2526 H HA . ARG 153 153 ? A 4.075 -15.065 -1.560 1.000 1 A 83.770 1 ATOM 2527 H HB2 . ARG 153 153 ? A 4.839 -17.068 -3.122 1.000 1 A 83.770 1 ATOM 2528 H HB3 . ARG 153 153 ? A 4.367 -18.100 -1.800 1.000 1 A 83.770 1 ATOM 2529 H HG2 . ARG 153 153 ? A 2.541 -16.011 -3.079 1.000 1 A 83.770 1 ATOM 2530 H HG3 . ARG 153 153 ? A 2.065 -17.250 -1.904 1.000 1 A 83.770 1 ATOM 2531 H HD2 . ARG 153 153 ? A 2.731 -19.012 -3.538 1.000 1 A 83.770 1 ATOM 2532 H HD3 . ARG 153 153 ? A 3.130 -17.762 -4.715 1.000 1 A 83.770 1 ATOM 2533 H HE . ARG 153 153 ? A 0.431 -18.594 -3.802 1.000 1 A 83.770 1 ATOM 2534 H HH11 . ARG 153 153 ? A 2.204 -16.243 -5.773 1.000 1 A 83.770 1 ATOM 2535 H HH12 . ARG 153 153 ? A 0.802 -15.835 -6.685 1.000 1 A 83.770 1 ATOM 2536 H HH21 . ARG 153 153 ? A -1.363 -17.937 -4.967 1.000 1 A 83.770 1 ATOM 2537 H HH22 . ARG 153 153 ? A -1.172 -16.740 -6.201 1.000 1 A 83.770 1 ATOM 2538 N N . SER 154 154 ? A 4.342 -17.335 0.800 1.000 1 A 82.460 1 ATOM 2539 C CA . SER 154 154 ? A 3.766 -17.796 2.057 1.000 1 A 82.460 1 ATOM 2540 C C . SER 154 154 ? A 3.636 -16.641 3.046 1.000 1 A 82.460 1 ATOM 2541 O O . SER 154 154 ? A 2.586 -16.480 3.653 1.000 1 A 82.460 1 ATOM 2542 C CB . SER 154 154 ? A 4.625 -18.920 2.638 1.000 1 A 82.460 1 ATOM 2543 O OG . SER 154 154 ? A 4.732 -19.961 1.687 1.000 1 A 82.460 1 ATOM 2544 H H . SER 154 154 ? A 5.151 -17.816 0.434 1.000 1 A 82.460 1 ATOM 2545 H HA . SER 154 154 ? A 2.768 -18.191 1.867 1.000 1 A 82.460 1 ATOM 2546 H HB2 . SER 154 154 ? A 5.619 -18.539 2.875 1.000 1 A 82.460 1 ATOM 2547 H HB3 . SER 154 154 ? A 4.160 -19.299 3.548 1.000 1 A 82.460 1 ATOM 2548 H HG . SER 154 154 ? A 5.301 -20.653 2.031 1.000 1 A 82.460 1 ATOM 2549 N N . SER 155 155 ? A 4.654 -15.786 3.165 1.000 1 A 82.410 1 ATOM 2550 C CA . SER 155 155 ? A 4.624 -14.622 4.057 1.000 1 A 82.410 1 ATOM 2551 C C . SER 155 155 ? A 3.586 -13.584 3.626 1.000 1 A 82.410 1 ATOM 2552 O O . SER 155 155 ? A 2.849 -13.080 4.472 1.000 1 A 82.410 1 ATOM 2553 C CB . SER 155 155 ? A 6.006 -13.967 4.118 1.000 1 A 82.410 1 ATOM 2554 O OG . SER 155 155 ? A 6.964 -14.915 4.546 1.000 1 A 82.410 1 ATOM 2555 H H . SER 155 155 ? A 5.484 -15.927 2.606 1.000 1 A 82.410 1 ATOM 2556 H HA . SER 155 155 ? A 4.363 -14.956 5.061 1.000 1 A 82.410 1 ATOM 2557 H HB2 . SER 155 155 ? A 5.980 -13.134 4.820 1.000 1 A 82.410 1 ATOM 2558 H HB3 . SER 155 155 ? A 6.281 -13.590 3.132 1.000 1 A 82.410 1 ATOM 2559 H HG . SER 155 155 ? A 7.842 -14.531 4.487 1.000 1 A 82.410 1 ATOM 2560 N N . ILE 156 156 ? A 3.500 -13.281 2.325 1.000 1 A 81.430 1 ATOM 2561 C CA . ILE 156 156 ? A 2.472 -12.388 1.769 1.000 1 A 81.430 1 ATOM 2562 C C . ILE 156 156 ? A 1.089 -12.995 2.001 1.000 1 A 81.430 1 ATOM 2563 O O . ILE 156 156 ? A 0.234 -12.359 2.604 1.000 1 A 81.430 1 ATOM 2564 C CB . ILE 156 156 ? A 2.713 -12.107 0.264 1.000 1 A 81.430 1 ATOM 2565 C CG1 . ILE 156 156 ? A 4.041 -11.352 0.051 1.000 1 A 81.430 1 ATOM 2566 C CG2 . ILE 156 156 ? A 1.539 -11.291 -0.317 1.000 1 A 81.430 1 ATOM 2567 C CD1 . ILE 156 156 ? A 4.382 -11.071 -1.419 1.000 1 A 81.430 1 ATOM 2568 H H . ILE 156 156 ? A 4.138 -13.731 1.684 1.000 1 A 81.430 1 ATOM 2569 H HA . ILE 156 156 ? A 2.501 -11.437 2.302 1.000 1 A 81.430 1 ATOM 2570 H HB . ILE 156 156 ? A 2.766 -13.056 -0.269 1.000 1 A 81.430 1 ATOM 2571 H HG12 . ILE 156 156 ? A 3.987 -10.398 0.575 1.000 1 A 81.430 1 ATOM 2572 H HG13 . ILE 156 156 ? A 4.865 -11.921 0.483 1.000 1 A 81.430 1 ATOM 2573 H HG21 . ILE 156 156 ? A 1.670 -11.121 -1.386 1.000 1 A 81.430 1 ATOM 2574 H HG22 . ILE 156 156 ? A 0.600 -11.836 -0.220 1.000 1 A 81.430 1 ATOM 2575 H HG23 . ILE 156 156 ? A 1.450 -10.329 0.187 1.000 1 A 81.430 1 ATOM 2576 H HD11 . ILE 156 156 ? A 3.653 -10.397 -1.869 1.000 1 A 81.430 1 ATOM 2577 H HD12 . ILE 156 156 ? A 5.350 -10.574 -1.481 1.000 1 A 81.430 1 ATOM 2578 H HD13 . ILE 156 156 ? A 4.416 -12.004 -1.982 1.000 1 A 81.430 1 ATOM 2579 N N . TYR 157 157 ? A 0.891 -14.244 1.590 1.000 1 A 81.800 1 ATOM 2580 C CA . TYR 157 157 ? A -0.361 -14.977 1.707 1.000 1 A 81.800 1 ATOM 2581 C C . TYR 157 157 ? A -0.844 -15.026 3.151 1.000 1 A 81.800 1 ATOM 2582 O O . TYR 157 157 ? A -1.991 -14.700 3.402 1.000 1 A 81.800 1 ATOM 2583 C CB . TYR 157 157 ? A -0.185 -16.394 1.151 1.000 1 A 81.800 1 ATOM 2584 C CG . TYR 157 157 ? A -1.439 -17.233 1.265 1.000 1 A 81.800 1 ATOM 2585 C CD1 . TYR 157 157 ? A -1.580 -18.157 2.320 1.000 1 A 81.800 1 ATOM 2586 C CD2 . TYR 157 157 ? A -2.476 -17.063 0.329 1.000 1 A 81.800 1 ATOM 2587 C CE1 . TYR 157 157 ? A -2.747 -18.938 2.416 1.000 1 A 81.800 1 ATOM 2588 C CE2 . TYR 157 157 ? A -3.655 -17.821 0.441 1.000 1 A 81.800 1 ATOM 2589 C CZ . TYR 157 157 ? A -3.789 -18.766 1.476 1.000 1 A 81.800 1 ATOM 2590 O OH . TYR 157 157 ? A -4.912 -19.523 1.546 1.000 1 A 81.800 1 ATOM 2591 H H . TYR 157 157 ? A 1.653 -14.708 1.116 1.000 1 A 81.800 1 ATOM 2592 H HA . TYR 157 157 ? A -1.125 -14.467 1.121 1.000 1 A 81.800 1 ATOM 2593 H HB2 . TYR 157 157 ? A 0.094 -16.328 0.099 1.000 1 A 81.800 1 ATOM 2594 H HB3 . TYR 157 157 ? A 0.625 -16.894 1.681 1.000 1 A 81.800 1 ATOM 2595 H HD1 . TYR 157 157 ? A -0.788 -18.277 3.044 1.000 1 A 81.800 1 ATOM 2596 H HD2 . TYR 157 157 ? A -2.383 -16.338 -0.467 1.000 1 A 81.800 1 ATOM 2597 H HE1 . TYR 157 157 ? A -2.840 -19.669 3.206 1.000 1 A 81.800 1 ATOM 2598 H HE2 . TYR 157 157 ? A -4.464 -17.692 -0.264 1.000 1 A 81.800 1 ATOM 2599 H HH . TYR 157 157 ? A -4.824 -20.295 2.109 1.000 1 A 81.800 1 ATOM 2600 N N . TRP 158 158 ? A 0.011 -15.344 4.124 1.000 1 A 81.250 1 ATOM 2601 C CA . TRP 158 158 ? A -0.392 -15.341 5.532 1.000 1 A 81.250 1 ATOM 2602 C C . TRP 158 158 ? A -0.708 -13.942 6.062 1.000 1 A 81.250 1 ATOM 2603 O O . TRP 158 158 ? A -1.604 -13.813 6.894 1.000 1 A 81.250 1 ATOM 2604 C CB . TRP 158 158 ? A 0.679 -16.017 6.391 1.000 1 A 81.250 1 ATOM 2605 C CG . TRP 158 158 ? A 0.692 -17.510 6.288 1.000 1 A 81.250 1 ATOM 2606 C CD1 . TRP 158 158 ? A 1.725 -18.272 5.865 1.000 1 A 81.250 1 ATOM 2607 C CD2 . TRP 158 158 ? A -0.361 -18.447 6.667 1.000 1 A 81.250 1 ATOM 2608 N NE1 . TRP 158 158 ? A 1.366 -19.604 5.891 1.000 1 A 81.250 1 ATOM 2609 C CE2 . TRP 158 158 ? A 0.100 -19.771 6.403 1.000 1 A 81.250 1 ATOM 2610 C CE3 . TRP 158 158 ? A -1.641 -18.316 7.249 1.000 1 A 81.250 1 ATOM 2611 C CZ2 . TRP 158 158 ? A -0.668 -20.907 6.691 1.000 1 A 81.250 1 ATOM 2612 C CZ3 . TRP 158 158 ? A -2.411 -19.451 7.570 1.000 1 A 81.250 1 ATOM 2613 C CH2 . TRP 158 158 ? A -1.929 -20.744 7.289 1.000 1 A 81.250 1 ATOM 2614 H H . TRP 158 158 ? A 0.947 -15.635 3.882 1.000 1 A 81.250 1 ATOM 2615 H HA . TRP 158 158 ? A -1.314 -15.913 5.625 1.000 1 A 81.250 1 ATOM 2616 H HB2 . TRP 158 158 ? A 0.490 -15.772 7.436 1.000 1 A 81.250 1 ATOM 2617 H HB3 . TRP 158 158 ? A 1.659 -15.617 6.133 1.000 1 A 81.250 1 ATOM 2618 H HD1 . TRP 158 158 ? A 2.685 -17.888 5.555 1.000 1 A 81.250 1 ATOM 2619 H HE1 . TRP 158 158 ? A 1.984 -20.356 5.622 1.000 1 A 81.250 1 ATOM 2620 H HE3 . TRP 158 158 ? A -2.013 -17.329 7.485 1.000 1 A 81.250 1 ATOM 2621 H HZ2 . TRP 158 158 ? A -0.278 -21.894 6.494 1.000 1 A 81.250 1 ATOM 2622 H HZ3 . TRP 158 158 ? A -3.360 -19.327 8.071 1.000 1 A 81.250 1 ATOM 2623 H HH2 . TRP 158 158 ? A -2.507 -21.613 7.564 1.000 1 A 81.250 1 ATOM 2624 N N . LYS 159 159 ? A -0.021 -12.892 5.590 1.000 1 A 82.300 1 ATOM 2625 C CA . LYS 159 159 ? A -0.394 -11.508 5.919 1.000 1 A 82.300 1 ATOM 2626 C C . LYS 159 159 ? A -1.760 -11.147 5.332 1.000 1 A 82.300 1 ATOM 2627 O O . LYS 159 159 ? A -2.563 -10.573 6.052 1.000 1 A 82.300 1 ATOM 2628 C CB . LYS 159 159 ? A 0.674 -10.504 5.454 1.000 1 A 82.300 1 ATOM 2629 C CG . LYS 159 159 ? A 1.904 -10.439 6.375 1.000 1 A 82.300 1 ATOM 2630 C CD . LYS 159 159 ? A 2.827 -9.295 5.923 1.000 1 A 82.300 1 ATOM 2631 C CE . LYS 159 159 ? A 4.069 -9.159 6.817 1.000 1 A 82.300 1 ATOM 2632 N NZ . LYS 159 159 ? A 4.773 -7.863 6.588 1.000 1 A 82.300 1 ATOM 2633 H H . LYS 159 159 ? A 0.698 -13.053 4.899 1.000 1 A 82.300 1 ATOM 2634 H HA . LYS 159 159 ? A -0.515 -11.418 6.999 1.000 1 A 82.300 1 ATOM 2635 H HB2 . LYS 159 159 ? A 0.216 -9.514 5.439 1.000 1 A 82.300 1 ATOM 2636 H HB3 . LYS 159 159 ? A 0.989 -10.737 4.437 1.000 1 A 82.300 1 ATOM 2637 H HG2 . LYS 159 159 ? A 2.444 -11.386 6.348 1.000 1 A 82.300 1 ATOM 2638 H HG3 . LYS 159 159 ? A 1.577 -10.250 7.397 1.000 1 A 82.300 1 ATOM 2639 H HD2 . LYS 159 159 ? A 2.259 -8.365 5.959 1.000 1 A 82.300 1 ATOM 2640 H HD3 . LYS 159 159 ? A 3.137 -9.470 4.893 1.000 1 A 82.300 1 ATOM 2641 H HE2 . LYS 159 159 ? A 3.754 -9.223 7.858 1.000 1 A 82.300 1 ATOM 2642 H HE3 . LYS 159 159 ? A 4.735 -9.998 6.616 1.000 1 A 82.300 1 ATOM 2643 H HZ1 . LYS 159 159 ? A 4.187 -7.073 6.817 1.000 1 A 82.300 1 ATOM 2644 H HZ2 . LYS 159 159 ? A 5.044 -7.756 5.621 1.000 1 A 82.300 1 ATOM 2645 H HZ3 . LYS 159 159 ? A 5.607 -7.787 7.152 1.000 1 A 82.300 1 ATOM 2646 N N . LEU 160 160 ? A -2.030 -11.509 4.078 1.000 1 A 82.440 1 ATOM 2647 C CA . LEU 160 160 ? A -3.279 -11.189 3.378 1.000 1 A 82.440 1 ATOM 2648 C C . LEU 160 160 ? A -4.464 -12.051 3.827 1.000 1 A 82.440 1 ATOM 2649 O O . LEU 160 160 ? A -5.562 -11.539 3.984 1.000 1 A 82.440 1 ATOM 2650 C CB . LEU 160 160 ? A -3.082 -11.332 1.861 1.000 1 A 82.440 1 ATOM 2651 C CG . LEU 160 160 ? A -2.073 -10.376 1.207 1.000 1 A 82.440 1 ATOM 2652 C CD1 . LEU 160 160 ? A -2.024 -10.629 -0.300 1.000 1 A 82.440 1 ATOM 2653 C CD2 . LEU 160 160 ? A -2.433 -8.916 1.436 1.000 1 A 82.440 1 ATOM 2654 H H . LEU 160 160 ? A -1.299 -11.968 3.553 1.000 1 A 82.440 1 ATOM 2655 H HA . LEU 160 160 ? A -3.560 -10.160 3.602 1.000 1 A 82.440 1 ATOM 2656 H HB2 . LEU 160 160 ? A -2.795 -12.359 1.635 1.000 1 A 82.440 1 ATOM 2657 H HB3 . LEU 160 160 ? A -4.049 -11.140 1.397 1.000 1 A 82.440 1 ATOM 2658 H HG . LEU 160 160 ? A -1.077 -10.541 1.617 1.000 1 A 82.440 1 ATOM 2659 H HD11 . LEU 160 160 ? A -2.990 -10.397 -0.750 1.000 1 A 82.440 1 ATOM 2660 H HD12 . LEU 160 160 ? A -1.266 -9.996 -0.761 1.000 1 A 82.440 1 ATOM 2661 H HD13 . LEU 160 160 ? A -1.786 -11.674 -0.498 1.000 1 A 82.440 1 ATOM 2662 H HD21 . LEU 160 160 ? A -1.701 -8.297 0.916 1.000 1 A 82.440 1 ATOM 2663 H HD22 . LEU 160 160 ? A -2.395 -8.679 2.499 1.000 1 A 82.440 1 ATOM 2664 H HD23 . LEU 160 160 ? A -3.430 -8.707 1.047 1.000 1 A 82.440 1 ATOM 2665 N N . LYS 161 161 ? A -4.245 -13.336 4.110 1.000 1 A 80.140 1 ATOM 2666 C CA . LYS 161 161 ? A -5.258 -14.264 4.637 1.000 1 A 80.140 1 ATOM 2667 C C . LYS 161 161 ? A -5.783 -13.828 6.005 1.000 1 A 80.140 1 ATOM 2668 O O . LYS 161 161 ? A -6.899 -14.154 6.376 1.000 1 A 80.140 1 ATOM 2669 C CB . LYS 161 161 ? A -4.656 -15.679 4.691 1.000 1 A 80.140 1 ATOM 2670 C CG . LYS 161 161 ? A -5.711 -16.734 5.045 1.000 1 A 80.140 1 ATOM 2671 C CD . LYS 161 161 ? A -5.101 -18.122 5.220 1.000 1 A 80.140 1 ATOM 2672 C CE . LYS 161 161 ? A -6.251 -19.084 5.526 1.000 1 A 80.140 1 ATOM 2673 N NZ . LYS 161 161 ? A -5.775 -20.445 5.869 1.000 1 A 80.140 1 ATOM 2674 H H . LYS 161 161 ? A -3.334 -13.711 3.889 1.000 1 A 80.140 1 ATOM 2675 H HA . LYS 161 161 ? A -6.125 -14.268 3.975 1.000 1 A 80.140 1 ATOM 2676 H HB2 . LYS 161 161 ? A -4.247 -15.929 3.712 1.000 1 A 80.140 1 ATOM 2677 H HB3 . LYS 161 161 ? A -3.852 -15.700 5.427 1.000 1 A 80.140 1 ATOM 2678 H HG2 . LYS 161 161 ? A -6.461 -16.761 4.254 1.000 1 A 80.140 1 ATOM 2679 H HG3 . LYS 161 161 ? A -6.201 -16.479 5.985 1.000 1 A 80.140 1 ATOM 2680 H HD2 . LYS 161 161 ? A -4.390 -18.100 6.045 1.000 1 A 80.140 1 ATOM 2681 H HD3 . LYS 161 161 ? A -4.599 -18.417 4.298 1.000 1 A 80.140 1 ATOM 2682 H HE2 . LYS 161 161 ? A -6.839 -18.672 6.346 1.000 1 A 80.140 1 ATOM 2683 H HE3 . LYS 161 161 ? A -6.907 -19.118 4.656 1.000 1 A 80.140 1 ATOM 2684 H HZ1 . LYS 161 161 ? A -6.574 -21.041 6.032 1.000 1 A 80.140 1 ATOM 2685 H HZ2 . LYS 161 161 ? A -5.240 -20.833 5.105 1.000 1 A 80.140 1 ATOM 2686 H HZ3 . LYS 161 161 ? A -5.211 -20.419 6.706 1.000 1 A 80.140 1 ATOM 2687 N N . ARG 162 162 ? A -4.986 -13.080 6.776 1.000 1 A 73.110 1 ATOM 2688 C CA . ARG 162 162 ? A -5.468 -12.444 8.012 1.000 1 A 73.110 1 ATOM 2689 C C . ARG 162 162 ? A -6.412 -11.268 7.749 1.000 1 A 73.110 1 ATOM 2690 O O . ARG 162 162 ? A -7.106 -10.869 8.668 1.000 1 A 73.110 1 ATOM 2691 C CB . ARG 162 162 ? A -4.287 -11.986 8.873 1.000 1 A 73.110 1 ATOM 2692 C CG . ARG 162 162 ? A -3.550 -13.161 9.521 1.000 1 A 73.110 1 ATOM 2693 C CD . ARG 162 162 ? A -2.340 -12.615 10.281 1.000 1 A 73.110 1 ATOM 2694 N NE . ARG 162 162 ? A -1.526 -13.702 10.853 1.000 1 A 73.110 1 ATOM 2695 C CZ . ARG 162 162 ? A -0.650 -13.586 11.833 1.000 1 A 73.110 1 ATOM 2696 N NH1 . ARG 162 162 ? A -0.422 -12.446 12.423 1.000 1 A 73.110 1 ATOM 2697 N NH2 . ARG 162 162 ? A 0.018 -14.623 12.251 1.000 1 A 73.110 1 ATOM 2698 H H . ARG 162 162 ? A -4.071 -12.841 6.423 1.000 1 A 73.110 1 ATOM 2699 H HA . ARG 162 162 ? A -6.073 -13.152 8.579 1.000 1 A 73.110 1 ATOM 2700 H HB2 . ARG 162 162 ? A -3.599 -11.403 8.261 1.000 1 A 73.110 1 ATOM 2701 H HB3 . ARG 162 162 ? A -4.659 -11.343 9.670 1.000 1 A 73.110 1 ATOM 2702 H HG2 . ARG 162 162 ? A -3.230 -13.876 8.763 1.000 1 A 73.110 1 ATOM 2703 H HG3 . ARG 162 162 ? A -4.216 -13.666 10.220 1.000 1 A 73.110 1 ATOM 2704 H HD2 . ARG 162 162 ? A -1.726 -12.033 9.594 1.000 1 A 73.110 1 ATOM 2705 H HD3 . ARG 162 162 ? A -2.710 -11.960 11.069 1.000 1 A 73.110 1 ATOM 2706 H HE . ARG 162 162 ? A -1.670 -14.618 10.454 1.000 1 A 73.110 1 ATOM 2707 H HH11 . ARG 162 162 ? A -1.034 -11.674 12.201 1.000 1 A 73.110 1 ATOM 2708 H HH12 . ARG 162 162 ? A 0.187 -12.402 13.228 1.000 1 A 73.110 1 ATOM 2709 H HH21 . ARG 162 162 ? A -0.183 -15.534 11.865 1.000 1 A 73.110 1 ATOM 2710 H HH22 . ARG 162 162 ? A 0.611 -14.547 13.066 1.000 1 A 73.110 1 ATOM 2711 N N . LEU 163 163 ? A -6.409 -10.703 6.542 1.000 1 A 76.290 1 ATOM 2712 C CA . LEU 163 163 ? A -7.262 -9.576 6.158 1.000 1 A 76.290 1 ATOM 2713 C C . LEU 163 163 ? A -8.572 -10.042 5.517 1.000 1 A 76.290 1 ATOM 2714 O O . LEU 163 163 ? A -9.575 -9.359 5.653 1.000 1 A 76.290 1 ATOM 2715 C CB . LEU 163 163 ? A -6.511 -8.647 5.181 1.000 1 A 76.290 1 ATOM 2716 C CG . LEU 163 163 ? A -5.114 -8.192 5.624 1.000 1 A 76.290 1 ATOM 2717 C CD1 . LEU 163 163 ? A -4.456 -7.353 4.527 1.000 1 A 76.290 1 ATOM 2718 C CD2 . LEU 163 163 ? A -5.146 -7.345 6.889 1.000 1 A 76.290 1 ATOM 2719 H H . LEU 163 163 ? A -5.845 -11.117 5.814 1.000 1 A 76.290 1 ATOM 2720 H HA . LEU 163 163 ? A -7.535 -9.001 7.043 1.000 1 A 76.290 1 ATOM 2721 H HB2 . LEU 163 163 ? A -7.130 -7.764 5.019 1.000 1 A 76.290 1 ATOM 2722 H HB3 . LEU 163 163 ? A -6.418 -9.153 4.219 1.000 1 A 76.290 1 ATOM 2723 H HG . LEU 163 163 ? A -4.489 -9.067 5.801 1.000 1 A 76.290 1 ATOM 2724 H HD11 . LEU 163 163 ? A -4.435 -7.920 3.596 1.000 1 A 76.290 1 ATOM 2725 H HD12 . LEU 163 163 ? A -5.028 -6.440 4.362 1.000 1 A 76.290 1 ATOM 2726 H HD13 . LEU 163 163 ? A -3.437 -7.099 4.818 1.000 1 A 76.290 1 ATOM 2727 H HD21 . LEU 163 163 ? A -5.704 -6.436 6.665 1.000 1 A 76.290 1 ATOM 2728 H HD22 . LEU 163 163 ? A -4.131 -7.090 7.195 1.000 1 A 76.290 1 ATOM 2729 H HD23 . LEU 163 163 ? A -5.638 -7.889 7.695 1.000 1 A 76.290 1 ATOM 2730 N N . VAL 164 164 ? A -8.558 -11.178 4.811 1.000 1 A 72.640 1 ATOM 2731 C CA . VAL 164 164 ? A -9.700 -11.687 4.038 1.000 1 A 72.640 1 ATOM 2732 C C . VAL 164 164 ? A -9.876 -13.184 4.308 1.000 1 A 72.640 1 ATOM 2733 O O . VAL 164 164 ? A -8.923 -13.950 4.169 1.000 1 A 72.640 1 ATOM 2734 C CB . VAL 164 164 ? A -9.501 -11.399 2.531 1.000 1 A 72.640 1 ATOM 2735 C CG1 . VAL 164 164 ? A -10.719 -11.822 1.706 1.000 1 A 72.640 1 ATOM 2736 C CG2 . VAL 164 164 ? A -9.269 -9.905 2.260 1.000 1 A 72.640 1 ATOM 2737 H H . VAL 164 164 ? A -7.690 -11.689 4.737 1.000 1 A 72.640 1 ATOM 2738 H HA . VAL 164 164 ? A -10.607 -11.176 4.359 1.000 1 A 72.640 1 ATOM 2739 H HB . VAL 164 164 ? A -8.631 -11.948 2.169 1.000 1 A 72.640 1 ATOM 2740 H HG11 . VAL 164 164 ? A -11.621 -11.335 2.076 1.000 1 A 72.640 1 ATOM 2741 H HG12 . VAL 164 164 ? A -10.570 -11.553 0.660 1.000 1 A 72.640 1 ATOM 2742 H HG13 . VAL 164 164 ? A -10.835 -12.905 1.747 1.000 1 A 72.640 1 ATOM 2743 H HG21 . VAL 164 164 ? A -8.309 -9.590 2.670 1.000 1 A 72.640 1 ATOM 2744 H HG22 . VAL 164 164 ? A -10.064 -9.319 2.722 1.000 1 A 72.640 1 ATOM 2745 H HG23 . VAL 164 164 ? A -9.267 -9.710 1.188 1.000 1 A 72.640 1 ATOM 2746 N N . GLU 165 165 ? A -11.090 -13.601 4.691 1.000 1 A 66.910 1 ATOM 2747 C CA . GLU 165 165 ? A -11.430 -15.021 4.907 1.000 1 A 66.910 1 ATOM 2748 C C . GLU 165 165 ? A -11.450 -15.814 3.592 1.000 1 A 66.910 1 ATOM 2749 O O . GLU 165 165 ? A -11.025 -16.970 3.556 1.000 1 A 66.910 1 ATOM 2750 C CB . GLU 165 165 ? A -12.810 -15.163 5.584 1.000 1 A 66.910 1 ATOM 2751 C CG . GLU 165 165 ? A -12.851 -14.701 7.051 1.000 1 A 66.910 1 ATOM 2752 C CD . GLU 165 165 ? A -14.205 -14.977 7.745 1.000 1 A 66.910 1 ATOM 2753 O OE1 . GLU 165 165 ? A -14.246 -14.935 8.996 1.000 1 A 66.910 1 ATOM 2754 O OE2 . GLU 165 165 ? A -15.215 -15.236 7.052 1.000 1 A 66.910 1 ATOM 2755 H H . GLU 165 165 ? A -11.816 -12.914 4.835 1.000 1 A 66.910 1 ATOM 2756 H HA . GLU 165 165 ? A -10.676 -15.481 5.546 1.000 1 A 66.910 1 ATOM 2757 H HB2 . GLU 165 165 ? A -13.089 -16.216 5.560 1.000 1 A 66.910 1 ATOM 2758 H HB3 . GLU 165 165 ? A -13.546 -14.602 5.007 1.000 1 A 66.910 1 ATOM 2759 H HG2 . GLU 165 165 ? A -12.641 -13.633 7.088 1.000 1 A 66.910 1 ATOM 2760 H HG3 . GLU 165 165 ? A -12.061 -15.219 7.595 1.000 1 A 66.910 1 ATOM 2761 N N . ASP 166 166 ? A -11.926 -15.180 2.518 1.000 1 A 71.380 1 ATOM 2762 C CA . ASP 166 166 ? A -12.046 -15.779 1.195 1.000 1 A 71.380 1 ATOM 2763 C C . ASP 166 166 ? A -10.666 -15.996 0.549 1.000 1 A 71.380 1 ATOM 2764 O O . ASP 166 166 ? A -9.972 -15.067 0.117 1.000 1 A 71.380 1 ATOM 2765 C CB . ASP 166 166 ? A -12.984 -14.932 0.323 1.000 1 A 71.380 1 ATOM 2766 C CG . ASP 166 166 ? A -13.326 -15.617 -1.003 1.000 1 A 71.380 1 ATOM 2767 O OD1 . ASP 166 166 ? A -12.648 -16.617 -1.334 1.000 1 A 71.380 1 ATOM 2768 O OD2 . ASP 166 166 ? A -14.235 -15.110 -1.688 1.000 1 A 71.380 1 ATOM 2769 H H . ASP 166 166 ? A -12.244 -14.227 2.625 1.000 1 A 71.380 1 ATOM 2770 H HA . ASP 166 166 ? A -12.520 -16.755 1.308 1.000 1 A 71.380 1 ATOM 2771 H HB2 . ASP 166 166 ? A -12.520 -13.967 0.123 1.000 1 A 71.380 1 ATOM 2772 H HB3 . ASP 166 166 ? A -13.910 -14.757 0.872 1.000 1 A 71.380 1 ATOM 2773 N N . THR 167 167 ? A -10.264 -17.264 0.482 1.000 1 A 69.980 1 ATOM 2774 C CA . THR 167 167 ? A -9.002 -17.683 -0.125 1.000 1 A 69.980 1 ATOM 2775 C C . THR 167 167 ? A -9.009 -17.598 -1.648 1.000 1 A 69.980 1 ATOM 2776 O O . THR 167 167 ? A -7.930 -17.502 -2.242 1.000 1 A 69.980 1 ATOM 2777 C CB . THR 167 167 ? A -8.633 -19.108 0.308 1.000 1 A 69.980 1 ATOM 2778 O OG1 . THR 167 167 ? A -9.690 -20.026 0.127 1.000 1 A 69.980 1 ATOM 2779 C CG2 . THR 167 167 ? A -8.274 -19.150 1.797 1.000 1 A 69.980 1 ATOM 2780 H H . THR 167 167 ? A -10.892 -17.977 0.824 1.000 1 A 69.980 1 ATOM 2781 H HA . THR 167 167 ? A -8.217 -17.008 0.217 1.000 1 A 69.980 1 ATOM 2782 H HB . THR 167 167 ? A -7.768 -19.442 -0.264 1.000 1 A 69.980 1 ATOM 2783 H HG1 . THR 167 167 ? A -10.044 -19.948 -0.762 1.000 1 A 69.980 1 ATOM 2784 H HG21 . THR 167 167 ? A -7.465 -18.448 1.997 1.000 1 A 69.980 1 ATOM 2785 H HG22 . THR 167 167 ? A -9.144 -18.872 2.394 1.000 1 A 69.980 1 ATOM 2786 H HG23 . THR 167 167 ? A -7.963 -20.160 2.061 1.000 1 A 69.980 1 ATOM 2787 N N . ASP 168 168 ? A -10.179 -17.594 -2.288 1.000 1 A 76.220 1 ATOM 2788 C CA . ASP 168 168 ? A -10.291 -17.602 -3.746 1.000 1 A 76.220 1 ATOM 2789 C C . ASP 168 168 ? A -9.871 -16.251 -4.326 1.000 1 A 76.220 1 ATOM 2790 O O . ASP 168 168 ? A -9.141 -16.205 -5.322 1.000 1 A 76.220 1 ATOM 2791 C CB . ASP 168 168 ? A -11.711 -17.988 -4.197 1.000 1 A 76.220 1 ATOM 2792 C CG . ASP 168 168 ? A -12.075 -19.447 -3.884 1.000 1 A 76.220 1 ATOM 2793 O OD1 . ASP 168 168 ? A -11.165 -20.215 -3.483 1.000 1 A 76.220 1 ATOM 2794 O OD2 . ASP 168 168 ? A -13.247 -19.812 -4.121 1.000 1 A 76.220 1 ATOM 2795 H H . ASP 168 168 ? A -11.044 -17.545 -1.770 1.000 1 A 76.220 1 ATOM 2796 H HA . ASP 168 168 ? A -9.613 -18.359 -4.139 1.000 1 A 76.220 1 ATOM 2797 H HB2 . ASP 168 168 ? A -11.766 -17.859 -5.278 1.000 1 A 76.220 1 ATOM 2798 H HB3 . ASP 168 168 ? A -12.443 -17.314 -3.752 1.000 1 A 76.220 1 ATOM 2799 N N . ILE 169 169 ? A -10.206 -15.151 -3.642 1.000 1 A 78.180 1 ATOM 2800 C CA . ILE 169 169 ? A -9.756 -13.799 -4.006 1.000 1 A 78.180 1 ATOM 2801 C C . ILE 169 169 ? A -8.221 -13.731 -4.034 1.000 1 A 78.180 1 ATOM 2802 O O . ILE 169 169 ? A -7.631 -13.185 -4.968 1.000 1 A 78.180 1 ATOM 2803 C CB . ILE 169 169 ? A -10.346 -12.749 -3.033 1.000 1 A 78.180 1 ATOM 2804 C CG1 . ILE 169 169 ? A -11.890 -12.768 -3.073 1.000 1 A 78.180 1 ATOM 2805 C CG2 . ILE 169 169 ? A -9.834 -11.340 -3.387 1.000 1 A 78.180 1 ATOM 2806 C CD1 . ILE 169 169 ? A -12.560 -11.807 -2.082 1.000 1 A 78.180 1 ATOM 2807 H H . ILE 169 169 ? A -10.827 -15.273 -2.856 1.000 1 A 78.180 1 ATOM 2808 H HA . ILE 169 169 ? A -10.112 -13.574 -5.011 1.000 1 A 78.180 1 ATOM 2809 H HB . ILE 169 169 ? A -10.021 -12.991 -2.021 1.000 1 A 78.180 1 ATOM 2810 H HG12 . ILE 169 169 ? A -12.242 -13.772 -2.836 1.000 1 A 78.180 1 ATOM 2811 H HG13 . ILE 169 169 ? A -12.233 -12.529 -4.080 1.000 1 A 78.180 1 ATOM 2812 H HG21 . ILE 169 169 ? A -10.142 -10.626 -2.623 1.000 1 A 78.180 1 ATOM 2813 H HG22 . ILE 169 169 ? A -8.745 -11.331 -3.437 1.000 1 A 78.180 1 ATOM 2814 H HG23 . ILE 169 169 ? A -10.234 -11.031 -4.353 1.000 1 A 78.180 1 ATOM 2815 H HD11 . ILE 169 169 ? A -13.632 -12.004 -2.065 1.000 1 A 78.180 1 ATOM 2816 H HD12 . ILE 169 169 ? A -12.404 -10.772 -2.384 1.000 1 A 78.180 1 ATOM 2817 H HD13 . ILE 169 169 ? A -12.159 -11.964 -1.081 1.000 1 A 78.180 1 ATOM 2818 N N . LEU 170 170 ? A -7.558 -14.319 -3.034 1.000 1 A 78.270 1 ATOM 2819 C CA . LEU 170 170 ? A -6.094 -14.347 -2.961 1.000 1 A 78.270 1 ATOM 2820 C C . LEU 170 170 ? A -5.477 -15.255 -4.028 1.000 1 A 78.270 1 ATOM 2821 O O . LEU 170 170 ? A -4.383 -14.976 -4.520 1.000 1 A 78.270 1 ATOM 2822 C CB . LEU 170 170 ? A -5.653 -14.808 -1.561 1.000 1 A 78.270 1 ATOM 2823 C CG . LEU 170 170 ? A -6.093 -13.884 -0.416 1.000 1 A 78.270 1 ATOM 2824 C CD1 . LEU 170 170 ? A -5.612 -14.456 0.917 1.000 1 A 78.270 1 ATOM 2825 C CD2 . LEU 170 170 ? A -5.506 -12.482 -0.567 1.000 1 A 78.270 1 ATOM 2826 H H . LEU 170 170 ? A -8.102 -14.786 -2.323 1.000 1 A 78.270 1 ATOM 2827 H HA . LEU 170 170 ? A -5.709 -13.345 -3.154 1.000 1 A 78.270 1 ATOM 2828 H HB2 . LEU 170 170 ? A -4.565 -14.880 -1.549 1.000 1 A 78.270 1 ATOM 2829 H HB3 . LEU 170 170 ? A -6.056 -15.804 -1.378 1.000 1 A 78.270 1 ATOM 2830 H HG . LEU 170 170 ? A -7.181 -13.816 -0.391 1.000 1 A 78.270 1 ATOM 2831 H HD11 . LEU 170 170 ? A -6.030 -15.453 1.055 1.000 1 A 78.270 1 ATOM 2832 H HD12 . LEU 170 170 ? A -4.523 -14.501 0.949 1.000 1 A 78.270 1 ATOM 2833 H HD13 . LEU 170 170 ? A -5.982 -13.821 1.722 1.000 1 A 78.270 1 ATOM 2834 H HD21 . LEU 170 170 ? A -5.927 -11.992 -1.445 1.000 1 A 78.270 1 ATOM 2835 H HD22 . LEU 170 170 ? A -5.787 -11.896 0.308 1.000 1 A 78.270 1 ATOM 2836 H HD23 . LEU 170 170 ? A -4.421 -12.531 -0.660 1.000 1 A 78.270 1 ATOM 2837 N N . SER 171 171 ? A -6.161 -16.344 -4.380 1.000 1 A 78.160 1 ATOM 2838 C CA . SER 171 171 ? A -5.683 -17.299 -5.381 1.000 1 A 78.160 1 ATOM 2839 C C . SER 171 171 ? A -5.675 -16.721 -6.802 1.000 1 A 78.160 1 ATOM 2840 O O . SER 171 171 ? A -4.758 -17.020 -7.566 1.000 1 A 78.160 1 ATOM 2841 C CB . SER 171 171 ? A -6.501 -18.591 -5.298 1.000 1 A 78.160 1 ATOM 2842 O OG . SER 171 171 ? A -7.762 -18.473 -5.915 1.000 1 A 78.160 1 ATOM 2843 H H . SER 171 171 ? A -7.037 -16.531 -3.913 1.000 1 A 78.160 1 ATOM 2844 H HA . SER 171 171 ? A -4.652 -17.552 -5.137 1.000 1 A 78.160 1 ATOM 2845 H HB2 . SER 171 171 ? A -5.952 -19.384 -5.805 1.000 1 A 78.160 1 ATOM 2846 H HB3 . SER 171 171 ? A -6.632 -18.877 -4.255 1.000 1 A 78.160 1 ATOM 2847 H HG . SER 171 171 ? A -8.251 -17.714 -5.587 1.000 1 A 78.160 1 ATOM 2848 N N . ASN 172 172 ? A -6.635 -15.845 -7.118 1.000 1 A 83.140 1 ATOM 2849 C CA . ASN 172 172 ? A -6.835 -15.252 -8.445 1.000 1 A 83.140 1 ATOM 2850 C C . ASN 172 172 ? A -6.097 -13.918 -8.657 1.000 1 A 83.140 1 ATOM 2851 O O . ASN 172 172 ? A -6.167 -13.330 -9.736 1.000 1 A 83.140 1 ATOM 2852 C CB . ASN 172 172 ? A -8.348 -15.102 -8.668 1.000 1 A 83.140 1 ATOM 2853 C CG . ASN 172 172 ? A -9.037 -16.443 -8.842 1.000 1 A 83.140 1 ATOM 2854 O OD1 . ASN 172 172 ? A -8.544 -17.338 -9.507 1.000 1 A 83.140 1 ATOM 2855 N ND2 . ASN 172 172 ? A -10.206 -16.617 -8.275 1.000 1 A 83.140 1 ATOM 2856 H H . ASN 172 172 ? A -7.354 -15.680 -6.427 1.000 1 A 83.140 1 ATOM 2857 H HA . ASN 172 172 ? A -6.442 -15.935 -9.198 1.000 1 A 83.140 1 ATOM 2858 H HB2 . ASN 172 172 ? A -8.530 -14.531 -9.578 1.000 1 A 83.140 1 ATOM 2859 H HB3 . ASN 172 172 ? A -8.791 -14.561 -7.832 1.000 1 A 83.140 1 ATOM 2860 H HD21 . ASN 172 172 ? A -10.588 -17.550 -8.332 1.000 1 A 83.140 1 ATOM 2861 H HD22 . ASN 172 172 ? A -10.544 -15.951 -7.595 1.000 1 A 83.140 1 ATOM 2862 N N . MET 173 173 ? A -5.403 -13.416 -7.637 1.000 1 A 86.100 1 ATOM 2863 C CA . MET 173 173 ? A -4.697 -12.140 -7.701 1.000 1 A 86.100 1 ATOM 2864 C C . MET 173 173 ? A -3.462 -12.219 -8.609 1.000 1 A 86.100 1 ATOM 2865 O O . MET 173 173 ? A -2.739 -13.218 -8.612 1.000 1 A 86.100 1 ATOM 2866 C CB . MET 173 173 ? A -4.361 -11.712 -6.272 1.000 1 A 86.100 1 ATOM 2867 C CG . MET 173 173 ? A -3.729 -10.323 -6.201 1.000 1 A 86.100 1 ATOM 2868 S SD . MET 173 173 ? A -3.348 -9.806 -4.513 1.000 1 A 86.100 1 ATOM 2869 C CE . MET 173 173 ? A -5.014 -9.469 -3.907 1.000 1 A 86.100 1 ATOM 2870 H H . MET 173 173 ? A -5.381 -13.939 -6.773 1.000 1 A 86.100 1 ATOM 2871 H HA . MET 173 173 ? A -5.378 -11.401 -8.124 1.000 1 A 86.100 1 ATOM 2872 H HB2 . MET 173 173 ? A -5.285 -11.707 -5.692 1.000 1 A 86.100 1 ATOM 2873 H HB3 . MET 173 173 ? A -3.684 -12.436 -5.819 1.000 1 A 86.100 1 ATOM 2874 H HG2 . MET 173 173 ? A -2.794 -10.333 -6.762 1.000 1 A 86.100 1 ATOM 2875 H HG3 . MET 173 173 ? A -4.396 -9.592 -6.657 1.000 1 A 86.100 1 ATOM 2876 H HE1 . MET 173 173 ? A -5.614 -10.379 -3.922 1.000 1 A 86.100 1 ATOM 2877 H HE2 . MET 173 173 ? A -4.945 -9.107 -2.881 1.000 1 A 86.100 1 ATOM 2878 H HE3 . MET 173 173 ? A -5.482 -8.707 -4.530 1.000 1 A 86.100 1 ATOM 2879 N N . SER 174 174 ? A -3.190 -11.148 -9.362 1.000 1 A 88.230 1 ATOM 2880 C CA . SER 174 174 ? A -1.973 -11.075 -10.168 1.000 1 A 88.230 1 ATOM 2881 C C . SER 174 174 ? A -0.729 -10.946 -9.285 1.000 1 A 88.230 1 ATOM 2882 O O . SER 174 174 ? A -0.775 -10.422 -8.169 1.000 1 A 88.230 1 ATOM 2883 C CB . SER 174 174 ? A -2.051 -9.953 -11.212 1.000 1 A 88.230 1 ATOM 2884 O OG . SER 174 174 ? A -1.694 -8.697 -10.678 1.000 1 A 88.230 1 ATOM 2885 H H . SER 174 174 ? A -3.783 -10.333 -9.306 1.000 1 A 88.230 1 ATOM 2886 H HA . SER 174 174 ? A -1.891 -12.014 -10.715 1.000 1 A 88.230 1 ATOM 2887 H HB2 . SER 174 174 ? A -1.351 -10.187 -12.015 1.000 1 A 88.230 1 ATOM 2888 H HB3 . SER 174 174 ? A -3.054 -9.906 -11.636 1.000 1 A 88.230 1 ATOM 2889 H HG . SER 174 174 ? A -2.490 -8.210 -10.454 1.000 1 A 88.230 1 ATOM 2890 N N . ASP 175 175 ? A 0.412 -11.397 -9.801 1.000 1 A 86.490 1 ATOM 2891 C CA . ASP 175 175 ? A 1.684 -11.262 -9.099 1.000 1 A 86.490 1 ATOM 2892 C C . ASP 175 175 ? A 2.011 -9.776 -8.810 1.000 1 A 86.490 1 ATOM 2893 O O . ASP 175 175 ? A 2.348 -9.408 -7.683 1.000 1 A 86.490 1 ATOM 2894 C CB . ASP 175 175 ? A 2.778 -11.965 -9.933 1.000 1 A 86.490 1 ATOM 2895 C CG . ASP 175 175 ? A 2.925 -13.479 -9.670 1.000 1 A 86.490 1 ATOM 2896 O OD1 . ASP 175 175 ? A 2.293 -14.022 -8.731 1.000 1 A 86.490 1 ATOM 2897 O OD2 . ASP 175 175 ? A 3.726 -14.096 -10.408 1.000 1 A 86.490 1 ATOM 2898 H H . ASP 175 175 ? A 0.392 -11.901 -10.677 1.000 1 A 86.490 1 ATOM 2899 H HA . ASP 175 175 ? A 1.584 -11.761 -8.136 1.000 1 A 86.490 1 ATOM 2900 H HB2 . ASP 175 175 ? A 3.738 -11.484 -9.748 1.000 1 A 86.490 1 ATOM 2901 H HB3 . ASP 175 175 ? A 2.570 -11.811 -10.992 1.000 1 A 86.490 1 ATOM 2902 N N . GLY 176 176 ? A 1.823 -8.882 -9.786 1.000 1 A 88.240 1 ATOM 2903 C CA . GLY 176 176 ? A 2.024 -7.440 -9.583 1.000 1 A 88.240 1 ATOM 2904 C C . GLY 176 176 ? A 1.161 -6.872 -8.449 1.000 1 A 88.240 1 ATOM 2905 O O . GLY 176 176 ? A 1.664 -6.179 -7.562 1.000 1 A 88.240 1 ATOM 2906 H H . GLY 176 176 ? A 1.431 -9.198 -10.661 1.000 1 A 88.240 1 ATOM 2907 H HA2 . GLY 176 176 ? A 1.766 -6.907 -10.499 1.000 1 A 88.240 1 ATOM 2908 H HA3 . GLY 176 176 ? A 3.070 -7.242 -9.351 1.000 1 A 88.240 1 ATOM 2909 N N . ASP 177 177 ? A -0.117 -7.250 -8.399 1.000 1 A 90.580 1 ATOM 2910 C CA . ASP 177 177 ? A -1.033 -6.774 -7.358 1.000 1 A 90.580 1 ATOM 2911 C C . ASP 177 177 ? A -0.652 -7.301 -5.972 1.000 1 A 90.580 1 ATOM 2912 O O . ASP 177 177 ? A -0.631 -6.529 -5.012 1.000 1 A 90.580 1 ATOM 2913 C CB . ASP 177 177 ? A -2.476 -7.155 -7.697 1.000 1 A 90.580 1 ATOM 2914 C CG . ASP 177 177 ? A -2.948 -6.536 -9.008 1.000 1 A 90.580 1 ATOM 2915 O OD1 . ASP 177 177 ? A -2.526 -5.401 -9.325 1.000 1 A 90.580 1 ATOM 2916 O OD2 . ASP 177 177 ? A -3.689 -7.241 -9.727 1.000 1 A 90.580 1 ATOM 2917 H H . ASP 177 177 ? A -0.487 -7.836 -9.134 1.000 1 A 90.580 1 ATOM 2918 H HA . ASP 177 177 ? A -0.978 -5.686 -7.318 1.000 1 A 90.580 1 ATOM 2919 H HB2 . ASP 177 177 ? A -3.131 -6.816 -6.894 1.000 1 A 90.580 1 ATOM 2920 H HB3 . ASP 177 177 ? A -2.550 -8.240 -7.764 1.000 1 A 90.580 1 ATOM 2921 N N . MET 178 178 ? A -0.260 -8.578 -5.863 1.000 1 A 89.430 1 ATOM 2922 C CA . MET 178 178 ? A 0.240 -9.150 -4.604 1.000 1 A 89.430 1 ATOM 2923 C C . MET 178 178 ? A 1.441 -8.370 -4.071 1.000 1 A 89.430 1 ATOM 2924 O O . MET 178 178 ? A 1.506 -8.052 -2.880 1.000 1 A 89.430 1 ATOM 2925 C CB . MET 178 178 ? A 0.666 -10.616 -4.790 1.000 1 A 89.430 1 ATOM 2926 C CG . MET 178 178 ? A -0.508 -11.585 -4.743 1.000 1 A 89.430 1 ATOM 2927 S SD . MET 178 178 ? A -0.014 -13.331 -4.805 1.000 1 A 89.430 1 ATOM 2928 C CE . MET 178 178 ? A -0.774 -13.715 -6.401 1.000 1 A 89.430 1 ATOM 2929 H H . MET 178 178 ? A -0.295 -9.159 -6.689 1.000 1 A 89.430 1 ATOM 2930 H HA . MET 178 178 ? A -0.545 -9.094 -3.849 1.000 1 A 89.430 1 ATOM 2931 H HB2 . MET 178 178 ? A 1.199 -10.737 -5.733 1.000 1 A 89.430 1 ATOM 2932 H HB3 . MET 178 178 ? A 1.343 -10.890 -3.981 1.000 1 A 89.430 1 ATOM 2933 H HG2 . MET 178 178 ? A -1.170 -11.367 -5.581 1.000 1 A 89.430 1 ATOM 2934 H HG3 . MET 178 178 ? A -1.060 -11.424 -3.817 1.000 1 A 89.430 1 ATOM 2935 H HE1 . MET 178 178 ? A -0.329 -13.099 -7.183 1.000 1 A 89.430 1 ATOM 2936 H HE2 . MET 178 178 ? A -0.651 -14.767 -6.660 1.000 1 A 89.430 1 ATOM 2937 H HE3 . MET 178 178 ? A -1.841 -13.504 -6.342 1.000 1 A 89.430 1 ATOM 2938 N N . LEU 179 179 ? A 2.395 -8.051 -4.949 1.000 1 A 90.900 1 ATOM 2939 C CA . LEU 179 179 ? A 3.567 -7.266 -4.582 1.000 1 A 90.900 1 ATOM 2940 C C . LEU 179 179 ? A 3.178 -5.845 -4.159 1.000 1 A 90.900 1 ATOM 2941 O O . LEU 179 179 ? A 3.691 -5.330 -3.164 1.000 1 A 90.900 1 ATOM 2942 C CB . LEU 179 179 ? A 4.530 -7.254 -5.775 1.000 1 A 90.900 1 ATOM 2943 C CG . LEU 179 179 ? A 5.806 -6.446 -5.511 1.000 1 A 90.900 1 ATOM 2944 C CD1 . LEU 179 179 ? A 6.631 -7.033 -4.366 1.000 1 A 90.900 1 ATOM 2945 C CD2 . LEU 179 179 ? A 6.673 -6.450 -6.761 1.000 1 A 90.900 1 ATOM 2946 H H . LEU 179 179 ? A 2.269 -8.324 -5.913 1.000 1 A 90.900 1 ATOM 2947 H HA . LEU 179 179 ? A 4.048 -7.747 -3.731 1.000 1 A 90.900 1 ATOM 2948 H HB2 . LEU 179 179 ? A 4.801 -8.281 -6.019 1.000 1 A 90.900 1 ATOM 2949 H HB3 . LEU 179 179 ? A 4.022 -6.827 -6.640 1.000 1 A 90.900 1 ATOM 2950 H HG . LEU 179 179 ? A 5.561 -5.410 -5.279 1.000 1 A 90.900 1 ATOM 2951 H HD11 . LEU 179 179 ? A 7.589 -6.517 -4.319 1.000 1 A 90.900 1 ATOM 2952 H HD12 . LEU 179 179 ? A 6.801 -8.097 -4.533 1.000 1 A 90.900 1 ATOM 2953 H HD13 . LEU 179 179 ? A 6.111 -6.886 -3.419 1.000 1 A 90.900 1 ATOM 2954 H HD21 . LEU 179 179 ? A 6.903 -7.474 -7.058 1.000 1 A 90.900 1 ATOM 2955 H HD22 . LEU 179 179 ? A 6.147 -5.948 -7.573 1.000 1 A 90.900 1 ATOM 2956 H HD23 . LEU 179 179 ? A 7.597 -5.918 -6.533 1.000 1 A 90.900 1 ATOM 2957 N N . THR 180 180 ? A 2.258 -5.224 -4.893 1.000 1 A 93.380 1 ATOM 2958 C CA . THR 180 180 ? A 1.803 -3.858 -4.635 1.000 1 A 93.380 1 ATOM 2959 C C . THR 180 180 ? A 1.085 -3.739 -3.295 1.000 1 A 93.380 1 ATOM 2960 O O . THR 180 180 ? A 1.412 -2.852 -2.502 1.000 1 A 93.380 1 ATOM 2961 C CB . THR 180 180 ? A 0.976 -3.353 -5.823 1.000 1 A 93.380 1 ATOM 2962 O OG1 . THR 180 180 ? A 1.864 -3.199 -6.898 1.000 1 A 93.380 1 ATOM 2963 C CG2 . THR 180 180 ? A 0.375 -1.968 -5.613 1.000 1 A 93.380 1 ATOM 2964 H H . THR 180 180 ? A 1.902 -5.696 -5.712 1.000 1 A 93.380 1 ATOM 2965 H HA . THR 180 180 ? A 2.686 -3.222 -4.568 1.000 1 A 93.380 1 ATOM 2966 H HB . THR 180 180 ? A 0.190 -4.062 -6.082 1.000 1 A 93.380 1 ATOM 2967 H HG1 . THR 180 180 ? A 1.795 -3.957 -7.483 1.000 1 A 93.380 1 ATOM 2968 H HG21 . THR 180 180 ? A -0.534 -2.060 -5.019 1.000 1 A 93.380 1 ATOM 2969 H HG22 . THR 180 180 ? A 1.091 -1.304 -5.128 1.000 1 A 93.380 1 ATOM 2970 H HG23 . THR 180 180 ? A 0.090 -1.556 -6.581 1.000 1 A 93.380 1 ATOM 2971 N N . ILE 181 181 ? A 0.199 -4.684 -2.973 1.000 1 A 91.680 1 ATOM 2972 C CA . ILE 181 181 ? A -0.477 -4.734 -1.672 1.000 1 A 91.680 1 ATOM 2973 C C . ILE 181 181 ? A 0.526 -5.022 -0.550 1.000 1 A 91.680 1 ATOM 2974 O O . ILE 181 181 ? A 0.464 -4.389 0.504 1.000 1 A 91.680 1 ATOM 2975 C CB . ILE 181 181 ? A -1.633 -5.755 -1.692 1.000 1 A 91.680 1 ATOM 2976 C CG1 . ILE 181 181 ? A -2.712 -5.336 -2.716 1.000 1 A 91.680 1 ATOM 2977 C CG2 . ILE 181 181 ? A -2.290 -5.852 -0.301 1.000 1 A 91.680 1 ATOM 2978 C CD1 . ILE 181 181 ? A -3.630 -6.495 -3.099 1.000 1 A 91.680 1 ATOM 2979 H H . ILE 181 181 ? A -0.032 -5.383 -3.664 1.000 1 A 91.680 1 ATOM 2980 H HA . ILE 181 181 ? A -0.903 -3.750 -1.474 1.000 1 A 91.680 1 ATOM 2981 H HB . ILE 181 181 ? A -1.230 -6.730 -1.965 1.000 1 A 91.680 1 ATOM 2982 H HG12 . ILE 181 181 ? A -3.309 -4.516 -2.319 1.000 1 A 91.680 1 ATOM 2983 H HG13 . ILE 181 181 ? A -2.247 -4.984 -3.637 1.000 1 A 91.680 1 ATOM 2984 H HG21 . ILE 181 181 ? A -1.564 -6.144 0.458 1.000 1 A 91.680 1 ATOM 2985 H HG22 . ILE 181 181 ? A -3.090 -6.592 -0.309 1.000 1 A 91.680 1 ATOM 2986 H HG23 . ILE 181 181 ? A -2.713 -4.888 -0.019 1.000 1 A 91.680 1 ATOM 2987 H HD11 . ILE 181 181 ? A -4.176 -6.865 -2.232 1.000 1 A 91.680 1 ATOM 2988 H HD12 . ILE 181 181 ? A -4.341 -6.161 -3.854 1.000 1 A 91.680 1 ATOM 2989 H HD13 . ILE 181 181 ? A -3.017 -7.294 -3.517 1.000 1 A 91.680 1 ATOM 2990 N N . TYR 182 182 ? A 1.496 -5.916 -0.763 1.000 1 A 90.200 1 ATOM 2991 C CA . TYR 182 182 ? A 2.542 -6.170 0.230 1.000 1 A 90.200 1 ATOM 2992 C C . TYR 182 182 ? A 3.346 -4.904 0.564 1.000 1 A 90.200 1 ATOM 2993 O O . TYR 182 182 ? A 3.508 -4.568 1.739 1.000 1 A 90.200 1 ATOM 2994 C CB . TYR 182 182 ? A 3.469 -7.287 -0.259 1.000 1 A 90.200 1 ATOM 2995 C CG . TYR 182 182 ? A 4.623 -7.538 0.687 1.000 1 A 90.200 1 ATOM 2996 C CD1 . TYR 182 182 ? A 5.903 -7.027 0.396 1.000 1 A 90.200 1 ATOM 2997 C CD2 . TYR 182 182 ? A 4.401 -8.252 1.879 1.000 1 A 90.200 1 ATOM 2998 C CE1 . TYR 182 182 ? A 6.964 -7.245 1.295 1.000 1 A 90.200 1 ATOM 2999 C CE2 . TYR 182 182 ? A 5.466 -8.496 2.764 1.000 1 A 90.200 1 ATOM 3000 C CZ . TYR 182 182 ? A 6.747 -7.984 2.475 1.000 1 A 90.200 1 ATOM 3001 O OH . TYR 182 182 ? A 7.766 -8.202 3.346 1.000 1 A 90.200 1 ATOM 3002 H H . TYR 182 182 ? A 1.505 -6.431 -1.631 1.000 1 A 90.200 1 ATOM 3003 H HA . TYR 182 182 ? A 2.064 -6.499 1.153 1.000 1 A 90.200 1 ATOM 3004 H HB2 . TYR 182 182 ? A 3.868 -7.030 -1.240 1.000 1 A 90.200 1 ATOM 3005 H HB3 . TYR 182 182 ? A 2.893 -8.206 -0.370 1.000 1 A 90.200 1 ATOM 3006 H HD1 . TYR 182 182 ? A 6.064 -6.464 -0.511 1.000 1 A 90.200 1 ATOM 3007 H HD2 . TYR 182 182 ? A 3.414 -8.637 2.088 1.000 1 A 90.200 1 ATOM 3008 H HE1 . TYR 182 182 ? A 7.947 -6.852 1.078 1.000 1 A 90.200 1 ATOM 3009 H HE2 . TYR 182 182 ? A 5.319 -9.089 3.654 1.000 1 A 90.200 1 ATOM 3010 H HH . TYR 182 182 ? A 8.577 -7.789 3.039 1.000 1 A 90.200 1 ATOM 3011 N N . CYS 183 183 ? A 3.812 -4.177 -0.454 1.000 1 A 92.520 1 ATOM 3012 C CA . CYS 183 183 ? A 4.513 -2.903 -0.289 1.000 1 A 92.520 1 ATOM 3013 C C . CYS 183 183 ? A 3.653 -1.861 0.436 1.000 1 A 92.520 1 ATOM 3014 O O . CYS 183 183 ? A 4.151 -1.138 1.298 1.000 1 A 92.520 1 ATOM 3015 C CB . CYS 183 183 ? A 4.889 -2.391 -1.681 1.000 1 A 92.520 1 ATOM 3016 S SG . CYS 183 183 ? A 6.316 -3.304 -2.331 1.000 1 A 92.520 1 ATOM 3017 H H . CYS 183 183 ? A 3.662 -4.517 -1.393 1.000 1 A 92.520 1 ATOM 3018 H HA . CYS 183 183 ? A 5.417 -3.048 0.303 1.000 1 A 92.520 1 ATOM 3019 H HB2 . CYS 183 183 ? A 5.129 -1.329 -1.635 1.000 1 A 92.520 1 ATOM 3020 H HB3 . CYS 183 183 ? A 4.032 -2.523 -2.341 1.000 1 A 92.520 1 ATOM 3021 H HG . CYS 183 183 ? A 6.190 -2.870 -3.588 1.000 1 A 92.520 1 ATOM 3022 N N . PHE 184 184 ? A 2.359 -1.802 0.121 1.000 1 A 93.070 1 ATOM 3023 C CA . PHE 184 184 ? A 1.428 -0.897 0.782 1.000 1 A 93.070 1 ATOM 3024 C C . PHE 184 184 ? A 1.233 -1.226 2.264 1.000 1 A 93.070 1 ATOM 3025 O O . PHE 184 184 ? A 1.266 -0.326 3.100 1.000 1 A 93.070 1 ATOM 3026 C CB . PHE 184 184 ? A 0.098 -0.951 0.048 1.000 1 A 93.070 1 ATOM 3027 C CG . PHE 184 184 ? A -0.918 -0.016 0.652 1.000 1 A 93.070 1 ATOM 3028 C CD1 . PHE 184 184 ? A -2.002 -0.527 1.388 1.000 1 A 93.070 1 ATOM 3029 C CD2 . PHE 184 184 ? A -0.768 1.371 0.486 1.000 1 A 93.070 1 ATOM 3030 C CE1 . PHE 184 184 ? A -2.963 0.358 1.896 1.000 1 A 93.070 1 ATOM 3031 C CE2 . PHE 184 184 ? A -1.713 2.249 1.033 1.000 1 A 93.070 1 ATOM 3032 C CZ . PHE 184 184 ? A -2.807 1.738 1.746 1.000 1 A 93.070 1 ATOM 3033 H H . PHE 184 184 ? A 2.006 -2.388 -0.622 1.000 1 A 93.070 1 ATOM 3034 H HA . PHE 184 184 ? A 1.817 0.120 0.721 1.000 1 A 93.070 1 ATOM 3035 H HB2 . PHE 184 184 ? A -0.287 -1.971 0.078 1.000 1 A 93.070 1 ATOM 3036 H HB3 . PHE 184 184 ? A 0.253 -0.684 -0.997 1.000 1 A 93.070 1 ATOM 3037 H HD1 . PHE 184 184 ? A -2.124 -1.591 1.523 1.000 1 A 93.070 1 ATOM 3038 H HD2 . PHE 184 184 ? A 0.067 1.766 -0.074 1.000 1 A 93.070 1 ATOM 3039 H HE1 . PHE 184 184 ? A -3.835 -0.011 2.415 1.000 1 A 93.070 1 ATOM 3040 H HE2 . PHE 184 184 ? A -1.615 3.313 0.876 1.000 1 A 93.070 1 ATOM 3041 H HZ . PHE 184 184 ? A -3.545 2.400 2.175 1.000 1 A 93.070 1 ATOM 3042 N N . ILE 185 185 ? A 1.105 -2.508 2.616 1.000 1 A 90.360 1 ATOM 3043 C CA . ILE 185 185 ? A 1.029 -2.944 4.016 1.000 1 A 90.360 1 ATOM 3044 C C . ILE 185 185 ? A 2.275 -2.493 4.782 1.000 1 A 90.360 1 ATOM 3045 O O . ILE 185 185 ? A 2.147 -1.951 5.878 1.000 1 A 90.360 1 ATOM 3046 C CB . ILE 185 185 ? A 0.823 -4.473 4.098 1.000 1 A 90.360 1 ATOM 3047 C CG1 . ILE 185 185 ? A -0.614 -4.816 3.653 1.000 1 A 90.360 1 ATOM 3048 C CG2 . ILE 185 185 ? A 1.095 -5.000 5.522 1.000 1 A 90.360 1 ATOM 3049 C CD1 . ILE 185 185 ? A -0.851 -6.312 3.422 1.000 1 A 90.360 1 ATOM 3050 H H . ILE 185 185 ? A 1.042 -3.200 1.883 1.000 1 A 90.360 1 ATOM 3051 H HA . ILE 185 185 ? A 0.176 -2.455 4.487 1.000 1 A 90.360 1 ATOM 3052 H HB . ILE 185 185 ? A 1.524 -4.959 3.419 1.000 1 A 90.360 1 ATOM 3053 H HG12 . ILE 185 185 ? A -1.323 -4.452 4.398 1.000 1 A 90.360 1 ATOM 3054 H HG13 . ILE 185 185 ? A -0.843 -4.304 2.718 1.000 1 A 90.360 1 ATOM 3055 H HG21 . ILE 185 185 ? A 2.151 -4.895 5.771 1.000 1 A 90.360 1 ATOM 3056 H HG22 . ILE 185 185 ? A 0.835 -6.056 5.602 1.000 1 A 90.360 1 ATOM 3057 H HG23 . ILE 185 185 ? A 0.507 -4.424 6.237 1.000 1 A 90.360 1 ATOM 3058 H HD11 . ILE 185 185 ? A -0.808 -6.866 4.360 1.000 1 A 90.360 1 ATOM 3059 H HD12 . ILE 185 185 ? A -0.112 -6.704 2.724 1.000 1 A 90.360 1 ATOM 3060 H HD13 . ILE 185 185 ? A -1.845 -6.439 2.993 1.000 1 A 90.360 1 ATOM 3061 N N . VAL 186 186 ? A 3.469 -2.671 4.205 1.000 1 A 91.090 1 ATOM 3062 C CA . VAL 186 186 ? A 4.721 -2.191 4.816 1.000 1 A 91.090 1 ATOM 3063 C C . VAL 186 186 ? A 4.679 -0.669 5.002 1.000 1 A 91.090 1 ATOM 3064 O O . VAL 186 186 ? A 4.949 -0.182 6.097 1.000 1 A 91.090 1 ATOM 3065 C CB . VAL 186 186 ? A 5.949 -2.633 3.992 1.000 1 A 91.090 1 ATOM 3066 C CG1 . VAL 186 186 ? A 7.259 -2.071 4.559 1.000 1 A 91.090 1 ATOM 3067 C CG2 . VAL 186 186 ? A 6.087 -4.164 3.983 1.000 1 A 91.090 1 ATOM 3068 H H . VAL 186 186 ? A 3.501 -3.103 3.292 1.000 1 A 91.090 1 ATOM 3069 H HA . VAL 186 186 ? A 4.811 -2.621 5.813 1.000 1 A 91.090 1 ATOM 3070 H HB . VAL 186 186 ? A 5.842 -2.287 2.964 1.000 1 A 91.090 1 ATOM 3071 H HG11 . VAL 186 186 ? A 8.109 -2.441 3.986 1.000 1 A 91.090 1 ATOM 3072 H HG12 . VAL 186 186 ? A 7.265 -0.983 4.503 1.000 1 A 91.090 1 ATOM 3073 H HG13 . VAL 186 186 ? A 7.374 -2.356 5.604 1.000 1 A 91.090 1 ATOM 3074 H HG21 . VAL 186 186 ? A 6.926 -4.450 3.348 1.000 1 A 91.090 1 ATOM 3075 H HG22 . VAL 186 186 ? A 5.184 -4.627 3.585 1.000 1 A 91.090 1 ATOM 3076 H HG23 . VAL 186 186 ? A 6.258 -4.523 4.998 1.000 1 A 91.090 1 ATOM 3077 N N . ALA 187 187 ? A 4.249 0.082 3.981 1.000 1 A 93.350 1 ATOM 3078 C CA . ALA 187 187 ? A 4.125 1.537 4.060 1.000 1 A 93.350 1 ATOM 3079 C C . ALA 187 187 ? A 3.148 1.999 5.155 1.000 1 A 93.350 1 ATOM 3080 O O . ALA 187 187 ? A 3.441 2.950 5.879 1.000 1 A 93.350 1 ATOM 3081 C CB . ALA 187 187 ? A 3.711 2.079 2.685 1.000 1 A 93.350 1 ATOM 3082 H H . ALA 187 187 ? A 4.024 -0.370 3.106 1.000 1 A 93.350 1 ATOM 3083 H HA . ALA 187 187 ? A 5.103 1.945 4.312 1.000 1 A 93.350 1 ATOM 3084 H HB1 . ALA 187 187 ? A 2.688 1.781 2.453 1.000 1 A 93.350 1 ATOM 3085 H HB2 . ALA 187 187 ? A 3.766 3.168 2.693 1.000 1 A 93.350 1 ATOM 3086 H HB3 . ALA 187 187 ? A 4.375 1.697 1.910 1.000 1 A 93.350 1 ATOM 3087 N N . LEU 188 188 ? A 2.007 1.320 5.312 1.000 1 A 90.430 1 ATOM 3088 C CA . LEU 188 188 ? A 1.038 1.615 6.368 1.000 1 A 90.430 1 ATOM 3089 C C . LEU 188 188 ? A 1.592 1.309 7.758 1.000 1 A 90.430 1 ATOM 3090 O O . LEU 188 188 ? A 1.398 2.107 8.679 1.000 1 A 90.430 1 ATOM 3091 C CB . LEU 188 188 ? A -0.251 0.806 6.159 1.000 1 A 90.430 1 ATOM 3092 C CG . LEU 188 188 ? A -1.179 1.276 5.029 1.000 1 A 90.430 1 ATOM 3093 C CD1 . LEU 188 188 ? A -2.365 0.314 5.023 1.000 1 A 90.430 1 ATOM 3094 C CD2 . LEU 188 188 ? A -1.724 2.691 5.224 1.000 1 A 90.430 1 ATOM 3095 H H . LEU 188 188 ? A 1.799 0.582 4.654 1.000 1 A 90.430 1 ATOM 3096 H HA . LEU 188 188 ? A 0.809 2.681 6.353 1.000 1 A 90.430 1 ATOM 3097 H HB2 . LEU 188 188 ? A 0.016 -0.236 5.982 1.000 1 A 90.430 1 ATOM 3098 H HB3 . LEU 188 188 ? A -0.821 0.843 7.088 1.000 1 A 90.430 1 ATOM 3099 H HG . LEU 188 188 ? A -0.660 1.228 4.072 1.000 1 A 90.430 1 ATOM 3100 H HD11 . LEU 188 188 ? A -3.183 0.735 4.439 1.000 1 A 90.430 1 ATOM 3101 H HD12 . LEU 188 188 ? A -2.040 -0.630 4.587 1.000 1 A 90.430 1 ATOM 3102 H HD13 . LEU 188 188 ? A -2.740 0.146 6.033 1.000 1 A 90.430 1 ATOM 3103 H HD21 . LEU 188 188 ? A -2.385 2.744 6.089 1.000 1 A 90.430 1 ATOM 3104 H HD22 . LEU 188 188 ? A -0.912 3.409 5.342 1.000 1 A 90.430 1 ATOM 3105 H HD23 . LEU 188 188 ? A -2.295 2.982 4.342 1.000 1 A 90.430 1 ATOM 3106 N N . GLN 189 189 ? A 2.260 0.168 7.932 1.000 1 A 87.550 1 ATOM 3107 C CA . GLN 189 189 ? A 2.842 -0.228 9.218 1.000 1 A 87.550 1 ATOM 3108 C C . GLN 189 189 ? A 3.841 0.822 9.717 1.000 1 A 87.550 1 ATOM 3109 O O . GLN 189 189 ? A 3.732 1.250 10.866 1.000 1 A 87.550 1 ATOM 3110 C CB . GLN 189 189 ? A 3.479 -1.623 9.096 1.000 1 A 87.550 1 ATOM 3111 C CG . GLN 189 189 ? A 2.398 -2.714 9.036 1.000 1 A 87.550 1 ATOM 3112 C CD . GLN 189 189 ? A 2.955 -4.134 8.925 1.000 1 A 87.550 1 ATOM 3113 O OE1 . GLN 189 189 ? A 3.814 -4.501 8.135 1.000 1 A 87.550 1 ATOM 3114 N NE2 . GLN 189 189 ? A 2.461 -5.040 9.740 1.000 1 A 87.550 1 ATOM 3115 H H . GLN 189 189 ? A 2.406 -0.430 7.132 1.000 1 A 87.550 1 ATOM 3116 H HA . GLN 189 189 ? A 2.049 -0.275 9.964 1.000 1 A 87.550 1 ATOM 3117 H HB2 . GLN 189 189 ? A 4.109 -1.672 8.208 1.000 1 A 87.550 1 ATOM 3118 H HB3 . GLN 189 189 ? A 4.103 -1.805 9.971 1.000 1 A 87.550 1 ATOM 3119 H HG2 . GLN 189 189 ? A 1.801 -2.642 9.946 1.000 1 A 87.550 1 ATOM 3120 H HG3 . GLN 189 189 ? A 1.718 -2.544 8.201 1.000 1 A 87.550 1 ATOM 3121 H HE21 . GLN 189 189 ? A 2.927 -5.936 9.735 1.000 1 A 87.550 1 ATOM 3122 H HE22 . GLN 189 189 ? A 1.819 -4.744 10.461 1.000 1 A 87.550 1 ATOM 3123 N N . ASP 190 190 ? A 4.692 1.322 8.821 1.000 1 A 89.910 1 ATOM 3124 C CA . ASP 190 190 ? A 5.732 2.309 9.129 1.000 1 A 89.910 1 ATOM 3125 C C . ASP 190 190 ? A 5.269 3.776 8.947 1.000 1 A 89.910 1 ATOM 3126 O O . ASP 190 190 ? A 6.056 4.708 9.097 1.000 1 A 89.910 1 ATOM 3127 C CB . ASP 190 190 ? A 7.000 1.958 8.324 1.000 1 A 89.910 1 ATOM 3128 C CG . ASP 190 190 ? A 7.662 0.630 8.740 1.000 1 A 89.910 1 ATOM 3129 O OD1 . ASP 190 190 ? A 7.361 0.123 9.846 1.000 1 A 89.910 1 ATOM 3130 O OD2 . ASP 190 190 ? A 8.499 0.121 7.958 1.000 1 A 89.910 1 ATOM 3131 H H . ASP 190 190 ? A 4.741 0.879 7.914 1.000 1 A 89.910 1 ATOM 3132 H HA . ASP 190 190 ? A 5.994 2.214 10.183 1.000 1 A 89.910 1 ATOM 3133 H HB2 . ASP 190 190 ? A 7.736 2.751 8.457 1.000 1 A 89.910 1 ATOM 3134 H HB3 . ASP 190 190 ? A 6.744 1.910 7.266 1.000 1 A 89.910 1 ATOM 3135 N N . ASN 191 191 ? A 3.978 4.011 8.660 1.000 1 A 90.460 1 ATOM 3136 C CA . ASN 191 191 ? A 3.371 5.343 8.485 1.000 1 A 90.460 1 ATOM 3137 C C . ASN 191 191 ? A 4.068 6.221 7.414 1.000 1 A 90.460 1 ATOM 3138 O O . ASN 191 191 ? A 4.219 7.438 7.565 1.000 1 A 90.460 1 ATOM 3139 C CB . ASN 191 191 ? A 3.243 6.013 9.866 1.000 1 A 90.460 1 ATOM 3140 C CG . ASN 191 191 ? A 2.310 7.209 9.888 1.000 1 A 90.460 1 ATOM 3141 O OD1 . ASN 191 191 ? A 1.330 7.309 9.169 1.000 1 A 90.460 1 ATOM 3142 N ND2 . ASN 191 191 ? A 2.538 8.130 10.795 1.000 1 A 90.460 1 ATOM 3143 H H . ASN 191 191 ? A 3.399 3.198 8.506 1.000 1 A 90.460 1 ATOM 3144 H HA . ASN 191 191 ? A 2.365 5.171 8.104 1.000 1 A 90.460 1 ATOM 3145 H HB2 . ASN 191 191 ? A 4.235 6.329 10.187 1.000 1 A 90.460 1 ATOM 3146 H HB3 . ASN 191 191 ? A 2.872 5.288 10.590 1.000 1 A 90.460 1 ATOM 3147 H HD21 . ASN 191 191 ? A 1.882 8.896 10.847 1.000 1 A 90.460 1 ATOM 3148 H HD22 . ASN 191 191 ? A 3.368 8.060 11.365 1.000 1 A 90.460 1 ATOM 3149 N N . LEU 192 192 ? A 4.484 5.599 6.310 1.000 1 A 92.860 1 ATOM 3150 C CA . LEU 192 192 ? A 5.232 6.216 5.213 1.000 1 A 92.860 1 ATOM 3151 C C . LEU 192 192 ? A 4.296 6.962 4.247 1.000 1 A 92.860 1 ATOM 3152 O O . LEU 192 192 ? A 3.946 6.470 3.173 1.000 1 A 92.860 1 ATOM 3153 C CB . LEU 192 192 ? A 6.076 5.127 4.525 1.000 1 A 92.860 1 ATOM 3154 C CG . LEU 192 192 ? A 7.141 4.483 5.433 1.000 1 A 92.860 1 ATOM 3155 C CD1 . LEU 192 192 ? A 7.855 3.378 4.667 1.000 1 A 92.860 1 ATOM 3156 C CD2 . LEU 192 192 ? A 8.190 5.481 5.923 1.000 1 A 92.860 1 ATOM 3157 H H . LEU 192 192 ? A 4.303 4.607 6.251 1.000 1 A 92.860 1 ATOM 3158 H HA . LEU 192 192 ? A 5.914 6.959 5.627 1.000 1 A 92.860 1 ATOM 3159 H HB2 . LEU 192 192 ? A 6.575 5.556 3.655 1.000 1 A 92.860 1 ATOM 3160 H HB3 . LEU 192 192 ? A 5.406 4.346 4.165 1.000 1 A 92.860 1 ATOM 3161 H HG . LEU 192 192 ? A 6.654 4.035 6.299 1.000 1 A 92.860 1 ATOM 3162 H HD11 . LEU 192 192 ? A 7.138 2.582 4.465 1.000 1 A 92.860 1 ATOM 3163 H HD12 . LEU 192 192 ? A 8.287 3.755 3.740 1.000 1 A 92.860 1 ATOM 3164 H HD13 . LEU 192 192 ? A 8.638 2.948 5.291 1.000 1 A 92.860 1 ATOM 3165 H HD21 . LEU 192 192 ? A 8.619 6.022 5.080 1.000 1 A 92.860 1 ATOM 3166 H HD22 . LEU 192 192 ? A 8.979 4.946 6.452 1.000 1 A 92.860 1 ATOM 3167 H HD23 . LEU 192 192 ? A 7.735 6.178 6.628 1.000 1 A 92.860 1 ATOM 3168 N N . ARG 193 193 ? A 3.875 8.172 4.644 1.000 1 A 92.720 1 ATOM 3169 C CA . ARG 193 193 ? A 2.835 8.976 3.963 1.000 1 A 92.720 1 ATOM 3170 C C . ARG 193 193 ? A 3.049 9.182 2.463 1.000 1 A 92.720 1 ATOM 3171 O O . ARG 193 193 ? A 2.091 9.118 1.698 1.000 1 A 92.720 1 ATOM 3172 C CB . ARG 193 193 ? A 2.708 10.349 4.637 1.000 1 A 92.720 1 ATOM 3173 C CG . ARG 193 193 ? A 2.100 10.264 6.042 1.000 1 A 92.720 1 ATOM 3174 C CD . ARG 193 193 ? A 1.840 11.678 6.568 1.000 1 A 92.720 1 ATOM 3175 N NE . ARG 193 193 ? A 1.164 11.645 7.876 1.000 1 A 92.720 1 ATOM 3176 C CZ . ARG 193 193 ? A 0.759 12.693 8.572 1.000 1 A 92.720 1 ATOM 3177 N NH1 . ARG 193 193 ? A 0.959 13.915 8.158 1.000 1 A 92.720 1 ATOM 3178 N NH2 . ARG 193 193 ? A 0.131 12.531 9.702 1.000 1 A 92.720 1 ATOM 3179 H H . ARG 193 193 ? A 4.157 8.438 5.576 1.000 1 A 92.720 1 ATOM 3180 H HA . ARG 193 193 ? A 1.880 8.457 4.047 1.000 1 A 92.720 1 ATOM 3181 H HB2 . ARG 193 193 ? A 3.685 10.830 4.685 1.000 1 A 92.720 1 ATOM 3182 H HB3 . ARG 193 193 ? A 2.053 10.968 4.023 1.000 1 A 92.720 1 ATOM 3183 H HG2 . ARG 193 193 ? A 2.777 9.738 6.715 1.000 1 A 92.720 1 ATOM 3184 H HG3 . ARG 193 193 ? A 1.155 9.722 5.991 1.000 1 A 92.720 1 ATOM 3185 H HD2 . ARG 193 193 ? A 2.793 12.200 6.655 1.000 1 A 92.720 1 ATOM 3186 H HD3 . ARG 193 193 ? A 1.212 12.205 5.850 1.000 1 A 92.720 1 ATOM 3187 H HE . ARG 193 193 ? A 0.972 10.728 8.252 1.000 1 A 92.720 1 ATOM 3188 H HH11 . ARG 193 193 ? A 0.646 14.707 8.701 1.000 1 A 92.720 1 ATOM 3189 H HH12 . ARG 193 193 ? A 1.429 14.051 7.275 1.000 1 A 92.720 1 ATOM 3190 H HH21 . ARG 193 193 ? A -0.132 11.601 9.997 1.000 1 A 92.720 1 ATOM 3191 H HH22 . ARG 193 193 ? A -0.199 13.331 10.223 1.000 1 A 92.720 1 ATOM 3192 N N . GLU 194 194 ? A 4.281 9.433 2.030 1.000 1 A 92.510 1 ATOM 3193 C CA . GLU 194 194 ? A 4.579 9.651 0.607 1.000 1 A 92.510 1 ATOM 3194 C C . GLU 194 194 ? A 4.409 8.368 -0.214 1.000 1 A 92.510 1 ATOM 3195 O O . GLU 194 194 ? A 3.840 8.416 -1.302 1.000 1 A 92.510 1 ATOM 3196 C CB . GLU 194 194 ? A 6.001 10.180 0.433 1.000 1 A 92.510 1 ATOM 3197 C CG . GLU 194 194 ? A 6.205 11.592 0.993 1.000 1 A 92.510 1 ATOM 3198 C CD . GLU 194 194 ? A 7.671 12.042 0.895 1.000 1 A 92.510 1 ATOM 3199 O OE1 . GLU 194 194 ? A 7.922 13.209 1.261 1.000 1 A 92.510 1 ATOM 3200 O OE2 . GLU 194 194 ? A 8.518 11.206 0.505 1.000 1 A 92.510 1 ATOM 3201 H H . GLU 194 194 ? A 5.033 9.479 2.703 1.000 1 A 92.510 1 ATOM 3202 H HA . GLU 194 194 ? A 3.889 10.388 0.196 1.000 1 A 92.510 1 ATOM 3203 H HB2 . GLU 194 194 ? A 6.245 10.186 -0.629 1.000 1 A 92.510 1 ATOM 3204 H HB3 . GLU 194 194 ? A 6.679 9.498 0.947 1.000 1 A 92.510 1 ATOM 3205 H HG2 . GLU 194 194 ? A 5.901 11.607 2.040 1.000 1 A 92.510 1 ATOM 3206 H HG3 . GLU 194 194 ? A 5.567 12.283 0.442 1.000 1 A 92.510 1 ATOM 3207 N N . ALA 195 195 ? A 4.832 7.213 0.315 1.000 1 A 93.770 1 ATOM 3208 C CA . ALA 195 195 ? A 4.619 5.926 -0.345 1.000 1 A 93.770 1 ATOM 3209 C C . ALA 195 195 ? A 3.134 5.545 -0.382 1.000 1 A 93.770 1 ATOM 3210 O O . ALA 195 195 ? A 2.652 5.093 -1.418 1.000 1 A 93.770 1 ATOM 3211 C CB . ALA 195 195 ? A 5.459 4.851 0.347 1.000 1 A 93.770 1 ATOM 3212 H H . ALA 195 195 ? A 5.232 7.215 1.242 1.000 1 A 93.770 1 ATOM 3213 H HA . ALA 195 195 ? A 4.954 6.002 -1.380 1.000 1 A 93.770 1 ATOM 3214 H HB1 . ALA 195 195 ? A 5.209 3.872 -0.063 1.000 1 A 93.770 1 ATOM 3215 H HB2 . ALA 195 195 ? A 6.514 5.045 0.151 1.000 1 A 93.770 1 ATOM 3216 H HB3 . ALA 195 195 ? A 5.273 4.846 1.421 1.000 1 A 93.770 1 ATOM 3217 N N . ILE 196 196 ? A 2.398 5.784 0.707 1.000 1 A 93.160 1 ATOM 3218 C CA . ILE 196 196 ? A 0.939 5.597 0.770 1.000 1 A 93.160 1 ATOM 3219 C C . ILE 196 196 ? A 0.251 6.432 -0.322 1.000 1 A 93.160 1 ATOM 3220 O O . ILE 196 196 ? A -0.494 5.897 -1.142 1.000 1 A 93.160 1 ATOM 3221 C CB . ILE 196 196 ? A 0.445 5.956 2.193 1.000 1 A 93.160 1 ATOM 3222 C CG1 . ILE 196 196 ? A 0.940 4.918 3.225 1.000 1 A 93.160 1 ATOM 3223 C CG2 . ILE 196 196 ? A -1.084 6.079 2.269 1.000 1 A 93.160 1 ATOM 3224 C CD1 . ILE 196 196 ? A 0.834 5.410 4.675 1.000 1 A 93.160 1 ATOM 3225 H H . ILE 196 196 ? A 2.873 6.121 1.532 1.000 1 A 93.160 1 ATOM 3226 H HA . ILE 196 196 ? A 0.701 4.552 0.573 1.000 1 A 93.160 1 ATOM 3227 H HB . ILE 196 196 ? A 0.862 6.928 2.458 1.000 1 A 93.160 1 ATOM 3228 H HG12 . ILE 196 196 ? A 0.375 3.992 3.114 1.000 1 A 93.160 1 ATOM 3229 H HG13 . ILE 196 196 ? A 1.989 4.686 3.042 1.000 1 A 93.160 1 ATOM 3230 H HG21 . ILE 196 196 ? A -1.441 6.854 1.590 1.000 1 A 93.160 1 ATOM 3231 H HG22 . ILE 196 196 ? A -1.402 6.368 3.271 1.000 1 A 93.160 1 ATOM 3232 H HG23 . ILE 196 196 ? A -1.557 5.129 2.022 1.000 1 A 93.160 1 ATOM 3233 H HD11 . ILE 196 196 ? A 1.271 4.665 5.341 1.000 1 A 93.160 1 ATOM 3234 H HD12 . ILE 196 196 ? A 1.386 6.342 4.794 1.000 1 A 93.160 1 ATOM 3235 H HD13 . ILE 196 196 ? A -0.206 5.572 4.959 1.000 1 A 93.160 1 ATOM 3236 N N . SER 197 197 ? A 0.568 7.729 -0.395 1.000 1 A 92.400 1 ATOM 3237 C CA . SER 197 197 ? A 0.033 8.643 -1.413 1.000 1 A 92.400 1 ATOM 3238 C C . SER 197 197 ? A 0.393 8.202 -2.836 1.000 1 A 92.400 1 ATOM 3239 O O . SER 197 197 ? A -0.469 8.169 -3.716 1.000 1 A 92.400 1 ATOM 3240 C CB . SER 197 197 ? A 0.568 10.051 -1.145 1.000 1 A 92.400 1 ATOM 3241 O OG . SER 197 197 ? A 0.016 10.985 -2.051 1.000 1 A 92.400 1 ATOM 3242 H H . SER 197 197 ? A 1.186 8.106 0.310 1.000 1 A 92.400 1 ATOM 3243 H HA . SER 197 197 ? A -1.054 8.663 -1.334 1.000 1 A 92.400 1 ATOM 3244 H HB2 . SER 197 197 ? A 1.654 10.051 -1.240 1.000 1 A 92.400 1 ATOM 3245 H HB3 . SER 197 197 ? A 0.306 10.344 -0.128 1.000 1 A 92.400 1 ATOM 3246 H HG . SER 197 197 ? A 0.432 11.836 -1.891 1.000 1 A 92.400 1 ATOM 3247 N N . TYR 198 198 ? A 1.646 7.793 -3.063 1.000 1 A 93.760 1 ATOM 3248 C CA . TYR 198 198 ? A 2.088 7.264 -4.352 1.000 1 A 93.760 1 ATOM 3249 C C . TYR 198 198 ? A 1.252 6.054 -4.777 1.000 1 A 93.760 1 ATOM 3250 O O . TYR 198 198 ? A 0.781 6.009 -5.916 1.000 1 A 93.760 1 ATOM 3251 C CB . TYR 198 198 ? A 3.573 6.887 -4.275 1.000 1 A 93.760 1 ATOM 3252 C CG . TYR 198 198 ? A 4.111 6.281 -5.557 1.000 1 A 93.760 1 ATOM 3253 C CD1 . TYR 198 198 ? A 4.061 4.886 -5.763 1.000 1 A 93.760 1 ATOM 3254 C CD2 . TYR 198 198 ? A 4.639 7.122 -6.552 1.000 1 A 93.760 1 ATOM 3255 C CE1 . TYR 198 198 ? A 4.526 4.334 -6.973 1.000 1 A 93.760 1 ATOM 3256 C CE2 . TYR 198 198 ? A 5.107 6.574 -7.761 1.000 1 A 93.760 1 ATOM 3257 C CZ . TYR 198 198 ? A 5.044 5.182 -7.976 1.000 1 A 93.760 1 ATOM 3258 O OH . TYR 198 198 ? A 5.505 4.663 -9.144 1.000 1 A 93.760 1 ATOM 3259 H H . TYR 198 198 ? A 2.321 7.854 -2.314 1.000 1 A 93.760 1 ATOM 3260 H HA . TYR 198 198 ? A 1.964 8.037 -5.109 1.000 1 A 93.760 1 ATOM 3261 H HB2 . TYR 198 198 ? A 3.727 6.174 -3.464 1.000 1 A 93.760 1 ATOM 3262 H HB3 . TYR 198 198 ? A 4.150 7.781 -4.036 1.000 1 A 93.760 1 ATOM 3263 H HD1 . TYR 198 198 ? A 3.653 4.243 -4.999 1.000 1 A 93.760 1 ATOM 3264 H HD2 . TYR 198 198 ? A 4.659 8.191 -6.397 1.000 1 A 93.760 1 ATOM 3265 H HE1 . TYR 198 198 ? A 4.481 3.267 -7.133 1.000 1 A 93.760 1 ATOM 3266 H HE2 . TYR 198 198 ? A 5.461 7.216 -8.554 1.000 1 A 93.760 1 ATOM 3267 H HH . TYR 198 198 ? A 5.261 3.739 -9.229 1.000 1 A 93.760 1 ATOM 3268 N N . VAL 199 199 ? A 1.035 5.102 -3.865 1.000 1 A 93.300 1 ATOM 3269 C CA . VAL 199 199 ? A 0.254 3.895 -4.141 1.000 1 A 93.300 1 ATOM 3270 C C . VAL 199 199 ? A -1.191 4.245 -4.500 1.000 1 A 93.300 1 ATOM 3271 O O . VAL 199 199 ? A -1.685 3.778 -5.526 1.000 1 A 93.300 1 ATOM 3272 C CB . VAL 199 199 ? A 0.338 2.900 -2.969 1.000 1 A 93.300 1 ATOM 3273 C CG1 . VAL 199 199 ? A -0.655 1.751 -3.126 1.000 1 A 93.300 1 ATOM 3274 C CG2 . VAL 199 199 ? A 1.732 2.265 -2.893 1.000 1 A 93.300 1 ATOM 3275 H H . VAL 199 199 ? A 1.425 5.219 -2.941 1.000 1 A 93.300 1 ATOM 3276 H HA . VAL 199 199 ? A 0.694 3.420 -5.019 1.000 1 A 93.300 1 ATOM 3277 H HB . VAL 199 199 ? A 0.129 3.416 -2.032 1.000 1 A 93.300 1 ATOM 3278 H HG11 . VAL 199 199 ? A -0.535 1.269 -4.097 1.000 1 A 93.300 1 ATOM 3279 H HG12 . VAL 199 199 ? A -1.675 2.121 -3.022 1.000 1 A 93.300 1 ATOM 3280 H HG13 . VAL 199 199 ? A -0.499 1.009 -2.343 1.000 1 A 93.300 1 ATOM 3281 H HG21 . VAL 199 199 ? A 2.505 3.032 -2.857 1.000 1 A 93.300 1 ATOM 3282 H HG22 . VAL 199 199 ? A 1.807 1.651 -1.996 1.000 1 A 93.300 1 ATOM 3283 H HG23 . VAL 199 199 ? A 1.892 1.636 -3.769 1.000 1 A 93.300 1 ATOM 3284 N N . TYR 200 200 ? A -1.841 5.129 -3.737 1.000 1 A 90.620 1 ATOM 3285 C CA . TYR 200 200 ? A -3.201 5.586 -4.041 1.000 1 A 90.620 1 ATOM 3286 C C . TYR 200 200 ? A -3.313 6.249 -5.415 1.000 1 A 90.620 1 ATOM 3287 O O . TYR 200 200 ? A -4.300 6.050 -6.119 1.000 1 A 90.620 1 ATOM 3288 C CB . TYR 200 200 ? A -3.672 6.579 -2.969 1.000 1 A 90.620 1 ATOM 3289 C CG . TYR 200 200 ? A -3.837 6.045 -1.560 1.000 1 A 90.620 1 ATOM 3290 C CD1 . TYR 200 200 ? A -4.064 4.676 -1.312 1.000 1 A 90.620 1 ATOM 3291 C CD2 . TYR 200 200 ? A -3.809 6.952 -0.482 1.000 1 A 90.620 1 ATOM 3292 C CE1 . TYR 200 200 ? A -4.248 4.226 0.005 1.000 1 A 90.620 1 ATOM 3293 C CE2 . TYR 200 200 ? A -4.013 6.501 0.836 1.000 1 A 90.620 1 ATOM 3294 C CZ . TYR 200 200 ? A -4.229 5.133 1.083 1.000 1 A 90.620 1 ATOM 3295 O OH . TYR 200 200 ? A -4.384 4.699 2.362 1.000 1 A 90.620 1 ATOM 3296 H H . TYR 200 200 ? A -1.397 5.466 -2.895 1.000 1 A 90.620 1 ATOM 3297 H HA . TYR 200 200 ? A -3.874 4.729 -4.061 1.000 1 A 90.620 1 ATOM 3298 H HB2 . TYR 200 200 ? A -2.974 7.416 -2.942 1.000 1 A 90.620 1 ATOM 3299 H HB3 . TYR 200 200 ? A -4.640 6.974 -3.275 1.000 1 A 90.620 1 ATOM 3300 H HD1 . TYR 200 200 ? A -4.084 3.950 -2.111 1.000 1 A 90.620 1 ATOM 3301 H HD2 . TYR 200 200 ? A -3.647 8.003 -0.668 1.000 1 A 90.620 1 ATOM 3302 H HE1 . TYR 200 200 ? A -4.374 3.171 0.196 1.000 1 A 90.620 1 ATOM 3303 H HE2 . TYR 200 200 ? A -3.993 7.193 1.664 1.000 1 A 90.620 1 ATOM 3304 H HH . TYR 200 200 ? A -4.276 5.408 3.000 1.000 1 A 90.620 1 ATOM 3305 N N . GLN 201 201 ? A -2.309 7.025 -5.823 1.000 1 A 91.780 1 ATOM 3306 C CA . GLN 201 201 ? A -2.337 7.730 -7.104 1.000 1 A 91.780 1 ATOM 3307 C C . GLN 201 201 ? A -2.121 6.800 -8.304 1.000 1 A 91.780 1 ATOM 3308 O O . GLN 201 201 ? A -2.770 6.996 -9.333 1.000 1 A 91.780 1 ATOM 3309 C CB . GLN 201 201 ? A -1.294 8.851 -7.087 1.000 1 A 91.780 1 ATOM 3310 C CG . GLN 201 201 ? A -1.718 10.002 -6.161 1.000 1 A 91.780 1 ATOM 3311 C CD . GLN 201 201 ? A -0.646 11.077 -6.036 1.000 1 A 91.780 1 ATOM 3312 O OE1 . GLN 201 201 ? A 0.364 11.095 -6.723 1.000 1 A 91.780 1 ATOM 3313 N NE2 . GLN 201 201 ? A -0.835 12.041 -5.165 1.000 1 A 91.780 1 ATOM 3314 H H . GLN 201 201 ? A -1.539 7.185 -5.190 1.000 1 A 91.780 1 ATOM 3315 H HA . GLN 201 201 ? A -3.321 8.182 -7.233 1.000 1 A 91.780 1 ATOM 3316 H HB2 . GLN 201 201 ? A -1.177 9.245 -8.096 1.000 1 A 91.780 1 ATOM 3317 H HB3 . GLN 201 201 ? A -0.336 8.450 -6.758 1.000 1 A 91.780 1 ATOM 3318 H HG2 . GLN 201 201 ? A -2.624 10.464 -6.555 1.000 1 A 91.780 1 ATOM 3319 H HG3 . GLN 201 201 ? A -1.944 9.623 -5.165 1.000 1 A 91.780 1 ATOM 3320 H HE21 . GLN 201 201 ? A -0.085 12.713 -5.086 1.000 1 A 91.780 1 ATOM 3321 H HE22 . GLN 201 201 ? A -1.591 11.977 -4.498 1.000 1 A 91.780 1 ATOM 3322 N N . HIS 202 202 ? A -1.241 5.802 -8.177 1.000 1 A 93.780 1 ATOM 3323 C CA . HIS 202 202 ? A -0.802 4.963 -9.300 1.000 1 A 93.780 1 ATOM 3324 C C . HIS 202 202 ? A -1.572 3.641 -9.417 1.000 1 A 93.780 1 ATOM 3325 O O . HIS 202 202 ? A -1.678 3.099 -10.513 1.000 1 A 93.780 1 ATOM 3326 C CB . HIS 202 202 ? A 0.714 4.732 -9.206 1.000 1 A 93.780 1 ATOM 3327 C CG . HIS 202 202 ? A 1.513 6.003 -9.374 1.000 1 A 93.780 1 ATOM 3328 N ND1 . HIS 202 202 ? A 1.672 6.979 -8.422 1.000 1 A 93.780 1 ATOM 3329 C CD2 . HIS 202 202 ? A 2.165 6.433 -10.498 1.000 1 A 93.780 1 ATOM 3330 C CE1 . HIS 202 202 ? A 2.380 7.983 -8.959 1.000 1 A 93.780 1 ATOM 3331 N NE2 . HIS 202 202 ? A 2.727 7.688 -10.222 1.000 1 A 93.780 1 ATOM 3332 H H . HIS 202 202 ? A -0.763 5.697 -7.293 1.000 1 A 93.780 1 ATOM 3333 H HA . HIS 202 202 ? A -0.985 5.499 -10.232 1.000 1 A 93.780 1 ATOM 3334 H HB2 . HIS 202 202 ? A 1.012 4.031 -9.986 1.000 1 A 93.780 1 ATOM 3335 H HB3 . HIS 202 202 ? A 0.955 4.281 -8.243 1.000 1 A 93.780 1 ATOM 3336 H HD1 . HIS 202 202 ? A 1.343 6.913 -7.469 1.000 1 A 93.780 1 ATOM 3337 H HD2 . HIS 202 202 ? A 2.219 5.904 -11.438 1.000 1 A 93.780 1 ATOM 3338 H HE1 . HIS 202 202 ? A 2.651 8.892 -8.442 1.000 1 A 93.780 1 ATOM 3339 N N . PHE 203 203 ? A -2.160 3.146 -8.324 1.000 1 A 93.960 1 ATOM 3340 C CA . PHE 203 203 ? A -2.849 1.851 -8.267 1.000 1 A 93.960 1 ATOM 3341 C C . PHE 203 203 ? A -4.294 2.003 -7.777 1.000 1 A 93.960 1 ATOM 3342 O O . PHE 203 203 ? A -4.762 1.291 -6.888 1.000 1 A 93.960 1 ATOM 3343 C CB . PHE 203 203 ? A -2.024 0.862 -7.437 1.000 1 A 93.960 1 ATOM 3344 C CG . PHE 203 203 ? A -0.586 0.738 -7.894 1.000 1 A 93.960 1 ATOM 3345 C CD1 . PHE 203 203 ? A -0.270 0.031 -9.064 1.000 1 A 93.960 1 ATOM 3346 C CD2 . PHE 203 203 ? A 0.436 1.375 -7.172 1.000 1 A 93.960 1 ATOM 3347 C CE1 . PHE 203 203 ? A 1.056 -0.006 -9.519 1.000 1 A 93.960 1 ATOM 3348 C CE2 . PHE 203 203 ? A 1.770 1.312 -7.609 1.000 1 A 93.960 1 ATOM 3349 C CZ . PHE 203 203 ? A 2.083 0.614 -8.788 1.000 1 A 93.960 1 ATOM 3350 H H . PHE 203 203 ? A -2.008 3.618 -7.444 1.000 1 A 93.960 1 ATOM 3351 H HA . PHE 203 203 ? A -2.913 1.436 -9.273 1.000 1 A 93.960 1 ATOM 3352 H HB2 . PHE 203 203 ? A -2.494 -0.120 -7.496 1.000 1 A 93.960 1 ATOM 3353 H HB3 . PHE 203 203 ? A -2.038 1.186 -6.397 1.000 1 A 93.960 1 ATOM 3354 H HD1 . PHE 203 203 ? A -1.044 -0.469 -9.627 1.000 1 A 93.960 1 ATOM 3355 H HD2 . PHE 203 203 ? A 0.182 1.910 -6.270 1.000 1 A 93.960 1 ATOM 3356 H HE1 . PHE 203 203 ? A 1.275 -0.497 -10.456 1.000 1 A 93.960 1 ATOM 3357 H HE2 . PHE 203 203 ? A 2.547 1.806 -7.044 1.000 1 A 93.960 1 ATOM 3358 H HZ . PHE 203 203 ? A 3.101 0.563 -9.145 1.000 1 A 93.960 1 ATOM 3359 N N . LYS 204 204 ? A -5.024 2.963 -8.361 1.000 1 A 90.290 1 ATOM 3360 C CA . LYS 204 204 ? A -6.420 3.281 -8.000 1.000 1 A 90.290 1 ATOM 3361 C C . LYS 204 204 ? A -7.382 2.101 -8.137 1.000 1 A 90.290 1 ATOM 3362 O O . LYS 204 204 ? A -8.368 2.037 -7.416 1.000 1 A 90.290 1 ATOM 3363 C CB . LYS 204 204 ? A -6.936 4.438 -8.867 1.000 1 A 90.290 1 ATOM 3364 C CG . LYS 204 204 ? A -6.266 5.760 -8.492 1.000 1 A 90.290 1 ATOM 3365 C CD . LYS 204 204 ? A -6.839 6.922 -9.302 1.000 1 A 90.290 1 ATOM 3366 C CE . LYS 204 204 ? A -6.144 8.208 -8.854 1.000 1 A 90.290 1 ATOM 3367 N NZ . LYS 204 204 ? A -6.801 9.402 -9.433 1.000 1 A 90.290 1 ATOM 3368 H H . LYS 204 204 ? A -4.550 3.549 -9.033 1.000 1 A 90.290 1 ATOM 3369 H HA . LYS 204 204 ? A -6.457 3.579 -6.952 1.000 1 A 90.290 1 ATOM 3370 H HB2 . LYS 204 204 ? A -8.010 4.543 -8.709 1.000 1 A 90.290 1 ATOM 3371 H HB3 . LYS 204 204 ? A -6.762 4.218 -9.920 1.000 1 A 90.290 1 ATOM 3372 H HG2 . LYS 204 204 ? A -6.456 5.953 -7.436 1.000 1 A 90.290 1 ATOM 3373 H HG3 . LYS 204 204 ? A -5.192 5.692 -8.665 1.000 1 A 90.290 1 ATOM 3374 H HD2 . LYS 204 204 ? A -7.910 6.991 -9.112 1.000 1 A 90.290 1 ATOM 3375 H HD3 . LYS 204 204 ? A -6.664 6.752 -10.364 1.000 1 A 90.290 1 ATOM 3376 H HE2 . LYS 204 204 ? A -5.094 8.156 -9.144 1.000 1 A 90.290 1 ATOM 3377 H HE3 . LYS 204 204 ? A -6.184 8.253 -7.766 1.000 1 A 90.290 1 ATOM 3378 H HZ1 . LYS 204 204 ? A -7.764 9.439 -9.129 1.000 1 A 90.290 1 ATOM 3379 H HZ2 . LYS 204 204 ? A -6.771 9.370 -10.442 1.000 1 A 90.290 1 ATOM 3380 H HZ3 . LYS 204 204 ? A -6.344 10.242 -9.108 1.000 1 A 90.290 1 ATOM 3381 N N . TYR 205 205 ? A -7.096 1.166 -9.039 1.000 1 A 92.240 1 ATOM 3382 C CA . TYR 205 205 ? A -7.917 -0.029 -9.252 1.000 1 A 92.240 1 ATOM 3383 C C . TYR 205 205 ? A -7.860 -1.025 -8.076 1.000 1 A 92.240 1 ATOM 3384 O O . TYR 205 205 ? A -8.693 -1.919 -8.002 1.000 1 A 92.240 1 ATOM 3385 C CB . TYR 205 205 ? A -7.499 -0.680 -10.576 1.000 1 A 92.240 1 ATOM 3386 C CG . TYR 205 205 ? A -6.110 -1.286 -10.547 1.000 1 A 92.240 1 ATOM 3387 C CD1 . TYR 205 205 ? A -4.976 -0.516 -10.881 1.000 1 A 92.240 1 ATOM 3388 C CD2 . TYR 205 205 ? A -5.959 -2.631 -10.168 1.000 1 A 92.240 1 ATOM 3389 C CE1 . TYR 205 205 ? A -3.691 -1.089 -10.800 1.000 1 A 92.240 1 ATOM 3390 C CE2 . TYR 205 205 ? A -4.680 -3.207 -10.110 1.000 1 A 92.240 1 ATOM 3391 C CZ . TYR 205 205 ? A -3.537 -2.435 -10.400 1.000 1 A 92.240 1 ATOM 3392 O OH . TYR 205 205 ? A -2.297 -2.977 -10.293 1.000 1 A 92.240 1 ATOM 3393 H H . TYR 205 205 ? A -6.240 1.253 -9.568 1.000 1 A 92.240 1 ATOM 3394 H HA . TYR 205 205 ? A -8.959 0.278 -9.345 1.000 1 A 92.240 1 ATOM 3395 H HB2 . TYR 205 205 ? A -8.218 -1.464 -10.816 1.000 1 A 92.240 1 ATOM 3396 H HB3 . TYR 205 205 ? A -7.554 0.061 -11.374 1.000 1 A 92.240 1 ATOM 3397 H HD1 . TYR 205 205 ? A -5.086 0.503 -11.220 1.000 1 A 92.240 1 ATOM 3398 H HD2 . TYR 205 205 ? A -6.822 -3.231 -9.921 1.000 1 A 92.240 1 ATOM 3399 H HE1 . TYR 205 205 ? A -2.814 -0.517 -11.064 1.000 1 A 92.240 1 ATOM 3400 H HE2 . TYR 205 205 ? A -4.572 -4.246 -9.835 1.000 1 A 92.240 1 ATOM 3401 H HH . TYR 205 205 ? A -2.350 -3.883 -9.978 1.000 1 A 92.240 1 ATOM 3402 N N . LEU 206 206 ? A -6.916 -0.852 -7.140 1.000 1 A 92.740 1 ATOM 3403 C CA . LEU 206 206 ? A -6.809 -1.616 -5.890 1.000 1 A 92.740 1 ATOM 3404 C C . LEU 206 206 ? A -7.481 -0.903 -4.699 1.000 1 A 92.740 1 ATOM 3405 O O . LEU 206 206 ? A -7.221 -1.231 -3.545 1.000 1 A 92.740 1 ATOM 3406 C CB . LEU 206 206 ? A -5.327 -1.940 -5.612 1.000 1 A 92.740 1 ATOM 3407 C CG . LEU 206 206 ? A -4.632 -2.821 -6.662 1.000 1 A 92.740 1 ATOM 3408 C CD1 . LEU 206 206 ? A -3.159 -3.008 -6.302 1.000 1 A 92.740 1 ATOM 3409 C CD2 . LEU 206 206 ? A -5.276 -4.205 -6.764 1.000 1 A 92.740 1 ATOM 3410 H H . LEU 206 206 ? A -6.237 -0.116 -7.275 1.000 1 A 92.740 1 ATOM 3411 H HA . LEU 206 206 ? A -7.350 -2.556 -6.007 1.000 1 A 92.740 1 ATOM 3412 H HB2 . LEU 206 206 ? A -5.245 -2.441 -4.647 1.000 1 A 92.740 1 ATOM 3413 H HB3 . LEU 206 206 ? A -4.785 -0.997 -5.546 1.000 1 A 92.740 1 ATOM 3414 H HG . LEU 206 206 ? A -4.682 -2.317 -7.628 1.000 1 A 92.740 1 ATOM 3415 H HD11 . LEU 206 206 ? A -2.669 -3.597 -7.077 1.000 1 A 92.740 1 ATOM 3416 H HD12 . LEU 206 206 ? A -2.668 -2.037 -6.242 1.000 1 A 92.740 1 ATOM 3417 H HD13 . LEU 206 206 ? A -3.070 -3.523 -5.346 1.000 1 A 92.740 1 ATOM 3418 H HD21 . LEU 206 206 ? A -6.294 -4.120 -7.143 1.000 1 A 92.740 1 ATOM 3419 H HD22 . LEU 206 206 ? A -4.710 -4.818 -7.465 1.000 1 A 92.740 1 ATOM 3420 H HD23 . LEU 206 206 ? A -5.279 -4.692 -5.789 1.000 1 A 92.740 1 ATOM 3421 N N . ASN 207 207 ? A -8.349 0.078 -4.953 1.000 1 A 91.460 1 ATOM 3422 C CA . ASN 207 207 ? A -9.022 0.887 -3.932 1.000 1 A 91.460 1 ATOM 3423 C C . ASN 207 207 ? A -9.711 0.085 -2.812 1.000 1 A 91.460 1 ATOM 3424 O O . ASN 207 207 ? A -9.581 0.450 -1.643 1.000 1 A 91.460 1 ATOM 3425 C CB . ASN 207 207 ? A -9.998 1.851 -4.625 1.000 1 A 91.460 1 ATOM 3426 C CG . ASN 207 207 ? A -11.094 1.192 -5.446 1.000 1 A 91.460 1 ATOM 3427 O OD1 . ASN 207 207 ? A -11.122 -0.002 -5.678 1.000 1 A 91.460 1 ATOM 3428 N ND2 . ASN 207 207 ? A -12.045 1.958 -5.920 1.000 1 A 91.460 1 ATOM 3429 H H . ASN 207 207 ? A -8.579 0.265 -5.919 1.000 1 A 91.460 1 ATOM 3430 H HA . ASN 207 207 ? A -8.267 1.492 -3.429 1.000 1 A 91.460 1 ATOM 3431 H HB2 . ASN 207 207 ? A -9.447 2.543 -5.262 1.000 1 A 91.460 1 ATOM 3432 H HB3 . ASN 207 207 ? A -10.488 2.443 -3.852 1.000 1 A 91.460 1 ATOM 3433 H HD21 . ASN 207 207 ? A -12.765 1.478 -6.441 1.000 1 A 91.460 1 ATOM 3434 H HD22 . ASN 207 207 ? A -12.057 2.950 -5.735 1.000 1 A 91.460 1 ATOM 3435 N N . THR 208 208 ? A -10.382 -1.023 -3.128 1.000 1 A 90.190 1 ATOM 3436 C CA . THR 208 208 ? A -11.000 -1.891 -2.115 1.000 1 A 90.190 1 ATOM 3437 C C . THR 208 208 ? A -9.952 -2.488 -1.173 1.000 1 A 90.190 1 ATOM 3438 O O . THR 208 208 ? A -10.159 -2.514 0.037 1.000 1 A 90.190 1 ATOM 3439 C CB . THR 208 208 ? A -11.815 -3.009 -2.780 1.000 1 A 90.190 1 ATOM 3440 O OG1 . THR 208 208 ? A -12.719 -2.438 -3.694 1.000 1 A 90.190 1 ATOM 3441 C CG2 . THR 208 208 ? A -12.647 -3.808 -1.781 1.000 1 A 90.190 1 ATOM 3442 H H . THR 208 208 ? A -10.600 -1.191 -4.100 1.000 1 A 90.190 1 ATOM 3443 H HA . THR 208 208 ? A -11.683 -1.293 -1.512 1.000 1 A 90.190 1 ATOM 3444 H HB . THR 208 208 ? A -11.145 -3.683 -3.313 1.000 1 A 90.190 1 ATOM 3445 H HG1 . THR 208 208 ? A -13.397 -3.091 -3.884 1.000 1 A 90.190 1 ATOM 3446 H HG21 . THR 208 208 ? A -12.000 -4.286 -1.045 1.000 1 A 90.190 1 ATOM 3447 H HG22 . THR 208 208 ? A -13.346 -3.147 -1.268 1.000 1 A 90.190 1 ATOM 3448 H HG23 . THR 208 208 ? A -13.205 -4.586 -2.301 1.000 1 A 90.190 1 ATOM 3449 N N . TRP 209 209 ? A -8.781 -2.885 -1.684 1.000 1 A 91.030 1 ATOM 3450 C CA . TRP 209 209 ? A -7.675 -3.377 -0.855 1.000 1 A 91.030 1 ATOM 3451 C C . TRP 209 209 ? A -7.096 -2.299 0.055 1.000 1 A 91.030 1 ATOM 3452 O O . TRP 209 209 ? A -6.717 -2.592 1.190 1.000 1 A 91.030 1 ATOM 3453 C CB . TRP 209 209 ? A -6.569 -3.966 -1.736 1.000 1 A 91.030 1 ATOM 3454 C CG . TRP 209 209 ? A -6.893 -5.326 -2.239 1.000 1 A 91.030 1 ATOM 3455 C CD1 . TRP 209 209 ? A -7.312 -5.657 -3.481 1.000 1 A 91.030 1 ATOM 3456 C CD2 . TRP 209 209 ? A -6.862 -6.561 -1.471 1.000 1 A 91.030 1 ATOM 3457 N NE1 . TRP 209 209 ? A -7.551 -7.017 -3.532 1.000 1 A 91.030 1 ATOM 3458 C CE2 . TRP 209 209 ? A -7.298 -7.619 -2.316 1.000 1 A 91.030 1 ATOM 3459 C CE3 . TRP 209 209 ? A -6.518 -6.883 -0.139 1.000 1 A 91.030 1 ATOM 3460 C CZ2 . TRP 209 209 ? A -7.399 -8.935 -1.855 1.000 1 A 91.030 1 ATOM 3461 C CZ3 . TRP 209 209 ? A -6.616 -8.205 0.330 1.000 1 A 91.030 1 ATOM 3462 C CH2 . TRP 209 209 ? A -7.063 -9.227 -0.524 1.000 1 A 91.030 1 ATOM 3463 H H . TRP 209 209 ? A -8.605 -2.735 -2.667 1.000 1 A 91.030 1 ATOM 3464 H HA . TRP 209 209 ? A -8.048 -4.168 -0.204 1.000 1 A 91.030 1 ATOM 3465 H HB2 . TRP 209 209 ? A -6.341 -3.306 -2.573 1.000 1 A 91.030 1 ATOM 3466 H HB3 . TRP 209 209 ? A -5.660 -4.053 -1.141 1.000 1 A 91.030 1 ATOM 3467 H HD1 . TRP 209 209 ? A -7.454 -4.961 -4.295 1.000 1 A 91.030 1 ATOM 3468 H HE1 . TRP 209 209 ? A -7.910 -7.490 -4.349 1.000 1 A 91.030 1 ATOM 3469 H HE3 . TRP 209 209 ? A -6.197 -6.096 0.528 1.000 1 A 91.030 1 ATOM 3470 H HZ2 . TRP 209 209 ? A -7.746 -9.715 -2.518 1.000 1 A 91.030 1 ATOM 3471 H HZ3 . TRP 209 209 ? A -6.383 -8.432 1.360 1.000 1 A 91.030 1 ATOM 3472 H HH2 . TRP 209 209 ? A -7.188 -10.231 -0.146 1.000 1 A 91.030 1 ATOM 3473 N N . TRP 210 210 ? A -7.059 -1.051 -0.410 1.000 1 A 92.060 1 ATOM 3474 C CA . TRP 210 210 ? A -6.652 0.097 0.402 1.000 1 A 92.060 1 ATOM 3475 C C . TRP 210 210 ? A -7.593 0.311 1.578 1.000 1 A 92.060 1 ATOM 3476 O O . TRP 210 210 ? A -7.124 0.479 2.704 1.000 1 A 92.060 1 ATOM 3477 C CB . TRP 210 210 ? A -6.531 1.331 -0.496 1.000 1 A 92.060 1 ATOM 3478 C CG . TRP 210 210 ? A -5.632 1.173 -1.696 1.000 1 A 92.060 1 ATOM 3479 C CD1 . TRP 210 210 ? A -5.763 1.837 -2.868 1.000 1 A 92.060 1 ATOM 3480 C CD2 . TRP 210 210 ? A -4.494 0.271 -1.889 1.000 1 A 92.060 1 ATOM 3481 N NE1 . TRP 210 210 ? A -4.833 1.377 -3.782 1.000 1 A 92.060 1 ATOM 3482 C CE2 . TRP 210 210 ? A -4.003 0.436 -3.218 1.000 1 A 92.060 1 ATOM 3483 C CE3 . TRP 210 210 ? A -3.845 -0.705 -1.103 1.000 1 A 92.060 1 ATOM 3484 C CZ2 . TRP 210 210 ? A -2.912 -0.294 -3.712 1.000 1 A 92.060 1 ATOM 3485 C CZ3 . TRP 210 210 ? A -2.750 -1.431 -1.582 1.000 1 A 92.060 1 ATOM 3486 C CH2 . TRP 210 210 ? A -2.266 -1.214 -2.872 1.000 1 A 92.060 1 ATOM 3487 H H . TRP 210 210 ? A -7.331 -0.889 -1.369 1.000 1 A 92.060 1 ATOM 3488 H HA . TRP 210 210 ? A -5.681 -0.089 0.862 1.000 1 A 92.060 1 ATOM 3489 H HB2 . TRP 210 210 ? A -7.523 1.611 -0.851 1.000 1 A 92.060 1 ATOM 3490 H HB3 . TRP 210 210 ? A -6.186 2.163 0.118 1.000 1 A 92.060 1 ATOM 3491 H HD1 . TRP 210 210 ? A -6.512 2.590 -3.065 1.000 1 A 92.060 1 ATOM 3492 H HE1 . TRP 210 210 ? A -4.815 1.636 -4.758 1.000 1 A 92.060 1 ATOM 3493 H HE3 . TRP 210 210 ? A -4.199 -0.937 -0.110 1.000 1 A 92.060 1 ATOM 3494 H HZ2 . TRP 210 210 ? A -2.574 -0.149 -4.728 1.000 1 A 92.060 1 ATOM 3495 H HZ3 . TRP 210 210 ? A -2.299 -2.185 -0.953 1.000 1 A 92.060 1 ATOM 3496 H HH2 . TRP 210 210 ? A -1.416 -1.791 -3.208 1.000 1 A 92.060 1 ATOM 3497 N N . LEU 211 211 ? A -8.900 0.204 1.335 1.000 1 A 92.780 1 ATOM 3498 C CA . LEU 211 211 ? A -9.915 0.279 2.379 1.000 1 A 92.780 1 ATOM 3499 C C . LEU 211 211 ? A -9.779 -0.876 3.387 1.000 1 A 92.780 1 ATOM 3500 O O . LEU 211 211 ? A -9.711 -0.618 4.587 1.000 1 A 92.780 1 ATOM 3501 C CB . LEU 211 211 ? A -11.297 0.332 1.704 1.000 1 A 92.780 1 ATOM 3502 C CG . LEU 211 211 ? A -12.451 0.631 2.675 1.000 1 A 92.780 1 ATOM 3503 C CD1 . LEU 211 211 ? A -12.354 2.042 3.251 1.000 1 A 92.780 1 ATOM 3504 C CD2 . LEU 211 211 ? A -13.783 0.531 1.940 1.000 1 A 92.780 1 ATOM 3505 H H . LEU 211 211 ? A -9.201 0.059 0.382 1.000 1 A 92.780 1 ATOM 3506 H HA . LEU 211 211 ? A -9.751 1.206 2.928 1.000 1 A 92.780 1 ATOM 3507 H HB2 . LEU 211 211 ? A -11.491 -0.626 1.222 1.000 1 A 92.780 1 ATOM 3508 H HB3 . LEU 211 211 ? A -11.288 1.100 0.931 1.000 1 A 92.780 1 ATOM 3509 H HG . LEU 211 211 ? A -12.446 -0.096 3.488 1.000 1 A 92.780 1 ATOM 3510 H HD11 . LEU 211 211 ? A -12.328 2.779 2.449 1.000 1 A 92.780 1 ATOM 3511 H HD12 . LEU 211 211 ? A -11.461 2.136 3.870 1.000 1 A 92.780 1 ATOM 3512 H HD13 . LEU 211 211 ? A -13.230 2.229 3.872 1.000 1 A 92.780 1 ATOM 3513 H HD21 . LEU 211 211 ? A -13.869 -0.449 1.470 1.000 1 A 92.780 1 ATOM 3514 H HD22 . LEU 211 211 ? A -13.860 1.309 1.180 1.000 1 A 92.780 1 ATOM 3515 H HD23 . LEU 211 211 ? A -14.601 0.649 2.650 1.000 1 A 92.780 1 ATOM 3516 N N . ILE 212 212 ? A -9.637 -2.122 2.912 1.000 1 A 92.380 1 ATOM 3517 C CA . ILE 212 212 ? A -9.414 -3.313 3.760 1.000 1 A 92.380 1 ATOM 3518 C C . ILE 212 212 ? A -8.176 -3.127 4.642 1.000 1 A 92.380 1 ATOM 3519 O O . ILE 212 212 ? A -8.221 -3.331 5.852 1.000 1 A 92.380 1 ATOM 3520 C CB . ILE 212 212 ? A -9.282 -4.595 2.896 1.000 1 A 92.380 1 ATOM 3521 C CG1 . ILE 212 212 ? A -10.629 -4.937 2.229 1.000 1 A 92.380 1 ATOM 3522 C CG2 . ILE 212 212 ? A -8.804 -5.804 3.727 1.000 1 A 92.380 1 ATOM 3523 C CD1 . ILE 212 212 ? A -10.541 -5.991 1.117 1.000 1 A 92.380 1 ATOM 3524 H H . ILE 212 212 ? A -9.734 -2.258 1.916 1.000 1 A 92.380 1 ATOM 3525 H HA . ILE 212 212 ? A -10.267 -3.440 4.428 1.000 1 A 92.380 1 ATOM 3526 H HB . ILE 212 212 ? A -8.543 -4.410 2.116 1.000 1 A 92.380 1 ATOM 3527 H HG12 . ILE 212 212 ? A -11.336 -5.277 2.986 1.000 1 A 92.380 1 ATOM 3528 H HG13 . ILE 212 212 ? A -11.037 -4.033 1.777 1.000 1 A 92.380 1 ATOM 3529 H HG21 . ILE 212 212 ? A -8.724 -6.693 3.102 1.000 1 A 92.380 1 ATOM 3530 H HG22 . ILE 212 212 ? A -7.818 -5.622 4.155 1.000 1 A 92.380 1 ATOM 3531 H HG23 . ILE 212 212 ? A -9.510 -6.009 4.532 1.000 1 A 92.380 1 ATOM 3532 H HD11 . ILE 212 212 ? A -10.242 -6.958 1.518 1.000 1 A 92.380 1 ATOM 3533 H HD12 . ILE 212 212 ? A -11.522 -6.103 0.654 1.000 1 A 92.380 1 ATOM 3534 H HD13 . ILE 212 212 ? A -9.827 -5.672 0.357 1.000 1 A 92.380 1 ATOM 3535 N N . CYS 213 213 ? A -7.058 -2.697 4.061 1.000 1 A 91.520 1 ATOM 3536 C CA . CYS 213 213 ? A -5.838 -2.476 4.825 1.000 1 A 91.520 1 ATOM 3537 C C . CYS 213 213 ? A -6.006 -1.340 5.849 1.000 1 A 91.520 1 ATOM 3538 O O . CYS 213 213 ? A -5.558 -1.476 6.986 1.000 1 A 91.520 1 ATOM 3539 C CB . CYS 213 213 ? A -4.703 -2.171 3.852 1.000 1 A 91.520 1 ATOM 3540 S SG . CYS 213 213 ? A -4.234 -3.620 2.868 1.000 1 A 91.520 1 ATOM 3541 H H . CYS 213 213 ? A -7.059 -2.534 3.064 1.000 1 A 91.520 1 ATOM 3542 H HA . CYS 213 213 ? A -5.598 -3.382 5.382 1.000 1 A 91.520 1 ATOM 3543 H HB2 . CYS 213 213 ? A -3.834 -1.836 4.419 1.000 1 A 91.520 1 ATOM 3544 H HB3 . CYS 213 213 ? A -5.048 -1.381 3.185 1.000 1 A 91.520 1 ATOM 3545 H HG . CYS 213 213 ? A -5.337 -3.624 2.114 1.000 1 A 91.520 1 ATOM 3546 N N . ALA 214 214 ? A -6.662 -0.233 5.494 1.000 1 A 92.940 1 ATOM 3547 C CA . ALA 214 214 ? A -6.898 0.855 6.439 1.000 1 A 92.940 1 ATOM 3548 C C . ALA 214 214 ? A -7.741 0.396 7.643 1.000 1 A 92.940 1 ATOM 3549 O O . ALA 214 214 ? A -7.407 0.737 8.782 1.000 1 A 92.940 1 ATOM 3550 C CB . ALA 214 214 ? A -7.538 2.036 5.704 1.000 1 A 92.940 1 ATOM 3551 H H . ALA 214 214 ? A -7.034 -0.146 4.559 1.000 1 A 92.940 1 ATOM 3552 H HA . ALA 214 214 ? A -5.928 1.174 6.821 1.000 1 A 92.940 1 ATOM 3553 H HB1 . ALA 214 214 ? A -6.903 2.346 4.874 1.000 1 A 92.940 1 ATOM 3554 H HB2 . ALA 214 214 ? A -7.652 2.873 6.393 1.000 1 A 92.940 1 ATOM 3555 H HB3 . ALA 214 214 ? A -8.518 1.754 5.318 1.000 1 A 92.940 1 ATOM 3556 N N . LEU 215 215 ? A -8.761 -0.436 7.393 1.000 1 A 94.280 1 ATOM 3557 C CA . LEU 215 215 ? A -9.569 -1.093 8.420 1.000 1 A 94.280 1 ATOM 3558 C C . LEU 215 215 ? A -8.693 -1.980 9.307 1.000 1 A 94.280 1 ATOM 3559 O O . LEU 215 215 ? A -8.541 -1.691 10.487 1.000 1 A 94.280 1 ATOM 3560 C CB . LEU 215 215 ? A -10.716 -1.890 7.763 1.000 1 A 94.280 1 ATOM 3561 C CG . LEU 215 215 ? A -11.808 -0.992 7.159 1.000 1 A 94.280 1 ATOM 3562 C CD1 . LEU 215 215 ? A -12.631 -1.748 6.122 1.000 1 A 94.280 1 ATOM 3563 C CD2 . LEU 215 215 ? A -12.755 -0.480 8.243 1.000 1 A 94.280 1 ATOM 3564 H H . LEU 215 215 ? A -8.974 -0.647 6.428 1.000 1 A 94.280 1 ATOM 3565 H HA . LEU 215 215 ? A -9.999 -0.332 9.071 1.000 1 A 94.280 1 ATOM 3566 H HB2 . LEU 215 215 ? A -11.173 -2.547 8.503 1.000 1 A 94.280 1 ATOM 3567 H HB3 . LEU 215 215 ? A -10.304 -2.524 6.977 1.000 1 A 94.280 1 ATOM 3568 H HG . LEU 215 215 ? A -11.345 -0.141 6.661 1.000 1 A 94.280 1 ATOM 3569 H HD11 . LEU 215 215 ? A -13.364 -1.075 5.679 1.000 1 A 94.280 1 ATOM 3570 H HD12 . LEU 215 215 ? A -13.147 -2.583 6.596 1.000 1 A 94.280 1 ATOM 3571 H HD13 . LEU 215 215 ? A -11.983 -2.124 5.330 1.000 1 A 94.280 1 ATOM 3572 H HD21 . LEU 215 215 ? A -13.280 -1.316 8.706 1.000 1 A 94.280 1 ATOM 3573 H HD22 . LEU 215 215 ? A -12.204 0.054 9.017 1.000 1 A 94.280 1 ATOM 3574 H HD23 . LEU 215 215 ? A -13.494 0.190 7.804 1.000 1 A 94.280 1 ATOM 3575 N N . CYS 216 216 ? A -8.039 -3.004 8.760 1.000 1 A 91.000 1 ATOM 3576 C CA . CYS 216 216 ? A -7.316 -4.003 9.557 1.000 1 A 91.000 1 ATOM 3577 C C . CYS 216 216 ? A -6.050 -3.476 10.264 1.000 1 A 91.000 1 ATOM 3578 O O . CYS 216 216 ? A -5.560 -4.100 11.207 1.000 1 A 91.000 1 ATOM 3579 C CB . CYS 216 216 ? A -6.920 -5.153 8.634 1.000 1 A 91.000 1 ATOM 3580 S SG . CYS 216 216 ? A -8.353 -5.892 7.797 1.000 1 A 91.000 1 ATOM 3581 H H . CYS 216 216 ? A -8.195 -3.202 7.782 1.000 1 A 91.000 1 ATOM 3582 H HA . CYS 216 216 ? A -7.983 -4.390 10.327 1.000 1 A 91.000 1 ATOM 3583 H HB2 . CYS 216 216 ? A -6.428 -5.925 9.225 1.000 1 A 91.000 1 ATOM 3584 H HB3 . CYS 216 216 ? A -6.227 -4.769 7.885 1.000 1 A 91.000 1 ATOM 3585 H HG . CYS 216 216 ? A -9.156 -5.996 8.859 1.000 1 A 91.000 1 ATOM 3586 N N . PHE 217 217 ? A -5.464 -2.365 9.804 1.000 1 A 90.440 1 ATOM 3587 C CA . PHE 217 217 ? A -4.248 -1.778 10.389 1.000 1 A 90.440 1 ATOM 3588 C C . PHE 217 217 ? A -4.512 -0.550 11.276 1.000 1 A 90.440 1 ATOM 3589 O O . PHE 217 217 ? A -3.566 0.176 11.596 1.000 1 A 90.440 1 ATOM 3590 C CB . PHE 217 217 ? A -3.172 -1.547 9.310 1.000 1 A 90.440 1 ATOM 3591 C CG . PHE 217 217 ? A -2.565 -2.831 8.770 1.000 1 A 90.440 1 ATOM 3592 C CD1 . PHE 217 217 ? A -1.561 -3.494 9.501 1.000 1 A 90.440 1 ATOM 3593 C CD2 . PHE 217 217 ? A -2.999 -3.379 7.550 1.000 1 A 90.440 1 ATOM 3594 C CE1 . PHE 217 217 ? A -1.030 -4.710 9.030 1.000 1 A 90.440 1 ATOM 3595 C CE2 . PHE 217 217 ? A -2.478 -4.592 7.081 1.000 1 A 90.440 1 ATOM 3596 C CZ . PHE 217 217 ? A -1.500 -5.265 7.827 1.000 1 A 90.440 1 ATOM 3597 H H . PHE 217 217 ? A -5.865 -1.926 8.987 1.000 1 A 90.440 1 ATOM 3598 H HA . PHE 217 217 ? A -3.825 -2.507 11.080 1.000 1 A 90.440 1 ATOM 3599 H HB2 . PHE 217 217 ? A -3.590 -0.956 8.495 1.000 1 A 90.440 1 ATOM 3600 H HB3 . PHE 217 217 ? A -2.354 -0.963 9.733 1.000 1 A 90.440 1 ATOM 3601 H HD1 . PHE 217 217 ? A -1.204 -3.057 10.422 1.000 1 A 90.440 1 ATOM 3602 H HD2 . PHE 217 217 ? A -3.745 -2.875 6.954 1.000 1 A 90.440 1 ATOM 3603 H HE1 . PHE 217 217 ? A -0.267 -5.232 9.589 1.000 1 A 90.440 1 ATOM 3604 H HE2 . PHE 217 217 ? A -2.845 -5.008 6.154 1.000 1 A 90.440 1 ATOM 3605 H HZ . PHE 217 217 ? A -1.111 -6.206 7.467 1.000 1 A 90.440 1 ATOM 3606 N N . ASN 218 218 ? A -5.758 -0.341 11.713 1.000 1 A 93.300 1 ATOM 3607 C CA . ASN 218 218 ? A -6.153 0.733 12.630 1.000 1 A 93.300 1 ATOM 3608 C C . ASN 218 218 ? A -5.848 2.148 12.109 1.000 1 A 93.300 1 ATOM 3609 O O . ASN 218 218 ? A -5.427 3.035 12.855 1.000 1 A 93.300 1 ATOM 3610 C CB . ASN 218 218 ? A -5.622 0.434 14.052 1.000 1 A 93.300 1 ATOM 3611 C CG . ASN 218 218 ? A -6.490 1.011 15.161 1.000 1 A 93.300 1 ATOM 3612 O OD1 . ASN 218 218 ? A -7.603 1.469 14.975 1.000 1 A 93.300 1 ATOM 3613 N ND2 . ASN 218 218 ? A -6.019 0.982 16.385 1.000 1 A 93.300 1 ATOM 3614 H H . ASN 218 218 ? A -6.485 -0.981 11.429 1.000 1 A 93.300 1 ATOM 3615 H HA . ASN 218 218 ? A -7.241 0.680 12.673 1.000 1 A 93.300 1 ATOM 3616 H HB2 . ASN 218 218 ? A -4.610 0.827 14.152 1.000 1 A 93.300 1 ATOM 3617 H HB3 . ASN 218 218 ? A -5.580 -0.644 14.212 1.000 1 A 93.300 1 ATOM 3618 H HD21 . ASN 218 218 ? A -5.232 0.387 16.605 1.000 1 A 93.300 1 ATOM 3619 H HD22 . ASN 218 218 ? A -6.639 1.285 17.122 1.000 1 A 93.300 1 ATOM 3620 N N . LYS 219 219 ? A -6.005 2.365 10.796 1.000 1 A 93.300 1 ATOM 3621 C CA . LYS 219 219 ? A -5.645 3.620 10.118 1.000 1 A 93.300 1 ATOM 3622 C C . LYS 219 219 ? A -6.868 4.502 9.898 1.000 1 A 93.300 1 ATOM 3623 O O . LYS 219 219 ? A -7.327 4.693 8.779 1.000 1 A 93.300 1 ATOM 3624 C CB . LYS 219 219 ? A -4.881 3.334 8.817 1.000 1 A 93.300 1 ATOM 3625 C CG . LYS 219 219 ? A -3.602 2.514 9.011 1.000 1 A 93.300 1 ATOM 3626 C CD . LYS 219 219 ? A -2.594 3.216 9.929 1.000 1 A 93.300 1 ATOM 3627 C CE . LYS 219 219 ? A -1.296 2.418 9.924 1.000 1 A 93.300 1 ATOM 3628 N NZ . LYS 219 219 ? A -0.218 3.108 10.667 1.000 1 A 93.300 1 ATOM 3629 H H . LYS 219 219 ? A -6.408 1.625 10.240 1.000 1 A 93.300 1 ATOM 3630 H HA . LYS 219 219 ? A -4.987 4.201 10.763 1.000 1 A 93.300 1 ATOM 3631 H HB2 . LYS 219 219 ? A -4.610 4.284 8.357 1.000 1 A 93.300 1 ATOM 3632 H HB3 . LYS 219 219 ? A -5.539 2.805 8.128 1.000 1 A 93.300 1 ATOM 3633 H HG2 . LYS 219 219 ? A -3.853 1.532 9.412 1.000 1 A 93.300 1 ATOM 3634 H HG3 . LYS 219 219 ? A -3.145 2.357 8.034 1.000 1 A 93.300 1 ATOM 3635 H HD2 . LYS 219 219 ? A -2.987 3.261 10.945 1.000 1 A 93.300 1 ATOM 3636 H HD3 . LYS 219 219 ? A -2.412 4.222 9.551 1.000 1 A 93.300 1 ATOM 3637 H HE2 . LYS 219 219 ? A -1.486 1.430 10.341 1.000 1 A 93.300 1 ATOM 3638 H HE3 . LYS 219 219 ? A -0.989 2.295 8.885 1.000 1 A 93.300 1 ATOM 3639 H HZ1 . LYS 219 219 ? A -0.360 3.049 11.665 1.000 1 A 93.300 1 ATOM 3640 H HZ2 . LYS 219 219 ? A 0.661 2.681 10.409 1.000 1 A 93.300 1 ATOM 3641 H HZ3 . LYS 219 219 ? A -0.166 4.073 10.372 1.000 1 A 93.300 1 ATOM 3642 N N . LEU 220 220 ? A -7.368 5.076 10.991 1.000 1 A 95.370 1 ATOM 3643 C CA . LEU 220 220 ? A -8.583 5.899 11.027 1.000 1 A 95.370 1 ATOM 3644 C C . LEU 220 220 ? A -8.620 7.031 9.981 1.000 1 A 95.370 1 ATOM 3645 O O . LEU 220 220 ? A -9.627 7.217 9.306 1.000 1 A 95.370 1 ATOM 3646 C CB . LEU 220 220 ? A -8.689 6.465 12.450 1.000 1 A 95.370 1 ATOM 3647 C CG . LEU 220 220 ? A -9.866 7.427 12.673 1.000 1 A 95.370 1 ATOM 3648 C CD1 . LEU 220 220 ? A -11.220 6.759 12.459 1.000 1 A 95.370 1 ATOM 3649 C CD2 . LEU 220 220 ? A -9.787 7.952 14.100 1.000 1 A 95.370 1 ATOM 3650 H H . LEU 220 220 ? A -6.958 4.798 11.871 1.000 1 A 95.370 1 ATOM 3651 H HA . LEU 220 220 ? A -9.442 5.256 10.837 1.000 1 A 95.370 1 ATOM 3652 H HB2 . LEU 220 220 ? A -7.767 6.998 12.685 1.000 1 A 95.370 1 ATOM 3653 H HB3 . LEU 220 220 ? A -8.780 5.629 13.143 1.000 1 A 95.370 1 ATOM 3654 H HG . LEU 220 220 ? A -9.776 8.279 11.999 1.000 1 A 95.370 1 ATOM 3655 H HD11 . LEU 220 220 ? A -11.308 5.877 13.094 1.000 1 A 95.370 1 ATOM 3656 H HD12 . LEU 220 220 ? A -11.345 6.470 11.416 1.000 1 A 95.370 1 ATOM 3657 H HD13 . LEU 220 220 ? A -12.017 7.458 12.714 1.000 1 A 95.370 1 ATOM 3658 H HD21 . LEU 220 220 ? A -10.627 8.623 14.279 1.000 1 A 95.370 1 ATOM 3659 H HD22 . LEU 220 220 ? A -9.850 7.134 14.818 1.000 1 A 95.370 1 ATOM 3660 H HD23 . LEU 220 220 ? A -8.860 8.507 14.244 1.000 1 A 95.370 1 ATOM 3661 N N . PHE 221 221 ? A -7.535 7.798 9.843 1.000 1 A 94.440 1 ATOM 3662 C CA . PHE 221 221 ? A -7.501 8.941 8.923 1.000 1 A 94.440 1 ATOM 3663 C C . PHE 221 221 ? A -7.506 8.507 7.453 1.000 1 A 94.440 1 ATOM 3664 O O . PHE 221 221 ? A -8.215 9.106 6.643 1.000 1 A 94.440 1 ATOM 3665 C CB . PHE 221 221 ? A -6.280 9.817 9.225 1.000 1 A 94.440 1 ATOM 3666 C CG . PHE 221 221 ? A -6.330 10.491 10.581 1.000 1 A 94.440 1 ATOM 3667 C CD1 . PHE 221 221 ? A -7.081 11.669 10.748 1.000 1 A 94.440 1 ATOM 3668 C CD2 . PHE 221 221 ? A -5.645 9.937 11.680 1.000 1 A 94.440 1 ATOM 3669 C CE1 . PHE 221 221 ? A -7.150 12.288 12.008 1.000 1 A 94.440 1 ATOM 3670 C CE2 . PHE 221 221 ? A -5.719 10.555 12.942 1.000 1 A 94.440 1 ATOM 3671 C CZ . PHE 221 221 ? A -6.472 11.731 13.105 1.000 1 A 94.440 1 ATOM 3672 H H . PHE 221 221 ? A -6.732 7.611 10.426 1.000 1 A 94.440 1 ATOM 3673 H HA . PHE 221 221 ? A -8.400 9.539 9.076 1.000 1 A 94.440 1 ATOM 3674 H HB2 . PHE 221 221 ? A -5.376 9.213 9.150 1.000 1 A 94.440 1 ATOM 3675 H HB3 . PHE 221 221 ? A -6.214 10.594 8.463 1.000 1 A 94.440 1 ATOM 3676 H HD1 . PHE 221 221 ? A -7.618 12.094 9.913 1.000 1 A 94.440 1 ATOM 3677 H HD2 . PHE 221 221 ? A -5.071 9.029 11.561 1.000 1 A 94.440 1 ATOM 3678 H HE1 . PHE 221 221 ? A -7.739 13.184 12.141 1.000 1 A 94.440 1 ATOM 3679 H HE2 . PHE 221 221 ? A -5.213 10.122 13.792 1.000 1 A 94.440 1 ATOM 3680 H HZ . PHE 221 221 ? A -6.544 12.203 14.074 1.000 1 A 94.440 1 ATOM 3681 N N . ASP 222 222 ? A -6.748 7.459 7.118 1.000 1 A 92.120 1 ATOM 3682 C CA . ASP 222 222 ? A -6.749 6.857 5.784 1.000 1 A 92.120 1 ATOM 3683 C C . ASP 222 222 ? A -8.123 6.266 5.457 1.000 1 A 92.120 1 ATOM 3684 O O . ASP 222 222 ? A -8.668 6.546 4.394 1.000 1 A 92.120 1 ATOM 3685 C CB . ASP 222 222 ? A -5.668 5.772 5.698 1.000 1 A 92.120 1 ATOM 3686 C CG . ASP 222 222 ? A -4.264 6.354 5.844 1.000 1 A 92.120 1 ATOM 3687 O OD1 . ASP 222 222 ? A -3.762 6.883 4.825 1.000 1 A 92.120 1 ATOM 3688 O OD2 . ASP 222 222 ? A -3.716 6.279 6.969 1.000 1 A 92.120 1 ATOM 3689 H H . ASP 222 222 ? A -6.177 7.012 7.822 1.000 1 A 92.120 1 ATOM 3690 H HA . ASP 222 222 ? A -6.527 7.622 5.040 1.000 1 A 92.120 1 ATOM 3691 H HB2 . ASP 222 222 ? A -5.746 5.277 4.730 1.000 1 A 92.120 1 ATOM 3692 H HB3 . ASP 222 222 ? A -5.841 5.019 6.467 1.000 1 A 92.120 1 ATOM 3693 N N . LEU 223 223 ? A -8.718 5.532 6.404 1.000 1 A 94.990 1 ATOM 3694 C CA . LEU 223 223 ? A -10.060 4.963 6.296 1.000 1 A 94.990 1 ATOM 3695 C C . LEU 223 223 ? A -11.103 6.038 5.979 1.000 1 A 94.990 1 ATOM 3696 O O . LEU 223 223 ? A -11.807 5.932 4.978 1.000 1 A 94.990 1 ATOM 3697 C CB . LEU 223 223 ? A -10.382 4.224 7.609 1.000 1 A 94.990 1 ATOM 3698 C CG . LEU 223 223 ? A -11.836 3.738 7.737 1.000 1 A 94.990 1 ATOM 3699 C CD1 . LEU 223 223 ? A -12.203 2.816 6.584 1.000 1 A 94.990 1 ATOM 3700 C CD2 . LEU 223 223 ? A -12.002 2.991 9.056 1.000 1 A 94.990 1 ATOM 3701 H H . LEU 223 223 ? A -8.200 5.344 7.250 1.000 1 A 94.990 1 ATOM 3702 H HA . LEU 223 223 ? A -10.072 4.246 5.474 1.000 1 A 94.990 1 ATOM 3703 H HB2 . LEU 223 223 ? A -10.183 4.887 8.451 1.000 1 A 94.990 1 ATOM 3704 H HB3 . LEU 223 223 ? A -9.713 3.369 7.698 1.000 1 A 94.990 1 ATOM 3705 H HG . LEU 223 223 ? A -12.517 4.589 7.742 1.000 1 A 94.990 1 ATOM 3706 H HD11 . LEU 223 223 ? A -12.328 3.409 5.678 1.000 1 A 94.990 1 ATOM 3707 H HD12 . LEU 223 223 ? A -13.152 2.326 6.800 1.000 1 A 94.990 1 ATOM 3708 H HD13 . LEU 223 223 ? A -11.427 2.065 6.435 1.000 1 A 94.990 1 ATOM 3709 H HD21 . LEU 223 223 ? A -11.836 3.675 9.888 1.000 1 A 94.990 1 ATOM 3710 H HD22 . LEU 223 223 ? A -11.290 2.167 9.104 1.000 1 A 94.990 1 ATOM 3711 H HD23 . LEU 223 223 ? A -13.014 2.592 9.132 1.000 1 A 94.990 1 ATOM 3712 N N . HIS 224 224 ? A -11.163 7.098 6.790 1.000 1 A 95.670 1 ATOM 3713 C CA . HIS 224 224 ? A -12.103 8.196 6.578 1.000 1 A 95.670 1 ATOM 3714 C C . HIS 224 224 ? A -11.892 8.865 5.210 1.000 1 A 95.670 1 ATOM 3715 O O . HIS 224 224 ? A -12.855 9.160 4.506 1.000 1 A 95.670 1 ATOM 3716 C CB . HIS 224 224 ? A -11.957 9.196 7.734 1.000 1 A 95.670 1 ATOM 3717 C CG . HIS 224 224 ? A -12.845 10.406 7.590 1.000 1 A 95.670 1 ATOM 3718 N ND1 . HIS 224 224 ? A -14.137 10.540 8.040 1.000 1 A 95.670 1 ATOM 3719 C CD2 . HIS 224 224 ? A -12.525 11.574 6.955 1.000 1 A 95.670 1 ATOM 3720 C CE1 . HIS 224 224 ? A -14.587 11.751 7.674 1.000 1 A 95.670 1 ATOM 3721 N NE2 . HIS 224 224 ? A -13.626 12.431 7.020 1.000 1 A 95.670 1 ATOM 3722 H H . HIS 224 224 ? A -10.572 7.113 7.609 1.000 1 A 95.670 1 ATOM 3723 H HA . HIS 224 224 ? A -13.117 7.797 6.590 1.000 1 A 95.670 1 ATOM 3724 H HB2 . HIS 224 224 ? A -10.921 9.529 7.795 1.000 1 A 95.670 1 ATOM 3725 H HB3 . HIS 224 224 ? A -12.202 8.692 8.669 1.000 1 A 95.670 1 ATOM 3726 H HD1 . HIS 224 224 ? A -14.651 9.882 8.608 1.000 1 A 95.670 1 ATOM 3727 H HD2 . HIS 224 224 ? A -11.583 11.785 6.470 1.000 1 A 95.670 1 ATOM 3728 H HE1 . HIS 224 224 ? A -15.569 12.139 7.902 1.000 1 A 95.670 1 ATOM 3729 N N . ASN 225 225 ? A -10.640 9.079 4.789 1.000 1 A 92.950 1 ATOM 3730 C CA . ASN 225 225 ? A -10.349 9.659 3.478 1.000 1 A 92.950 1 ATOM 3731 C C . ASN 225 225 ? A -10.817 8.751 2.325 1.000 1 A 92.950 1 ATOM 3732 O O . ASN 225 225 ? A -11.456 9.227 1.390 1.000 1 A 92.950 1 ATOM 3733 C CB . ASN 225 225 ? A -8.847 9.980 3.401 1.000 1 A 92.950 1 ATOM 3734 C CG . ASN 225 225 ? A -8.500 10.782 2.159 1.000 1 A 92.950 1 ATOM 3735 O OD1 . ASN 225 225 ? A -8.834 11.951 2.049 1.000 1 A 92.950 1 ATOM 3736 N ND2 . ASN 225 225 ? A -7.815 10.206 1.203 1.000 1 A 92.950 1 ATOM 3737 H H . ASN 225 225 ? A -9.872 8.779 5.373 1.000 1 A 92.950 1 ATOM 3738 H HA . ASN 225 225 ? A -10.913 10.587 3.386 1.000 1 A 92.950 1 ATOM 3739 H HB2 . ASN 225 225 ? A -8.273 9.054 3.414 1.000 1 A 92.950 1 ATOM 3740 H HB3 . ASN 225 225 ? A -8.555 10.567 4.271 1.000 1 A 92.950 1 ATOM 3741 H HD21 . ASN 225 225 ? A -7.596 9.222 1.259 1.000 1 A 92.950 1 ATOM 3742 H HD22 . ASN 225 225 ? A -7.751 10.706 0.328 1.000 1 A 92.950 1 ATOM 3743 N N . LEU 226 226 ? A -10.537 7.450 2.401 1.000 1 A 92.800 1 ATOM 3744 C CA . LEU 226 226 ? A -10.921 6.476 1.378 1.000 1 A 92.800 1 ATOM 3745 C C . LEU 226 226 ? A -12.448 6.301 1.286 1.000 1 A 92.800 1 ATOM 3746 O O . LEU 226 226 ? A -13.005 6.267 0.188 1.000 1 A 92.800 1 ATOM 3747 C CB . LEU 226 226 ? A -10.220 5.140 1.696 1.000 1 A 92.800 1 ATOM 3748 C CG . LEU 226 226 ? A -8.692 5.148 1.484 1.000 1 A 92.800 1 ATOM 3749 C CD1 . LEU 226 226 ? A -8.100 3.866 2.067 1.000 1 A 92.800 1 ATOM 3750 C CD2 . LEU 226 226 ? A -8.282 5.222 0.011 1.000 1 A 92.800 1 ATOM 3751 H H . LEU 226 226 ? A -10.040 7.111 3.211 1.000 1 A 92.800 1 ATOM 3752 H HA . LEU 226 226 ? A -10.588 6.833 0.403 1.000 1 A 92.800 1 ATOM 3753 H HB2 . LEU 226 226 ? A -10.430 4.886 2.735 1.000 1 A 92.800 1 ATOM 3754 H HB3 . LEU 226 226 ? A -10.652 4.348 1.084 1.000 1 A 92.800 1 ATOM 3755 H HG . LEU 226 226 ? A -8.246 6.002 1.993 1.000 1 A 92.800 1 ATOM 3756 H HD11 . LEU 226 226 ? A -8.529 3.000 1.564 1.000 1 A 92.800 1 ATOM 3757 H HD12 . LEU 226 226 ? A -8.325 3.812 3.133 1.000 1 A 92.800 1 ATOM 3758 H HD13 . LEU 226 226 ? A -7.017 3.864 1.942 1.000 1 A 92.800 1 ATOM 3759 H HD21 . LEU 226 226 ? A -7.195 5.264 -0.060 1.000 1 A 92.800 1 ATOM 3760 H HD22 . LEU 226 226 ? A -8.635 4.336 -0.517 1.000 1 A 92.800 1 ATOM 3761 H HD23 . LEU 226 226 ? A -8.694 6.117 -0.455 1.000 1 A 92.800 1 ATOM 3762 N N . TYR 227 227 ? A -13.131 6.222 2.427 1.000 1 A 94.820 1 ATOM 3763 C CA . TYR 227 227 ? A -14.568 5.956 2.478 1.000 1 A 94.820 1 ATOM 3764 C C . TYR 227 227 ? A -15.421 7.197 2.165 1.000 1 A 94.820 1 ATOM 3765 O O . TYR 227 227 ? A -16.292 7.140 1.297 1.000 1 A 94.820 1 ATOM 3766 C CB . TYR 227 227 ? A -14.910 5.352 3.844 1.000 1 A 94.820 1 ATOM 3767 C CG . TYR 227 227 ? A -16.351 4.905 3.944 1.000 1 A 94.820 1 ATOM 3768 C CD1 . TYR 227 227 ? A -17.281 5.682 4.661 1.000 1 A 94.820 1 ATOM 3769 C CD2 . TYR 227 227 ? A -16.769 3.727 3.296 1.000 1 A 94.820 1 ATOM 3770 C CE1 . TYR 227 227 ? A -18.627 5.285 4.732 1.000 1 A 94.820 1 ATOM 3771 C CE2 . TYR 227 227 ? A -18.118 3.328 3.363 1.000 1 A 94.820 1 ATOM 3772 C CZ . TYR 227 227 ? A -19.046 4.105 4.085 1.000 1 A 94.820 1 ATOM 3773 O OH . TYR 227 227 ? A -20.352 3.736 4.122 1.000 1 A 94.820 1 ATOM 3774 H H . TYR 227 227 ? A -12.622 6.236 3.299 1.000 1 A 94.820 1 ATOM 3775 H HA . TYR 227 227 ? A -14.809 5.209 1.722 1.000 1 A 94.820 1 ATOM 3776 H HB2 . TYR 227 227 ? A -14.271 4.486 4.020 1.000 1 A 94.820 1 ATOM 3777 H HB3 . TYR 227 227 ? A -14.700 6.081 4.627 1.000 1 A 94.820 1 ATOM 3778 H HD1 . TYR 227 227 ? A -16.975 6.590 5.159 1.000 1 A 94.820 1 ATOM 3779 H HD2 . TYR 227 227 ? A -16.057 3.121 2.755 1.000 1 A 94.820 1 ATOM 3780 H HE1 . TYR 227 227 ? A -19.328 5.899 5.279 1.000 1 A 94.820 1 ATOM 3781 H HE2 . TYR 227 227 ? A -18.445 2.403 2.913 1.000 1 A 94.820 1 ATOM 3782 H HH . TYR 227 227 ? A -20.831 4.204 4.809 1.000 1 A 94.820 1 ATOM 3783 N N . GLU 228 228 ? A -15.155 8.339 2.809 1.000 1 A 92.000 1 ATOM 3784 C CA . GLU 228 228 ? A -15.987 9.545 2.656 1.000 1 A 92.000 1 ATOM 3785 C C . GLU 228 228 ? A -15.575 10.410 1.461 1.000 1 A 92.000 1 ATOM 3786 O O . GLU 228 228 ? A -16.424 10.872 0.694 1.000 1 A 92.000 1 ATOM 3787 C CB . GLU 228 228 ? A -15.959 10.390 3.944 1.000 1 A 92.000 1 ATOM 3788 C CG . GLU 228 228 ? A -16.748 9.762 5.102 1.000 1 A 92.000 1 ATOM 3789 C CD . GLU 228 228 ? A -18.243 9.600 4.775 1.000 1 A 92.000 1 ATOM 3790 O OE1 . GLU 228 228 ? A -18.843 8.624 5.272 1.000 1 A 92.000 1 ATOM 3791 O OE2 . GLU 228 228 ? A -18.773 10.429 3.999 1.000 1 A 92.000 1 ATOM 3792 H H . GLU 228 228 ? A -14.427 8.347 3.509 1.000 1 A 92.000 1 ATOM 3793 H HA . GLU 228 228 ? A -17.020 9.250 2.471 1.000 1 A 92.000 1 ATOM 3794 H HB2 . GLU 228 228 ? A -14.927 10.554 4.257 1.000 1 A 92.000 1 ATOM 3795 H HB3 . GLU 228 228 ? A -16.378 11.374 3.733 1.000 1 A 92.000 1 ATOM 3796 H HG2 . GLU 228 228 ? A -16.642 10.398 5.980 1.000 1 A 92.000 1 ATOM 3797 H HG3 . GLU 228 228 ? A -16.306 8.794 5.340 1.000 1 A 92.000 1 ATOM 3798 N N . LYS 229 229 ? A -14.267 10.641 1.275 1.000 1 A 88.800 1 ATOM 3799 C CA . LYS 229 229 ? A -13.777 11.585 0.255 1.000 1 A 88.800 1 ATOM 3800 C C . LYS 229 229 ? A -13.608 10.922 -1.106 1.000 1 A 88.800 1 ATOM 3801 O O . LYS 229 229 ? A -14.139 11.428 -2.092 1.000 1 A 88.800 1 ATOM 3802 C CB . LYS 229 229 ? A -12.494 12.289 0.711 1.000 1 A 88.800 1 ATOM 3803 C CG . LYS 229 229 ? A -12.721 13.176 1.943 1.000 1 A 88.800 1 ATOM 3804 C CD . LYS 229 229 ? A -11.365 13.638 2.467 1.000 1 A 88.800 1 ATOM 3805 C CE . LYS 229 229 ? A -11.483 14.683 3.568 1.000 1 A 88.800 1 ATOM 3806 N NZ . LYS 229 229 ? A -10.129 15.077 4.019 1.000 1 A 88.800 1 ATOM 3807 H H . LYS 229 229 ? A -13.609 10.169 1.879 1.000 1 A 88.800 1 ATOM 3808 H HA . LYS 229 229 ? A -14.536 12.352 0.103 1.000 1 A 88.800 1 ATOM 3809 H HB2 . LYS 229 229 ? A -11.716 11.556 0.922 1.000 1 A 88.800 1 ATOM 3810 H HB3 . LYS 229 229 ? A -12.135 12.916 -0.105 1.000 1 A 88.800 1 ATOM 3811 H HG2 . LYS 229 229 ? A -13.231 12.620 2.730 1.000 1 A 88.800 1 ATOM 3812 H HG3 . LYS 229 229 ? A -13.326 14.037 1.660 1.000 1 A 88.800 1 ATOM 3813 H HD2 . LYS 229 229 ? A -10.765 14.026 1.644 1.000 1 A 88.800 1 ATOM 3814 H HD3 . LYS 229 229 ? A -10.881 12.762 2.899 1.000 1 A 88.800 1 ATOM 3815 H HE2 . LYS 229 229 ? A -12.031 15.543 3.183 1.000 1 A 88.800 1 ATOM 3816 H HE3 . LYS 229 229 ? A -12.056 14.256 4.391 1.000 1 A 88.800 1 ATOM 3817 H HZ1 . LYS 229 229 ? A -10.188 15.736 4.782 1.000 1 A 88.800 1 ATOM 3818 H HZ2 . LYS 229 229 ? A -9.614 15.479 3.249 1.000 1 A 88.800 1 ATOM 3819 H HZ3 . LYS 229 229 ? A -9.631 14.253 4.324 1.000 1 A 88.800 1 ATOM 3820 N N . GLU 230 230 ? A -12.928 9.778 -1.155 1.000 1 A 88.640 1 ATOM 3821 C CA . GLU 230 230 ? A -12.752 9.001 -2.394 1.000 1 A 88.640 1 ATOM 3822 C C . GLU 230 230 ? A -13.989 8.146 -2.736 1.000 1 A 88.640 1 ATOM 3823 O O . GLU 230 230 ? A -14.079 7.603 -3.836 1.000 1 A 88.640 1 ATOM 3824 C CB . GLU 230 230 ? A -11.486 8.132 -2.313 1.000 1 A 88.640 1 ATOM 3825 C CG . GLU 230 230 ? A -10.180 8.909 -2.076 1.000 1 A 88.640 1 ATOM 3826 C CD . GLU 230 230 ? A -9.776 9.843 -3.229 1.000 1 A 88.640 1 ATOM 3827 O OE1 . GLU 230 230 ? A -9.063 10.831 -2.938 1.000 1 A 88.640 1 ATOM 3828 O OE2 . GLU 230 230 ? A -10.123 9.554 -4.398 1.000 1 A 88.640 1 ATOM 3829 H H . GLU 230 230 ? A -12.485 9.448 -0.309 1.000 1 A 88.640 1 ATOM 3830 H HA . GLU 230 230 ? A -12.617 9.689 -3.229 1.000 1 A 88.640 1 ATOM 3831 H HB2 . GLU 230 230 ? A -11.604 7.417 -1.499 1.000 1 A 88.640 1 ATOM 3832 H HB3 . GLU 230 230 ? A -11.390 7.553 -3.231 1.000 1 A 88.640 1 ATOM 3833 H HG2 . GLU 230 230 ? A -9.382 8.181 -1.930 1.000 1 A 88.640 1 ATOM 3834 H HG3 . GLU 230 230 ? A -10.261 9.478 -1.150 1.000 1 A 88.640 1 ATOM 3835 N N . LYS 231 231 ? A -14.969 8.058 -1.821 1.000 1 A 91.490 1 ATOM 3836 C CA . LYS 231 231 ? A -16.249 7.350 -1.998 1.000 1 A 91.490 1 ATOM 3837 C C . LYS 231 231 ? A -16.087 5.875 -2.371 1.000 1 A 91.490 1 ATOM 3838 O O . LYS 231 231 ? A -16.901 5.331 -3.120 1.000 1 A 91.490 1 ATOM 3839 C CB . LYS 231 231 ? A -17.170 8.110 -2.965 1.000 1 A 91.490 1 ATOM 3840 C CG . LYS 231 231 ? A -17.492 9.523 -2.472 1.000 1 A 91.490 1 ATOM 3841 C CD . LYS 231 231 ? A -18.445 10.205 -3.454 1.000 1 A 91.490 1 ATOM 3842 C CE . LYS 231 231 ? A -18.760 11.604 -2.929 1.000 1 A 91.490 1 ATOM 3843 N NZ . LYS 231 231 ? A -19.674 12.331 -3.841 1.000 1 A 91.490 1 ATOM 3844 H H . LYS 231 231 ? A -14.797 8.497 -0.927 1.000 1 A 91.490 1 ATOM 3845 H HA . LYS 231 231 ? A -16.744 7.332 -1.027 1.000 1 A 91.490 1 ATOM 3846 H HB2 . LYS 231 231 ? A -18.108 7.563 -3.062 1.000 1 A 91.490 1 ATOM 3847 H HB3 . LYS 231 231 ? A -16.701 8.162 -3.948 1.000 1 A 91.490 1 ATOM 3848 H HG2 . LYS 231 231 ? A -16.577 10.110 -2.398 1.000 1 A 91.490 1 ATOM 3849 H HG3 . LYS 231 231 ? A -17.959 9.464 -1.489 1.000 1 A 91.490 1 ATOM 3850 H HD2 . LYS 231 231 ? A -19.362 9.620 -3.537 1.000 1 A 91.490 1 ATOM 3851 H HD3 . LYS 231 231 ? A -17.963 10.272 -4.430 1.000 1 A 91.490 1 ATOM 3852 H HE2 . LYS 231 231 ? A -17.819 12.144 -2.818 1.000 1 A 91.490 1 ATOM 3853 H HE3 . LYS 231 231 ? A -19.196 11.513 -1.934 1.000 1 A 91.490 1 ATOM 3854 H HZ1 . LYS 231 231 ? A -19.245 12.426 -4.750 1.000 1 A 91.490 1 ATOM 3855 H HZ2 . LYS 231 231 ? A -20.548 11.833 -3.935 1.000 1 A 91.490 1 ATOM 3856 H HZ3 . LYS 231 231 ? A -19.861 13.252 -3.472 1.000 1 A 91.490 1 ATOM 3857 N N . ILE 232 232 ? A -15.056 5.218 -1.844 1.000 1 A 90.080 1 ATOM 3858 C CA . ILE 232 232 ? A -14.871 3.775 -2.006 1.000 1 A 90.080 1 ATOM 3859 C C . ILE 232 232 ? A -15.917 3.088 -1.129 1.000 1 A 90.080 1 ATOM 3860 O O . ILE 232 232 ? A -15.853 3.158 0.097 1.000 1 A 90.080 1 ATOM 3861 C CB . ILE 232 232 ? A -13.430 3.355 -1.656 1.000 1 A 90.080 1 ATOM 3862 C CG1 . ILE 232 232 ? A -12.418 4.096 -2.562 1.000 1 A 90.080 1 ATOM 3863 C CG2 . ILE 232 232 ? A -13.268 1.830 -1.833 1.000 1 A 90.080 1 ATOM 3864 C CD1 . ILE 232 232 ? A -11.002 4.103 -1.984 1.000 1 A 90.080 1 ATOM 3865 H H . ILE 232 232 ? A -14.445 5.714 -1.210 1.000 1 A 90.080 1 ATOM 3866 H HA . ILE 232 232 ? A -15.056 3.509 -3.046 1.000 1 A 90.080 1 ATOM 3867 H HB . ILE 232 232 ? A -13.235 3.614 -0.616 1.000 1 A 90.080 1 ATOM 3868 H HG12 . ILE 232 232 ? A -12.700 5.141 -2.686 1.000 1 A 90.080 1 ATOM 3869 H HG13 . ILE 232 232 ? A -12.417 3.642 -3.553 1.000 1 A 90.080 1 ATOM 3870 H HG21 . ILE 232 232 ? A -13.969 1.292 -1.196 1.000 1 A 90.080 1 ATOM 3871 H HG22 . ILE 232 232 ? A -12.264 1.519 -1.544 1.000 1 A 90.080 1 ATOM 3872 H HG23 . ILE 232 232 ? A -13.444 1.541 -2.869 1.000 1 A 90.080 1 ATOM 3873 H HD11 . ILE 232 232 ? A -10.993 4.740 -1.099 1.000 1 A 90.080 1 ATOM 3874 H HD12 . ILE 232 232 ? A -10.312 4.527 -2.714 1.000 1 A 90.080 1 ATOM 3875 H HD13 . ILE 232 232 ? A -10.674 3.102 -1.706 1.000 1 A 90.080 1 ATOM 3876 N N . ARG 233 233 ? A -16.919 2.475 -1.763 1.000 1 A 89.970 1 ATOM 3877 C CA . ARG 233 233 ? A -18.051 1.864 -1.065 1.000 1 A 89.970 1 ATOM 3878 C C . ARG 233 233 ? A -17.754 0.417 -0.697 1.000 1 A 89.970 1 ATOM 3879 O O . ARG 233 233 ? A -17.320 -0.369 -1.532 1.000 1 A 89.970 1 ATOM 3880 C CB . ARG 233 233 ? A -19.346 1.991 -1.888 1.000 1 A 89.970 1 ATOM 3881 C CG . ARG 233 233 ? A -19.799 3.440 -2.131 1.000 1 A 89.970 1 ATOM 3882 C CD . ARG 233 233 ? A -20.036 4.198 -0.816 1.000 1 A 89.970 1 ATOM 3883 N NE . ARG 233 233 ? A -20.518 5.572 -1.042 1.000 1 A 89.970 1 ATOM 3884 C CZ . ARG 233 233 ? A -20.674 6.483 -0.093 1.000 1 A 89.970 1 ATOM 3885 N NH1 . ARG 233 233 ? A -20.462 6.229 1.169 1.000 1 A 89.970 1 ATOM 3886 N NH2 . ARG 233 233 ? A -21.052 7.693 -0.395 1.000 1 A 89.970 1 ATOM 3887 H H . ARG 233 233 ? A -16.898 2.442 -2.772 1.000 1 A 89.970 1 ATOM 3888 H HA . ARG 233 233 ? A -18.187 2.381 -0.115 1.000 1 A 89.970 1 ATOM 3889 H HB2 . ARG 233 233 ? A -19.204 1.500 -2.851 1.000 1 A 89.970 1 ATOM 3890 H HB3 . ARG 233 233 ? A -20.144 1.465 -1.364 1.000 1 A 89.970 1 ATOM 3891 H HG2 . ARG 233 233 ? A -20.728 3.419 -2.700 1.000 1 A 89.970 1 ATOM 3892 H HG3 . ARG 233 233 ? A -19.049 3.963 -2.724 1.000 1 A 89.970 1 ATOM 3893 H HD2 . ARG 233 233 ? A -20.762 3.648 -0.217 1.000 1 A 89.970 1 ATOM 3894 H HD3 . ARG 233 233 ? A -19.097 4.252 -0.265 1.000 1 A 89.970 1 ATOM 3895 H HE . ARG 233 233 ? A -20.677 5.848 -2.000 1.000 1 A 89.970 1 ATOM 3896 H HH11 . ARG 233 233 ? A -20.149 5.312 1.453 1.000 1 A 89.970 1 ATOM 3897 H HH12 . ARG 233 233 ? A -20.455 6.955 1.871 1.000 1 A 89.970 1 ATOM 3898 H HH21 . ARG 233 233 ? A -21.133 8.356 0.363 1.000 1 A 89.970 1 ATOM 3899 H HH22 . ARG 233 233 ? A -21.300 7.928 -1.346 1.000 1 A 89.970 1 ATOM 3900 N N . MET 234 234 ? A -18.049 0.100 0.552 1.000 1 A 93.590 1 ATOM 3901 C CA . MET 234 234 ? A -18.087 -1.228 1.145 1.000 1 A 93.590 1 ATOM 3902 C C . MET 234 234 ? A -19.252 -1.213 2.127 1.000 1 A 93.590 1 ATOM 3903 O O . MET 234 234 ? A -19.559 -0.157 2.688 1.000 1 A 93.590 1 ATOM 3904 C CB . MET 234 234 ? A -16.752 -1.501 1.838 1.000 1 A 93.590 1 ATOM 3905 C CG . MET 234 234 ? A -16.634 -2.897 2.461 1.000 1 A 93.590 1 ATOM 3906 S SD . MET 234 234 ? A -14.994 -3.194 3.177 1.000 1 A 93.590 1 ATOM 3907 C CE . MET 234 234 ? A -14.061 -3.498 1.658 1.000 1 A 93.590 1 ATOM 3908 H H . MET 234 234 ? A -18.399 0.827 1.160 1.000 1 A 93.590 1 ATOM 3909 H HA . MET 234 234 ? A -18.265 -1.984 0.380 1.000 1 A 93.590 1 ATOM 3910 H HB2 . MET 234 234 ? A -16.595 -0.756 2.617 1.000 1 A 93.590 1 ATOM 3911 H HB3 . MET 234 234 ? A -15.967 -1.384 1.090 1.000 1 A 93.590 1 ATOM 3912 H HG2 . MET 234 234 ? A -16.838 -3.658 1.708 1.000 1 A 93.590 1 ATOM 3913 H HG3 . MET 234 234 ? A -17.377 -2.999 3.253 1.000 1 A 93.590 1 ATOM 3914 H HE1 . MET 234 234 ? A -14.260 -4.512 1.309 1.000 1 A 93.590 1 ATOM 3915 H HE2 . MET 234 234 ? A -14.346 -2.788 0.882 1.000 1 A 93.590 1 ATOM 3916 H HE3 . MET 234 234 ? A -12.999 -3.380 1.871 1.000 1 A 93.590 1 ATOM 3917 N N . ASP 235 235 ? A -19.929 -2.344 2.282 1.000 1 A 94.560 1 ATOM 3918 C CA . ASP 235 235 ? A -20.994 -2.458 3.269 1.000 1 A 94.560 1 ATOM 3919 C C . ASP 235 235 ? A -20.442 -2.194 4.682 1.000 1 A 94.560 1 ATOM 3920 O O . ASP 235 235 ? A -19.330 -2.606 5.009 1.000 1 A 94.560 1 ATOM 3921 C CB . ASP 235 235 ? A -21.646 -3.831 3.130 1.000 1 A 94.560 1 ATOM 3922 C CG . ASP 235 235 ? A -22.665 -4.008 4.240 1.000 1 A 94.560 1 ATOM 3923 O OD1 . ASP 235 235 ? A -22.280 -4.644 5.242 1.000 1 A 94.560 1 ATOM 3924 O OD2 . ASP 235 235 ? A -23.745 -3.395 4.115 1.000 1 A 94.560 1 ATOM 3925 H H . ASP 235 235 ? A -19.594 -3.200 1.864 1.000 1 A 94.560 1 ATOM 3926 H HA . ASP 235 235 ? A -21.756 -1.706 3.063 1.000 1 A 94.560 1 ATOM 3927 H HB2 . ASP 235 235 ? A -22.138 -3.906 2.160 1.000 1 A 94.560 1 ATOM 3928 H HB3 . ASP 235 235 ? A -20.888 -4.612 3.194 1.000 1 A 94.560 1 ATOM 3929 N N . VAL 236 236 ? A -21.191 -1.471 5.515 1.000 1 A 95.390 1 ATOM 3930 C CA . VAL 236 236 ? A -20.695 -1.010 6.822 1.000 1 A 95.390 1 ATOM 3931 C C . VAL 236 236 ? A -20.500 -2.182 7.796 1.000 1 A 95.390 1 ATOM 3932 O O . VAL 236 236 ? A -19.538 -2.180 8.569 1.000 1 A 95.390 1 ATOM 3933 C CB . VAL 236 236 ? A -21.625 0.089 7.375 1.000 1 A 95.390 1 ATOM 3934 C CG1 . VAL 236 236 ? A -21.291 0.482 8.810 1.000 1 A 95.390 1 ATOM 3935 C CG2 . VAL 236 236 ? A -21.537 1.366 6.527 1.000 1 A 95.390 1 ATOM 3936 H H . VAL 236 236 ? A -22.139 -1.252 5.245 1.000 1 A 95.390 1 ATOM 3937 H HA . VAL 236 236 ? A -19.710 -0.567 6.677 1.000 1 A 95.390 1 ATOM 3938 H HB . VAL 236 236 ? A -22.654 -0.269 7.352 1.000 1 A 95.390 1 ATOM 3939 H HG11 . VAL 236 236 ? A -20.225 0.679 8.923 1.000 1 A 95.390 1 ATOM 3940 H HG12 . VAL 236 236 ? A -21.868 1.356 9.110 1.000 1 A 95.390 1 ATOM 3941 H HG13 . VAL 236 236 ? A -21.599 -0.349 9.445 1.000 1 A 95.390 1 ATOM 3942 H HG21 . VAL 236 236 ? A -22.222 2.116 6.921 1.000 1 A 95.390 1 ATOM 3943 H HG22 . VAL 236 236 ? A -21.813 1.150 5.495 1.000 1 A 95.390 1 ATOM 3944 H HG23 . VAL 236 236 ? A -20.518 1.754 6.548 1.000 1 A 95.390 1 ATOM 3945 N N . ASP 237 237 ? A -21.333 -3.225 7.715 1.000 1 A 95.070 1 ATOM 3946 C CA . ASP 237 237 ? A -21.151 -4.450 8.501 1.000 1 A 95.070 1 ATOM 3947 C C . ASP 237 237 ? A -19.984 -5.292 7.965 1.000 1 A 95.070 1 ATOM 3948 O O . ASP 237 237 ? A -19.255 -5.930 8.731 1.000 1 A 95.070 1 ATOM 3949 C CB . ASP 237 237 ? A -22.445 -5.281 8.526 1.000 1 A 95.070 1 ATOM 3950 C CG . ASP 237 237 ? A -23.561 -4.643 9.354 1.000 1 A 95.070 1 ATOM 3951 O OD1 . ASP 237 237 ? A -23.230 -4.074 10.420 1.000 1 A 95.070 1 ATOM 3952 O OD2 . ASP 237 237 ? A -24.743 -4.810 8.987 1.000 1 A 95.070 1 ATOM 3953 H H . ASP 237 237 ? A -22.038 -3.248 6.992 1.000 1 A 95.070 1 ATOM 3954 H HA . ASP 237 237 ? A -20.907 -4.177 9.528 1.000 1 A 95.070 1 ATOM 3955 H HB2 . ASP 237 237 ? A -22.219 -6.249 8.975 1.000 1 A 95.070 1 ATOM 3956 H HB3 . ASP 237 237 ? A -22.798 -5.470 7.512 1.000 1 A 95.070 1 ATOM 3957 N N . GLU 238 238 ? A -19.739 -5.277 6.653 1.000 1 A 92.810 1 ATOM 3958 C CA . GLU 238 238 ? A -18.513 -5.829 6.075 1.000 1 A 92.810 1 ATOM 3959 C C . GLU 238 238 ? A -17.263 -5.086 6.567 1.000 1 A 92.810 1 ATOM 3960 O O . GLU 238 238 ? A -16.325 -5.733 7.035 1.000 1 A 92.810 1 ATOM 3961 C CB . GLU 238 238 ? A -18.615 -5.868 4.546 1.000 1 A 92.810 1 ATOM 3962 C CG . GLU 238 238 ? A -17.427 -6.608 3.920 1.000 1 A 92.810 1 ATOM 3963 C CD . GLU 238 238 ? A -17.543 -6.755 2.397 1.000 1 A 92.810 1 ATOM 3964 O OE1 . GLU 238 238 ? A -16.751 -7.559 1.857 1.000 1 A 92.810 1 ATOM 3965 O OE2 . GLU 238 238 ? A -18.406 -6.086 1.784 1.000 1 A 92.810 1 ATOM 3966 H H . GLU 238 238 ? A -20.409 -4.808 6.060 1.000 1 A 92.810 1 ATOM 3967 H HA . GLU 238 238 ? A -18.406 -6.857 6.424 1.000 1 A 92.810 1 ATOM 3968 H HB2 . GLU 238 238 ? A -18.651 -4.854 4.149 1.000 1 A 92.810 1 ATOM 3969 H HB3 . GLU 238 238 ? A -19.532 -6.392 4.277 1.000 1 A 92.810 1 ATOM 3970 H HG2 . GLU 238 238 ? A -17.364 -7.599 4.372 1.000 1 A 92.810 1 ATOM 3971 H HG3 . GLU 238 238 ? A -16.506 -6.073 4.152 1.000 1 A 92.810 1 ATOM 3972 N N . MET 239 239 ? A -17.265 -3.750 6.563 1.000 1 A 94.800 1 ATOM 3973 C CA . MET 239 239 ? A -16.164 -2.941 7.098 1.000 1 A 94.800 1 ATOM 3974 C C . MET 239 239 ? A -15.893 -3.265 8.568 1.000 1 A 94.800 1 ATOM 3975 O O . MET 239 239 ? A -14.738 -3.453 8.955 1.000 1 A 94.800 1 ATOM 3976 C CB . MET 239 239 ? A -16.475 -1.444 6.979 1.000 1 A 94.800 1 ATOM 3977 C CG . MET 239 239 ? A -16.501 -0.935 5.540 1.000 1 A 94.800 1 ATOM 3978 S SD . MET 239 239 ? A -17.130 0.755 5.358 1.000 1 A 94.800 1 ATOM 3979 C CE . MET 239 239 ? A -15.929 1.686 6.336 1.000 1 A 94.800 1 ATOM 3980 H H . MET 239 239 ? A -18.068 -3.283 6.168 1.000 1 A 94.800 1 ATOM 3981 H HA . MET 239 239 ? A -15.262 -3.166 6.529 1.000 1 A 94.800 1 ATOM 3982 H HB2 . MET 239 239 ? A -15.707 -0.891 7.520 1.000 1 A 94.800 1 ATOM 3983 H HB3 . MET 239 239 ? A -17.437 -1.233 7.446 1.000 1 A 94.800 1 ATOM 3984 H HG2 . MET 239 239 ? A -15.497 -0.986 5.120 1.000 1 A 94.800 1 ATOM 3985 H HG3 . MET 239 239 ? A -17.142 -1.587 4.947 1.000 1 A 94.800 1 ATOM 3986 H HE1 . MET 239 239 ? A -16.138 2.752 6.239 1.000 1 A 94.800 1 ATOM 3987 H HE2 . MET 239 239 ? A -14.930 1.470 5.957 1.000 1 A 94.800 1 ATOM 3988 H HE3 . MET 239 239 ? A -16.003 1.400 7.385 1.000 1 A 94.800 1 ATOM 3989 N N . MET 240 240 ? A -16.949 -3.387 9.376 1.000 1 A 95.640 1 ATOM 3990 C CA . MET 240 240 ? A -16.845 -3.769 10.782 1.000 1 A 95.640 1 ATOM 3991 C C . MET 240 240 ? A -16.200 -5.149 10.945 1.000 1 A 95.640 1 ATOM 3992 O O . MET 240 240 ? A -15.242 -5.294 11.705 1.000 1 A 95.640 1 ATOM 3993 C CB . MET 240 240 ? A -18.242 -3.716 11.407 1.000 1 A 95.640 1 ATOM 3994 C CG . MET 240 240 ? A -18.245 -4.130 12.878 1.000 1 A 95.640 1 ATOM 3995 S SD . MET 240 240 ? A -17.224 -3.099 13.965 1.000 1 A 95.640 1 ATOM 3996 C CE . MET 240 240 ? A -18.434 -1.844 14.438 1.000 1 A 95.640 1 ATOM 3997 H H . MET 240 240 ? A -17.863 -3.181 9.000 1.000 1 A 95.640 1 ATOM 3998 H HA . MET 240 240 ? A -16.208 -3.046 11.291 1.000 1 A 95.640 1 ATOM 3999 H HB2 . MET 240 240 ? A -18.611 -2.694 11.325 1.000 1 A 95.640 1 ATOM 4000 H HB3 . MET 240 240 ? A -18.917 -4.374 10.861 1.000 1 A 95.640 1 ATOM 4001 H HG2 . MET 240 240 ? A -17.893 -5.158 12.955 1.000 1 A 95.640 1 ATOM 4002 H HG3 . MET 240 240 ? A -19.273 -4.113 13.237 1.000 1 A 95.640 1 ATOM 4003 H HE1 . MET 240 240 ? A -18.599 -1.176 13.593 1.000 1 A 95.640 1 ATOM 4004 H HE2 . MET 240 240 ? A -19.371 -2.316 14.734 1.000 1 A 95.640 1 ATOM 4005 H HE3 . MET 240 240 ? A -18.043 -1.272 15.279 1.000 1 A 95.640 1 ATOM 4006 N N . ARG 241 241 ? A -16.644 -6.157 10.181 1.000 1 A 92.950 1 ATOM 4007 C CA . ARG 241 241 ? A -16.019 -7.491 10.202 1.000 1 A 92.950 1 ATOM 4008 C C . ARG 241 241 ? A -14.534 -7.435 9.841 1.000 1 A 92.950 1 ATOM 4009 O O . ARG 241 241 ? A -13.739 -8.094 10.507 1.000 1 A 92.950 1 ATOM 4010 C CB . ARG 241 241 ? A -16.759 -8.454 9.265 1.000 1 A 92.950 1 ATOM 4011 C CG . ARG 241 241 ? A -18.110 -8.902 9.841 1.000 1 A 92.950 1 ATOM 4012 C CD . ARG 241 241 ? A -18.770 -9.968 8.959 1.000 1 A 92.950 1 ATOM 4013 N NE . ARG 241 241 ? A -19.115 -9.449 7.620 1.000 1 A 92.950 1 ATOM 4014 C CZ . ARG 241 241 ? A -19.274 -10.154 6.511 1.000 1 A 92.950 1 ATOM 4015 N NH1 . ARG 241 241 ? A -19.135 -11.452 6.494 1.000 1 A 92.950 1 ATOM 4016 N NH2 . ARG 241 241 ? A -19.573 -9.566 5.387 1.000 1 A 92.950 1 ATOM 4017 H H . ARG 241 241 ? A -17.420 -5.977 9.559 1.000 1 A 92.950 1 ATOM 4018 H HA . ARG 241 241 ? A -16.058 -7.877 11.220 1.000 1 A 92.950 1 ATOM 4019 H HB2 . ARG 241 241 ? A -16.903 -7.982 8.293 1.000 1 A 92.950 1 ATOM 4020 H HB3 . ARG 241 241 ? A -16.140 -9.341 9.123 1.000 1 A 92.950 1 ATOM 4021 H HG2 . ARG 241 241 ? A -18.781 -8.050 9.952 1.000 1 A 92.950 1 ATOM 4022 H HG3 . ARG 241 241 ? A -17.947 -9.330 10.830 1.000 1 A 92.950 1 ATOM 4023 H HD2 . ARG 241 241 ? A -19.683 -10.301 9.452 1.000 1 A 92.950 1 ATOM 4024 H HD3 . ARG 241 241 ? A -18.087 -10.813 8.877 1.000 1 A 92.950 1 ATOM 4025 H HE . ARG 241 241 ? A -19.289 -8.456 7.564 1.000 1 A 92.950 1 ATOM 4026 H HH11 . ARG 241 241 ? A -18.792 -11.907 7.328 1.000 1 A 92.950 1 ATOM 4027 H HH12 . ARG 241 241 ? A -19.191 -11.946 5.614 1.000 1 A 92.950 1 ATOM 4028 H HH21 . ARG 241 241 ? A -19.633 -10.080 4.520 1.000 1 A 92.950 1 ATOM 4029 H HH22 . ARG 241 241 ? A -19.726 -8.569 5.359 1.000 1 A 92.950 1 ATOM 4030 N N . MET 242 242 ? A -14.153 -6.628 8.847 1.000 1 A 92.300 1 ATOM 4031 C CA . MET 242 242 ? A -12.749 -6.425 8.465 1.000 1 A 92.300 1 ATOM 4032 C C . MET 242 242 ? A -11.945 -5.713 9.564 1.000 1 A 92.300 1 ATOM 4033 O O . MET 242 242 ? A -10.793 -6.067 9.811 1.000 1 A 92.300 1 ATOM 4034 C CB . MET 242 242 ? A -12.648 -5.625 7.158 1.000 1 A 92.300 1 ATOM 4035 C CG . MET 242 242 ? A -13.249 -6.332 5.940 1.000 1 A 92.300 1 ATOM 4036 S SD . MET 242 242 ? A -12.513 -7.928 5.519 1.000 1 A 92.300 1 ATOM 4037 C CE . MET 242 242 ? A -13.576 -8.359 4.114 1.000 1 A 92.300 1 ATOM 4038 H H . MET 242 242 ? A -14.873 -6.142 8.332 1.000 1 A 92.300 1 ATOM 4039 H HA . MET 242 242 ? A -12.286 -7.398 8.299 1.000 1 A 92.300 1 ATOM 4040 H HB2 . MET 242 242 ? A -13.159 -4.671 7.288 1.000 1 A 92.300 1 ATOM 4041 H HB3 . MET 242 242 ? A -11.598 -5.423 6.948 1.000 1 A 92.300 1 ATOM 4042 H HG2 . MET 242 242 ? A -13.152 -5.671 5.079 1.000 1 A 92.300 1 ATOM 4043 H HG3 . MET 242 242 ? A -14.313 -6.496 6.108 1.000 1 A 92.300 1 ATOM 4044 H HE1 . MET 242 242 ? A -13.279 -9.327 3.712 1.000 1 A 92.300 1 ATOM 4045 H HE2 . MET 242 242 ? A -14.616 -8.405 4.438 1.000 1 A 92.300 1 ATOM 4046 H HE3 . MET 242 242 ? A -13.485 -7.602 3.335 1.000 1 A 92.300 1 ATOM 4047 N N . ALA 243 243 ? A -12.532 -4.736 10.258 1.000 1 A 94.580 1 ATOM 4048 C CA . ALA 243 243 ? A -11.899 -4.077 11.400 1.000 1 A 94.580 1 ATOM 4049 C C . ALA 243 243 ? A -11.662 -5.061 12.563 1.000 1 A 94.580 1 ATOM 4050 O O . ALA 243 243 ? A -10.642 -4.992 13.247 1.000 1 A 94.580 1 ATOM 4051 C CB . ALA 243 243 ? A -12.760 -2.880 11.819 1.000 1 A 94.580 1 ATOM 4052 H H . ALA 243 243 ? A -13.469 -4.456 10.007 1.000 1 A 94.580 1 ATOM 4053 H HA . ALA 243 243 ? A -10.926 -3.698 11.085 1.000 1 A 94.580 1 ATOM 4054 H HB1 . ALA 243 243 ? A -12.899 -2.203 10.976 1.000 1 A 94.580 1 ATOM 4055 H HB2 . ALA 243 243 ? A -12.264 -2.340 12.625 1.000 1 A 94.580 1 ATOM 4056 H HB3 . ALA 243 243 ? A -13.735 -3.217 12.171 1.000 1 A 94.580 1 ATOM 4057 N N . CYS 244 244 ? A -12.537 -6.046 12.748 1.000 1 A 93.750 1 ATOM 4058 C CA . CYS 244 244 ? A -12.398 -7.055 13.795 1.000 1 A 93.750 1 ATOM 4059 C C . CYS 244 244 ? A -11.343 -8.143 13.519 1.000 1 A 93.750 1 ATOM 4060 O O . CYS 244 244 ? A -11.145 -8.984 14.393 1.000 1 A 93.750 1 ATOM 4061 C CB . CYS 244 244 ? A -13.771 -7.683 14.057 1.000 1 A 93.750 1 ATOM 4062 S SG . CYS 244 244 ? A -14.895 -6.447 14.760 1.000 1 A 93.750 1 ATOM 4063 H H . CYS 244 244 ? A -13.406 -6.014 12.234 1.000 1 A 93.750 1 ATOM 4064 H HA . CYS 244 244 ? A -12.083 -6.554 14.710 1.000 1 A 93.750 1 ATOM 4065 H HB2 . CYS 244 244 ? A -14.182 -8.060 13.121 1.000 1 A 93.750 1 ATOM 4066 H HB3 . CYS 244 244 ? A -13.675 -8.510 14.760 1.000 1 A 93.750 1 ATOM 4067 H HG . CYS 244 244 ? A -14.357 -6.376 15.981 1.000 1 A 93.750 1 ATOM 4068 N N . THR 245 245 ? A -10.662 -8.171 12.364 1.000 1 A 90.560 1 ATOM 4069 C CA . THR 245 245 ? A -9.720 -9.261 12.008 1.000 1 A 90.560 1 ATOM 4070 C C . THR 245 245 ? A -8.392 -9.214 12.761 1.000 1 A 90.560 1 ATOM 4071 O O . THR 245 245 ? A -7.742 -10.246 12.945 1.000 1 A 90.560 1 ATOM 4072 C CB . THR 245 245 ? A -9.380 -9.277 10.514 1.000 1 A 90.560 1 ATOM 4073 O OG1 . THR 245 245 ? A -8.738 -8.081 10.143 1.000 1 A 90.560 1 ATOM 4074 C CG2 . THR 245 245 ? A -10.593 -9.467 9.612 1.000 1 A 90.560 1 ATOM 4075 H H . THR 245 245 ? A -10.863 -7.473 11.662 1.000 1 A 90.560 1 ATOM 4076 H HA . THR 245 245 ? A -10.187 -10.217 12.246 1.000 1 A 90.560 1 ATOM 4077 H HB . THR 245 245 ? A -8.702 -10.111 10.333 1.000 1 A 90.560 1 ATOM 4078 H HG1 . THR 245 245 ? A -9.014 -7.910 9.239 1.000 1 A 90.560 1 ATOM 4079 H HG21 . THR 245 245 ? A -11.037 -10.444 9.806 1.000 1 A 90.560 1 ATOM 4080 H HG22 . THR 245 245 ? A -10.292 -9.427 8.566 1.000 1 A 90.560 1 ATOM 4081 H HG23 . THR 245 245 ? A -11.339 -8.698 9.811 1.000 1 A 90.560 1 ATOM 4082 N N . LYS 246 246 ? A -7.986 -8.035 13.237 1.000 1 A 88.950 1 ATOM 4083 C CA . LYS 246 246 ? A -6.759 -7.834 14.012 1.000 1 A 88.950 1 ATOM 4084 C C . LYS 246 246 ? A -7.092 -7.240 15.370 1.000 1 A 88.950 1 ATOM 4085 O O . LYS 246 246 ? A -7.827 -6.260 15.434 1.000 1 A 88.950 1 ATOM 4086 C CB . LYS 246 246 ? A -5.814 -6.929 13.217 1.000 1 A 88.950 1 ATOM 4087 C CG . LYS 246 246 ? A -4.435 -6.857 13.878 1.000 1 A 88.950 1 ATOM 4088 C CD . LYS 246 246 ? A -3.563 -5.851 13.139 1.000 1 A 88.950 1 ATOM 4089 C CE . LYS 246 246 ? A -2.213 -5.765 13.842 1.000 1 A 88.950 1 ATOM 4090 N NZ . LYS 246 246 ? A -1.420 -4.662 13.264 1.000 1 A 88.950 1 ATOM 4091 H H . LYS 246 246 ? A -8.592 -7.242 13.083 1.000 1 A 88.950 1 ATOM 4092 H HA . LYS 246 246 ? A -6.278 -8.797 14.180 1.000 1 A 88.950 1 ATOM 4093 H HB2 . LYS 246 246 ? A -5.704 -7.322 12.206 1.000 1 A 88.950 1 ATOM 4094 H HB3 . LYS 246 246 ? A -6.248 -5.931 13.154 1.000 1 A 88.950 1 ATOM 4095 H HG2 . LYS 246 246 ? A -3.968 -7.842 13.855 1.000 1 A 88.950 1 ATOM 4096 H HG3 . LYS 246 246 ? A -4.533 -6.533 14.914 1.000 1 A 88.950 1 ATOM 4097 H HD2 . LYS 246 246 ? A -3.443 -6.156 12.099 1.000 1 A 88.950 1 ATOM 4098 H HD3 . LYS 246 246 ? A -4.056 -4.880 13.177 1.000 1 A 88.950 1 ATOM 4099 H HE2 . LYS 246 246 ? A -2.398 -5.582 14.900 1.000 1 A 88.950 1 ATOM 4100 H HE3 . LYS 246 246 ? A -1.700 -6.722 13.747 1.000 1 A 88.950 1 ATOM 4101 H HZ1 . LYS 246 246 ? A -1.319 -4.796 12.268 1.000 1 A 88.950 1 ATOM 4102 H HZ2 . LYS 246 246 ? A -0.528 -4.585 13.731 1.000 1 A 88.950 1 ATOM 4103 H HZ3 . LYS 246 246 ? A -1.933 -3.805 13.415 1.000 1 A 88.950 1 ATOM 4104 N N . ASP 247 247 ? A -6.513 -7.794 16.429 1.000 1 A 91.960 1 ATOM 4105 C CA . ASP 247 247 ? A -6.725 -7.277 17.779 1.000 1 A 91.960 1 ATOM 4106 C C . ASP 247 247 ? A -6.196 -5.843 17.971 1.000 1 A 91.960 1 ATOM 4107 O O . ASP 247 247 ? A -5.334 -5.380 17.212 1.000 1 A 91.960 1 ATOM 4108 C CB . ASP 247 247 ? A -6.136 -8.244 18.826 1.000 1 A 91.960 1 ATOM 4109 C CG . ASP 247 247 ? A -7.011 -8.353 20.081 1.000 1 A 91.960 1 ATOM 4110 O OD1 . ASP 247 247 ? A -8.038 -7.639 20.143 1.000 1 A 91.960 1 ATOM 4111 O OD2 . ASP 247 247 ? A -6.698 -9.205 20.934 1.000 1 A 91.960 1 ATOM 4112 H H . ASP 247 247 ? A -6.065 -8.694 16.338 1.000 1 A 91.960 1 ATOM 4113 H HA . ASP 247 247 ? A -7.807 -7.241 17.910 1.000 1 A 91.960 1 ATOM 4114 H HB2 . ASP 247 247 ? A -5.135 -7.915 19.104 1.000 1 A 91.960 1 ATOM 4115 H HB3 . ASP 247 247 ? A -6.045 -9.241 18.395 1.000 1 A 91.960 1 ATOM 4116 N N . ASN 248 248 ? A -6.679 -5.158 19.011 1.000 1 A 92.500 1 ATOM 4117 C CA . ASN 248 248 ? A -6.336 -3.766 19.343 1.000 1 A 92.500 1 ATOM 4118 C C . ASN 248 248 ? A -6.675 -2.745 18.236 1.000 1 A 92.500 1 ATOM 4119 O O . ASN 248 248 ? A -5.927 -1.793 17.976 1.000 1 A 92.500 1 ATOM 4120 C CB . ASN 248 248 ? A -4.875 -3.687 19.827 1.000 1 A 92.500 1 ATOM 4121 C CG . ASN 248 248 ? A -4.698 -4.365 21.163 1.000 1 A 92.500 1 ATOM 4122 O OD1 . ASN 248 248 ? A -4.954 -3.758 22.181 1.000 1 A 92.500 1 ATOM 4123 N ND2 . ASN 248 248 ? A -4.268 -5.600 21.204 1.000 1 A 92.500 1 ATOM 4124 H H . ASN 248 248 ? A -7.359 -5.626 19.592 1.000 1 A 92.500 1 ATOM 4125 H HA . ASN 248 248 ? A -6.966 -3.485 20.188 1.000 1 A 92.500 1 ATOM 4126 H HB2 . ASN 248 248 ? A -4.194 -4.119 19.095 1.000 1 A 92.500 1 ATOM 4127 H HB3 . ASN 248 248 ? A -4.603 -2.642 19.972 1.000 1 A 92.500 1 ATOM 4128 H HD21 . ASN 248 248 ? A -4.489 -6.028 22.092 1.000 1 A 92.500 1 ATOM 4129 H HD22 . ASN 248 248 ? A -4.296 -6.173 20.373 1.000 1 A 92.500 1 ATOM 4130 N N . ASN 249 249 ? A -7.808 -2.931 17.560 1.000 1 A 94.230 1 ATOM 4131 C CA . ASN 249 249 ? A -8.222 -2.140 16.401 1.000 1 A 94.230 1 ATOM 4132 C C . ASN 249 249 ? A -9.373 -1.161 16.703 1.000 1 A 94.230 1 ATOM 4133 O O . ASN 249 249 ? A -10.289 -0.959 15.906 1.000 1 A 94.230 1 ATOM 4134 C CB . ASN 249 249 ? A -8.469 -3.086 15.225 1.000 1 A 94.230 1 ATOM 4135 C CG . ASN 249 249 ? A -8.429 -2.371 13.899 1.000 1 A 94.230 1 ATOM 4136 O OD1 . ASN 249 249 ? A -8.012 -1.235 13.770 1.000 1 A 94.230 1 ATOM 4137 N ND2 . ASN 249 249 ? A -8.810 -3.026 12.846 1.000 1 A 94.230 1 ATOM 4138 H H . ASN 249 249 ? A -8.408 -3.688 17.858 1.000 1 A 94.230 1 ATOM 4139 H HA . ASN 249 249 ? A -7.379 -1.508 16.119 1.000 1 A 94.230 1 ATOM 4140 H HB2 . ASN 249 249 ? A -7.675 -3.832 15.197 1.000 1 A 94.230 1 ATOM 4141 H HB3 . ASN 249 249 ? A -9.428 -3.589 15.345 1.000 1 A 94.230 1 ATOM 4142 H HD21 . ASN 249 249 ? A -8.915 -2.486 11.999 1.000 1 A 94.230 1 ATOM 4143 H HD22 . ASN 249 249 ? A -9.296 -3.900 12.985 1.000 1 A 94.230 1 ATOM 4144 N N . PHE 250 250 ? A -9.326 -0.540 17.883 1.000 1 A 96.100 1 ATOM 4145 C CA . PHE 250 250 ? A -10.443 0.230 18.437 1.000 1 A 96.100 1 ATOM 4146 C C . PHE 250 250 ? A -10.877 1.420 17.576 1.000 1 A 96.100 1 ATOM 4147 O O . PHE 250 250 ? A -12.070 1.689 17.481 1.000 1 A 96.100 1 ATOM 4148 C CB . PHE 250 250 ? A -10.067 0.724 19.842 1.000 1 A 96.100 1 ATOM 4149 C CG . PHE 250 250 ? A -9.539 -0.330 20.798 1.000 1 A 96.100 1 ATOM 4150 C CD1 . PHE 250 250 ? A -9.978 -1.668 20.729 1.000 1 A 96.100 1 ATOM 4151 C CD2 . PHE 250 250 ? A -8.595 0.042 21.775 1.000 1 A 96.100 1 ATOM 4152 C CE1 . PHE 250 250 ? A -9.457 -2.626 21.611 1.000 1 A 96.100 1 ATOM 4153 C CE2 . PHE 250 250 ? A -8.085 -0.916 22.665 1.000 1 A 96.100 1 ATOM 4154 C CZ . PHE 250 250 ? A -8.514 -2.248 22.580 1.000 1 A 96.100 1 ATOM 4155 H H . PHE 250 250 ? A -8.596 -0.818 18.523 1.000 1 A 96.100 1 ATOM 4156 H HA . PHE 250 250 ? A -11.309 -0.425 18.524 1.000 1 A 96.100 1 ATOM 4157 H HB2 . PHE 250 250 ? A -9.312 1.504 19.740 1.000 1 A 96.100 1 ATOM 4158 H HB3 . PHE 250 250 ? A -10.946 1.180 20.297 1.000 1 A 96.100 1 ATOM 4159 H HD1 . PHE 250 250 ? A -10.724 -1.979 20.012 1.000 1 A 96.100 1 ATOM 4160 H HD2 . PHE 250 250 ? A -8.269 1.069 21.855 1.000 1 A 96.100 1 ATOM 4161 H HE1 . PHE 250 250 ? A -9.793 -3.651 21.558 1.000 1 A 96.100 1 ATOM 4162 H HE2 . PHE 250 250 ? A -7.366 -0.635 23.420 1.000 1 A 96.100 1 ATOM 4163 H HZ . PHE 250 250 ? A -8.119 -2.977 23.273 1.000 1 A 96.100 1 ATOM 4164 N N . LEU 251 251 ? A -9.946 2.132 16.923 1.000 1 A 96.960 1 ATOM 4165 C CA . LEU 251 251 ? A -10.299 3.353 16.187 1.000 1 A 96.960 1 ATOM 4166 C C . LEU 251 251 ? A -11.188 3.039 14.984 1.000 1 A 96.960 1 ATOM 4167 O O . LEU 251 251 ? A -12.135 3.773 14.713 1.000 1 A 96.960 1 ATOM 4168 C CB . LEU 251 251 ? A -9.062 4.128 15.696 1.000 1 A 96.960 1 ATOM 4169 C CG . LEU 251 251 ? A -7.997 4.485 16.742 1.000 1 A 96.960 1 ATOM 4170 C CD1 . LEU 251 251 ? A -6.752 5.051 16.056 1.000 1 A 96.960 1 ATOM 4171 C CD2 . LEU 251 251 ? A -8.532 5.546 17.698 1.000 1 A 96.960 1 ATOM 4172 H H . LEU 251 251 ? A -8.996 1.790 16.893 1.000 1 A 96.960 1 ATOM 4173 H HA . LEU 251 251 ? A -10.879 3.998 16.847 1.000 1 A 96.960 1 ATOM 4174 H HB2 . LEU 251 251 ? A -8.597 3.590 14.870 1.000 1 A 96.960 1 ATOM 4175 H HB3 . LEU 251 251 ? A -9.430 5.058 15.262 1.000 1 A 96.960 1 ATOM 4176 H HG . LEU 251 251 ? A -7.707 3.597 17.304 1.000 1 A 96.960 1 ATOM 4177 H HD11 . LEU 251 251 ? A -6.341 4.298 15.383 1.000 1 A 96.960 1 ATOM 4178 H HD12 . LEU 251 251 ? A -7.014 5.942 15.485 1.000 1 A 96.960 1 ATOM 4179 H HD13 . LEU 251 251 ? A -6.002 5.297 16.807 1.000 1 A 96.960 1 ATOM 4180 H HD21 . LEU 251 251 ? A -8.860 6.430 17.151 1.000 1 A 96.960 1 ATOM 4181 H HD22 . LEU 251 251 ? A -9.376 5.123 18.241 1.000 1 A 96.960 1 ATOM 4182 H HD23 . LEU 251 251 ? A -7.763 5.821 18.420 1.000 1 A 96.960 1 ATOM 4183 N N . THR 252 252 ? A -10.880 1.968 14.253 1.000 1 A 96.670 1 ATOM 4184 C CA . THR 252 252 ? A -11.631 1.604 13.045 1.000 1 A 96.670 1 ATOM 4185 C C . THR 252 252 ? A -12.922 0.862 13.377 1.000 1 A 96.670 1 ATOM 4186 O O . THR 252 252 ? A -13.931 1.133 12.730 1.000 1 A 96.670 1 ATOM 4187 C CB . THR 252 252 ? A -10.786 0.801 12.057 1.000 1 A 96.670 1 ATOM 4188 O OG1 . THR 252 252 ? A -10.398 -0.412 12.636 1.000 1 A 96.670 1 ATOM 4189 C CG2 . THR 252 252 ? A -9.551 1.575 11.594 1.000 1 A 96.670 1 ATOM 4190 H H . THR 252 252 ? A -10.127 1.368 14.560 1.000 1 A 96.670 1 ATOM 4191 H HA . THR 252 252 ? A -11.927 2.519 12.532 1.000 1 A 96.670 1 ATOM 4192 H HB . THR 252 252 ? A -11.399 0.578 11.184 1.000 1 A 96.670 1 ATOM 4193 H HG1 . THR 252 252 ? A -9.521 -0.354 13.023 1.000 1 A 96.670 1 ATOM 4194 H HG21 . THR 252 252 ? A -9.862 2.451 11.025 1.000 1 A 96.670 1 ATOM 4195 H HG22 . THR 252 252 ? A -8.944 0.936 10.953 1.000 1 A 96.670 1 ATOM 4196 H HG23 . THR 252 252 ? A -8.967 1.908 12.451 1.000 1 A 96.670 1 ATOM 4197 N N . ILE 253 253 ? A -12.938 0.027 14.426 1.000 1 A 97.280 1 ATOM 4198 C CA . ILE 253 253 ? A -14.172 -0.568 14.971 1.000 1 A 97.280 1 ATOM 4199 C C . ILE 253 253 ? A -15.141 0.542 15.386 1.000 1 A 97.280 1 ATOM 4200 O O . ILE 253 253 ? A -16.286 0.569 14.941 1.000 1 A 97.280 1 ATOM 4201 C CB . ILE 253 253 ? A -13.846 -1.515 16.153 1.000 1 A 97.280 1 ATOM 4202 C CG1 . ILE 253 253 ? A -13.132 -2.776 15.616 1.000 1 A 97.280 1 ATOM 4203 C CG2 . ILE 253 253 ? A -15.109 -1.910 16.948 1.000 1 A 97.280 1 ATOM 4204 C CD1 . ILE 253 253 ? A -12.583 -3.704 16.704 1.000 1 A 97.280 1 ATOM 4205 H H . ILE 253 253 ? A -12.060 -0.208 14.866 1.000 1 A 97.280 1 ATOM 4206 H HA . ILE 253 253 ? A -14.665 -1.149 14.191 1.000 1 A 97.280 1 ATOM 4207 H HB . ILE 253 253 ? A -13.172 -0.997 16.835 1.000 1 A 97.280 1 ATOM 4208 H HG12 . ILE 253 253 ? A -13.820 -3.341 14.987 1.000 1 A 97.280 1 ATOM 4209 H HG13 . ILE 253 253 ? A -12.287 -2.476 14.997 1.000 1 A 97.280 1 ATOM 4210 H HG21 . ILE 253 253 ? A -15.817 -2.428 16.302 1.000 1 A 97.280 1 ATOM 4211 H HG22 . ILE 253 253 ? A -14.857 -2.572 17.776 1.000 1 A 97.280 1 ATOM 4212 H HG23 . ILE 253 253 ? A -15.597 -1.037 17.383 1.000 1 A 97.280 1 ATOM 4213 H HD11 . ILE 253 253 ? A -11.930 -3.147 17.377 1.000 1 A 97.280 1 ATOM 4214 H HD12 . ILE 253 253 ? A -12.008 -4.496 16.225 1.000 1 A 97.280 1 ATOM 4215 H HD13 . ILE 253 253 ? A -13.393 -4.163 17.270 1.000 1 A 97.280 1 ATOM 4216 N N . TYR 254 254 ? A -14.668 1.512 16.172 1.000 1 A 97.530 1 ATOM 4217 C CA . TYR 254 254 ? A -15.490 2.628 16.636 1.000 1 A 97.530 1 ATOM 4218 C C . TYR 254 254 ? A -15.986 3.514 15.486 1.000 1 A 97.530 1 ATOM 4219 O O . TYR 254 254 ? A -17.130 3.961 15.484 1.000 1 A 97.530 1 ATOM 4220 C CB . TYR 254 254 ? A -14.670 3.448 17.626 1.000 1 A 97.530 1 ATOM 4221 C CG . TYR 254 254 ? A -15.494 4.465 18.372 1.000 1 A 97.530 1 ATOM 4222 C CD1 . TYR 254 254 ? A -15.522 5.800 17.950 1.000 1 A 97.530 1 ATOM 4223 C CD2 . TYR 254 254 ? A -16.251 4.059 19.480 1.000 1 A 97.530 1 ATOM 4224 C CE1 . TYR 254 254 ? A -16.271 6.743 18.674 1.000 1 A 97.530 1 ATOM 4225 C CE2 . TYR 254 254 ? A -17.044 4.990 20.178 1.000 1 A 97.530 1 ATOM 4226 C CZ . TYR 254 254 ? A -17.045 6.340 19.774 1.000 1 A 97.530 1 ATOM 4227 O OH . TYR 254 254 ? A -17.786 7.276 20.411 1.000 1 A 97.530 1 ATOM 4228 H H . TYR 254 254 ? A -13.720 1.446 16.514 1.000 1 A 97.530 1 ATOM 4229 H HA . TYR 254 254 ? A -16.361 2.228 17.154 1.000 1 A 97.530 1 ATOM 4230 H HB2 . TYR 254 254 ? A -13.850 3.945 17.107 1.000 1 A 97.530 1 ATOM 4231 H HB3 . TYR 254 254 ? A -14.236 2.771 18.362 1.000 1 A 97.530 1 ATOM 4232 H HD1 . TYR 254 254 ? A -14.980 6.089 17.062 1.000 1 A 97.530 1 ATOM 4233 H HD2 . TYR 254 254 ? A -16.239 3.017 19.763 1.000 1 A 97.530 1 ATOM 4234 H HE1 . TYR 254 254 ? A -16.286 7.782 18.382 1.000 1 A 97.530 1 ATOM 4235 H HE2 . TYR 254 254 ? A -17.666 4.678 21.004 1.000 1 A 97.530 1 ATOM 4236 H HH . TYR 254 254 ? A -18.331 6.883 21.097 1.000 1 A 97.530 1 ATOM 4237 N N . TYR 255 255 ? A -15.147 3.733 14.471 1.000 1 A 97.550 1 ATOM 4238 C CA . TYR 255 255 ? A -15.553 4.433 13.255 1.000 1 A 97.550 1 ATOM 4239 C C . TYR 255 255 ? A -16.695 3.704 12.531 1.000 1 A 97.550 1 ATOM 4240 O O . TYR 255 255 ? A -17.693 4.334 12.194 1.000 1 A 97.550 1 ATOM 4241 C CB . TYR 255 255 ? A -14.329 4.609 12.354 1.000 1 A 97.550 1 ATOM 4242 C CG . TYR 255 255 ? A -14.605 5.395 11.093 1.000 1 A 97.550 1 ATOM 4243 C CD1 . TYR 255 255 ? A -14.937 4.726 9.901 1.000 1 A 97.550 1 ATOM 4244 C CD2 . TYR 255 255 ? A -14.549 6.800 11.118 1.000 1 A 97.550 1 ATOM 4245 C CE1 . TYR 255 255 ? A -15.197 5.463 8.732 1.000 1 A 97.550 1 ATOM 4246 C CE2 . TYR 255 255 ? A -14.851 7.541 9.962 1.000 1 A 97.550 1 ATOM 4247 C CZ . TYR 255 255 ? A -15.190 6.871 8.767 1.000 1 A 97.550 1 ATOM 4248 O OH . TYR 255 255 ? A -15.529 7.560 7.648 1.000 1 A 97.550 1 ATOM 4249 H H . TYR 255 255 ? A -14.204 3.378 14.536 1.000 1 A 97.550 1 ATOM 4250 H HA . TYR 255 255 ? A -15.926 5.421 13.527 1.000 1 A 97.550 1 ATOM 4251 H HB2 . TYR 255 255 ? A -13.936 3.631 12.076 1.000 1 A 97.550 1 ATOM 4252 H HB3 . TYR 255 255 ? A -13.556 5.129 12.920 1.000 1 A 97.550 1 ATOM 4253 H HD1 . TYR 255 255 ? A -15.010 3.649 9.884 1.000 1 A 97.550 1 ATOM 4254 H HD2 . TYR 255 255 ? A -14.315 7.313 12.039 1.000 1 A 97.550 1 ATOM 4255 H HE1 . TYR 255 255 ? A -15.454 4.959 7.813 1.000 1 A 97.550 1 ATOM 4256 H HE2 . TYR 255 255 ? A -14.848 8.620 10.006 1.000 1 A 97.550 1 ATOM 4257 H HH . TYR 255 255 ? A -15.921 8.419 7.822 1.000 1 A 97.550 1 ATOM 4258 N N . CYS 256 256 ? A -16.592 2.383 12.342 1.000 1 A 97.190 1 ATOM 4259 C CA . CYS 256 256 ? A -17.654 1.588 11.717 1.000 1 A 97.190 1 ATOM 4260 C C . CYS 256 256 ? A -18.935 1.581 12.567 1.000 1 A 97.190 1 ATOM 4261 O O . CYS 256 256 ? A -20.031 1.699 12.025 1.000 1 A 97.190 1 ATOM 4262 C CB . CYS 256 256 ? A -17.157 0.157 11.460 1.000 1 A 97.190 1 ATOM 4263 S SG . CYS 256 256 ? A -15.739 0.157 10.328 1.000 1 A 97.190 1 ATOM 4264 H H . CYS 256 256 ? A -15.765 1.903 12.668 1.000 1 A 97.190 1 ATOM 4265 H HA . CYS 256 256 ? A -17.915 2.035 10.758 1.000 1 A 97.190 1 ATOM 4266 H HB2 . CYS 256 256 ? A -17.964 -0.418 11.007 1.000 1 A 97.190 1 ATOM 4267 H HB3 . CYS 256 256 ? A -16.872 -0.317 12.399 1.000 1 A 97.190 1 ATOM 4268 H HG . CYS 256 256 ? A -14.842 0.562 11.232 1.000 1 A 97.190 1 ATOM 4269 N N . PHE 257 257 ? A -18.805 1.514 13.895 1.000 1 A 97.190 1 ATOM 4270 C CA . PHE 257 257 ? A -19.928 1.626 14.829 1.000 1 A 97.190 1 ATOM 4271 C C . PHE 257 257 ? A -20.681 2.954 14.656 1.000 1 A 97.190 1 ATOM 4272 O O . PHE 257 257 ? A -21.900 2.955 14.511 1.000 1 A 97.190 1 ATOM 4273 C CB . PHE 257 257 ? A -19.398 1.463 16.260 1.000 1 A 97.190 1 ATOM 4274 C CG . PHE 257 257 ? A -20.404 1.817 17.332 1.000 1 A 97.190 1 ATOM 4275 C CD1 . PHE 257 257 ? A -20.280 3.021 18.054 1.000 1 A 97.190 1 ATOM 4276 C CD2 . PHE 257 257 ? A -21.479 0.949 17.591 1.000 1 A 97.190 1 ATOM 4277 C CE1 . PHE 257 257 ? A -21.223 3.344 19.046 1.000 1 A 97.190 1 ATOM 4278 C CE2 . PHE 257 257 ? A -22.416 1.270 18.588 1.000 1 A 97.190 1 ATOM 4279 C CZ . PHE 257 257 ? A -22.286 2.464 19.317 1.000 1 A 97.190 1 ATOM 4280 H H . PHE 257 257 ? A -17.881 1.380 14.280 1.000 1 A 97.190 1 ATOM 4281 H HA . PHE 257 257 ? A -20.645 0.829 14.634 1.000 1 A 97.190 1 ATOM 4282 H HB2 . PHE 257 257 ? A -18.518 2.092 16.396 1.000 1 A 97.190 1 ATOM 4283 H HB3 . PHE 257 257 ? A -19.082 0.430 16.406 1.000 1 A 97.190 1 ATOM 4284 H HD1 . PHE 257 257 ? A -19.462 3.695 17.851 1.000 1 A 97.190 1 ATOM 4285 H HD2 . PHE 257 257 ? A -21.590 0.036 17.025 1.000 1 A 97.190 1 ATOM 4286 H HE1 . PHE 257 257 ? A -21.123 4.260 19.610 1.000 1 A 97.190 1 ATOM 4287 H HE2 . PHE 257 257 ? A -23.231 0.594 18.802 1.000 1 A 97.190 1 ATOM 4288 H HZ . PHE 257 257 ? A -22.998 2.696 20.095 1.000 1 A 97.190 1 ATOM 4289 N N . LEU 258 258 ? A -19.966 4.080 14.568 1.000 1 A 96.470 1 ATOM 4290 C CA . LEU 258 258 ? A -20.577 5.393 14.325 1.000 1 A 96.470 1 ATOM 4291 C C . LEU 258 258 ? A -21.230 5.525 12.942 1.000 1 A 96.470 1 ATOM 4292 O O . LEU 258 258 ? A -22.138 6.338 12.777 1.000 1 A 96.470 1 ATOM 4293 C CB . LEU 258 258 ? A -19.518 6.489 14.506 1.000 1 A 96.470 1 ATOM 4294 C CG . LEU 258 258 ? A -19.121 6.754 15.967 1.000 1 A 96.470 1 ATOM 4295 C CD1 . LEU 258 258 ? A -18.003 7.790 15.958 1.000 1 A 96.470 1 ATOM 4296 C CD2 . LEU 258 258 ? A -20.274 7.311 16.802 1.000 1 A 96.470 1 ATOM 4297 H H . LEU 258 258 ? A -18.966 4.025 14.705 1.000 1 A 96.470 1 ATOM 4298 H HA . LEU 258 258 ? A -21.383 5.538 15.044 1.000 1 A 96.470 1 ATOM 4299 H HB2 . LEU 258 258 ? A -19.910 7.416 14.089 1.000 1 A 96.470 1 ATOM 4300 H HB3 . LEU 258 258 ? A -18.631 6.218 13.934 1.000 1 A 96.470 1 ATOM 4301 H HG . LEU 258 258 ? A -18.755 5.841 16.438 1.000 1 A 96.470 1 ATOM 4302 H HD11 . LEU 258 258 ? A -17.088 7.311 15.610 1.000 1 A 96.470 1 ATOM 4303 H HD12 . LEU 258 258 ? A -18.273 8.616 15.300 1.000 1 A 96.470 1 ATOM 4304 H HD13 . LEU 258 258 ? A -17.856 8.186 16.963 1.000 1 A 96.470 1 ATOM 4305 H HD21 . LEU 258 258 ? A -19.921 7.559 17.803 1.000 1 A 96.470 1 ATOM 4306 H HD22 . LEU 258 258 ? A -21.056 6.560 16.912 1.000 1 A 96.470 1 ATOM 4307 H HD23 . LEU 258 258 ? A -20.690 8.203 16.333 1.000 1 A 96.470 1 ATOM 4308 N N . LEU 259 259 ? A -20.796 4.734 11.958 1.000 1 A 95.720 1 ATOM 4309 C CA . LEU 259 259 ? A -21.461 4.627 10.655 1.000 1 A 95.720 1 ATOM 4310 C C . LEU 259 259 ? A -22.724 3.746 10.688 1.000 1 A 95.720 1 ATOM 4311 O O . LEU 259 259 ? A -23.420 3.663 9.678 1.000 1 A 95.720 1 ATOM 4312 C CB . LEU 259 259 ? A -20.460 4.131 9.596 1.000 1 A 95.720 1 ATOM 4313 C CG . LEU 259 259 ? A -19.322 5.104 9.243 1.000 1 A 95.720 1 ATOM 4314 C CD1 . LEU 259 259 ? A -18.441 4.440 8.184 1.000 1 A 95.720 1 ATOM 4315 C CD2 . LEU 259 259 ? A -19.833 6.434 8.683 1.000 1 A 95.720 1 ATOM 4316 H H . LEU 259 259 ? A -20.026 4.110 12.153 1.000 1 A 95.720 1 ATOM 4317 H HA . LEU 259 259 ? A -21.815 5.616 10.363 1.000 1 A 95.720 1 ATOM 4318 H HB2 . LEU 259 259 ? A -21.013 3.919 8.681 1.000 1 A 95.720 1 ATOM 4319 H HB3 . LEU 259 259 ? A -20.026 3.189 9.934 1.000 1 A 95.720 1 ATOM 4320 H HG . LEU 259 259 ? A -18.713 5.318 10.121 1.000 1 A 95.720 1 ATOM 4321 H HD11 . LEU 259 259 ? A -19.051 4.084 7.354 1.000 1 A 95.720 1 ATOM 4322 H HD12 . LEU 259 259 ? A -17.912 3.595 8.626 1.000 1 A 95.720 1 ATOM 4323 H HD13 . LEU 259 259 ? A -17.720 5.161 7.799 1.000 1 A 95.720 1 ATOM 4324 H HD21 . LEU 259 259 ? A -20.505 6.252 7.844 1.000 1 A 95.720 1 ATOM 4325 H HD22 . LEU 259 259 ? A -20.362 6.986 9.460 1.000 1 A 95.720 1 ATOM 4326 H HD23 . LEU 259 259 ? A -18.996 7.041 8.341 1.000 1 A 95.720 1 ATOM 4327 N N . GLY 260 260 ? A -23.038 3.119 11.826 1.000 1 A 95.710 1 ATOM 4328 C CA . GLY 260 260 ? A -24.231 2.294 12.020 1.000 1 A 95.710 1 ATOM 4329 C C . GLY 260 260 ? A -24.004 0.787 11.896 1.000 1 A 95.710 1 ATOM 4330 O O . GLY 260 260 ? A -24.982 0.057 11.766 1.000 1 A 95.710 1 ATOM 4331 H H . GLY 260 260 ? A -22.433 3.241 12.626 1.000 1 A 95.710 1 ATOM 4332 H HA2 . GLY 260 260 ? A -25.002 2.579 11.304 1.000 1 A 95.710 1 ATOM 4333 H HA3 . GLY 260 260 ? A -24.612 2.481 13.023 1.000 1 A 95.710 1 ATOM 4334 N N . ALA 261 261 ? A -22.753 0.312 11.932 1.000 1 A 97.110 1 ATOM 4335 C CA . ALA 261 261 ? A -22.466 -1.122 11.944 1.000 1 A 97.110 1 ATOM 4336 C C . ALA 261 261 ? A -23.066 -1.820 13.172 1.000 1 A 97.110 1 ATOM 4337 O O . ALA 261 261 ? A -23.060 -1.287 14.286 1.000 1 A 97.110 1 ATOM 4338 C CB . ALA 261 261 ? A -20.957 -1.358 11.960 1.000 1 A 97.110 1 ATOM 4339 H H . ALA 261 261 ? A -21.982 0.958 12.026 1.000 1 A 97.110 1 ATOM 4340 H HA . ALA 261 261 ? A -22.889 -1.576 11.048 1.000 1 A 97.110 1 ATOM 4341 H HB1 . ALA 261 261 ? A -20.453 -0.882 11.119 1.000 1 A 97.110 1 ATOM 4342 H HB2 . ALA 261 261 ? A -20.776 -2.432 11.925 1.000 1 A 97.110 1 ATOM 4343 H HB3 . ALA 261 261 ? A -20.563 -0.948 12.890 1.000 1 A 97.110 1 ATOM 4344 N N . ASN 262 262 ? A -23.486 -3.067 12.991 1.000 1 A 97.430 1 ATOM 4345 C CA . ASN 262 262 ? A -24.009 -3.904 14.054 1.000 1 A 97.430 1 ATOM 4346 C C . ASN 262 262 ? A -22.887 -4.383 14.995 1.000 1 A 97.430 1 ATOM 4347 O O . ASN 262 262 ? A -22.083 -5.258 14.657 1.000 1 A 97.430 1 ATOM 4348 C CB . ASN 262 262 ? A -24.799 -5.045 13.402 1.000 1 A 97.430 1 ATOM 4349 C CG . ASN 262 262 ? A -25.479 -5.941 14.415 1.000 1 A 97.430 1 ATOM 4350 O OD1 . ASN 262 262 ? A -25.105 -6.036 15.569 1.000 1 A 97.430 1 ATOM 4351 N ND2 . ASN 262 262 ? A -26.477 -6.682 14.004 1.000 1 A 97.430 1 ATOM 4352 H H . ASN 262 262 ? A -23.449 -3.446 12.055 1.000 1 A 97.430 1 ATOM 4353 H HA . ASN 262 262 ? A -24.710 -3.308 14.640 1.000 1 A 97.430 1 ATOM 4354 H HB2 . ASN 262 262 ? A -24.135 -5.647 12.782 1.000 1 A 97.430 1 ATOM 4355 H HB3 . ASN 262 262 ? A -25.558 -4.615 12.748 1.000 1 A 97.430 1 ATOM 4356 H HD21 . ASN 262 262 ? A -26.799 -6.592 13.051 1.000 1 A 97.430 1 ATOM 4357 H HD22 . ASN 262 262 ? A -26.967 -7.221 14.703 1.000 1 A 97.430 1 ATOM 4358 N N . ILE 263 263 ? A -22.876 -3.854 16.220 1.000 1 A 97.140 1 ATOM 4359 C CA . ILE 263 263 ? A -21.862 -4.184 17.227 1.000 1 A 97.140 1 ATOM 4360 C C . ILE 263 263 ? A -21.936 -5.643 17.716 1.000 1 A 97.140 1 ATOM 4361 O O . ILE 263 263 ? A -20.905 -6.232 18.034 1.000 1 A 97.140 1 ATOM 4362 C CB . ILE 263 263 ? A -21.921 -3.156 18.378 1.000 1 A 97.140 1 ATOM 4363 C CG1 . ILE 263 263 ? A -20.627 -3.138 19.217 1.000 1 A 97.140 1 ATOM 4364 C CG2 . ILE 263 263 ? A -23.151 -3.376 19.276 1.000 1 A 97.140 1 ATOM 4365 C CD1 . ILE 263 263 ? A -19.402 -2.626 18.451 1.000 1 A 97.140 1 ATOM 4366 H H . ILE 263 263 ? A -23.533 -3.115 16.426 1.000 1 A 97.140 1 ATOM 4367 H HA . ILE 263 263 ? A -20.898 -4.081 16.731 1.000 1 A 97.140 1 ATOM 4368 H HB . ILE 263 263 ? A -22.024 -2.165 17.936 1.000 1 A 97.140 1 ATOM 4369 H HG12 . ILE 263 263 ? A -20.778 -2.493 20.083 1.000 1 A 97.140 1 ATOM 4370 H HG13 . ILE 263 263 ? A -20.399 -4.142 19.576 1.000 1 A 97.140 1 ATOM 4371 H HG21 . ILE 263 263 ? A -24.070 -3.333 18.692 1.000 1 A 97.140 1 ATOM 4372 H HG22 . ILE 263 263 ? A -23.094 -4.341 19.778 1.000 1 A 97.140 1 ATOM 4373 H HG23 . ILE 263 263 ? A -23.194 -2.600 20.041 1.000 1 A 97.140 1 ATOM 4374 H HD11 . ILE 263 263 ? A -18.550 -2.578 19.130 1.000 1 A 97.140 1 ATOM 4375 H HD12 . ILE 263 263 ? A -19.598 -1.629 18.058 1.000 1 A 97.140 1 ATOM 4376 H HD13 . ILE 263 263 ? A -19.140 -3.296 17.632 1.000 1 A 97.140 1 ATOM 4377 N N . ASN 264 264 ? A -23.107 -6.286 17.675 1.000 1 A 97.820 1 ATOM 4378 C CA . ASN 264 264 ? A -23.232 -7.716 17.978 1.000 1 A 97.820 1 ATOM 4379 C C . ASN 264 264 ? A -22.575 -8.575 16.895 1.000 1 A 97.820 1 ATOM 4380 O O . ASN 264 264 ? A -21.909 -9.566 17.191 1.000 1 A 97.820 1 ATOM 4381 C CB . ASN 264 264 ? A -24.717 -8.080 18.168 1.000 1 A 97.820 1 ATOM 4382 C CG . ASN 264 264 ? A -25.267 -7.555 19.479 1.000 1 A 97.820 1 ATOM 4383 O OD1 . ASN 264 264 ? A -24.522 -7.188 20.369 1.000 1 A 97.820 1 ATOM 4384 N ND2 . ASN 264 264 ? A -26.563 -7.524 19.639 1.000 1 A 97.820 1 ATOM 4385 H H . ASN 264 264 ? A -23.930 -5.788 17.366 1.000 1 A 97.820 1 ATOM 4386 H HA . ASN 264 264 ? A -22.702 -7.931 18.906 1.000 1 A 97.820 1 ATOM 4387 H HB2 . ASN 264 264 ? A -25.324 -7.701 17.346 1.000 1 A 97.820 1 ATOM 4388 H HB3 . ASN 264 264 ? A -24.816 -9.165 18.180 1.000 1 A 97.820 1 ATOM 4389 H HD21 . ASN 264 264 ? A -27.208 -7.934 18.979 1.000 1 A 97.820 1 ATOM 4390 H HD22 . ASN 264 264 ? A -26.866 -7.319 20.581 1.000 1 A 97.820 1 ATOM 4391 N N . SER 265 265 ? A -22.672 -8.160 15.629 1.000 1 A 95.790 1 ATOM 4392 C CA . SER 265 265 ? A -21.928 -8.817 14.546 1.000 1 A 95.790 1 ATOM 4393 C C . SER 265 265 ? A -20.413 -8.647 14.713 1.000 1 A 95.790 1 ATOM 4394 O O . SER 265 265 ? A -19.658 -9.585 14.442 1.000 1 A 95.790 1 ATOM 4395 C CB . SER 265 265 ? A -22.382 -8.300 13.180 1.000 1 A 95.790 1 ATOM 4396 O OG . SER 265 265 ? A -23.726 -8.677 12.957 1.000 1 A 95.790 1 ATOM 4397 H H . SER 265 265 ? A -23.163 -7.295 15.452 1.000 1 A 95.790 1 ATOM 4398 H HA . SER 265 265 ? A -22.136 -9.887 14.582 1.000 1 A 95.790 1 ATOM 4399 H HB2 . SER 265 265 ? A -22.279 -7.216 13.125 1.000 1 A 95.790 1 ATOM 4400 H HB3 . SER 265 265 ? A -21.760 -8.749 12.406 1.000 1 A 95.790 1 ATOM 4401 H HG . SER 265 265 ? A -24.291 -8.178 13.552 1.000 1 A 95.790 1 ATOM 4402 N N . ALA 266 266 ? A -19.967 -7.492 15.219 1.000 1 A 97.000 1 ATOM 4403 C CA . ALA 266 266 ? A -18.571 -7.244 15.577 1.000 1 A 97.000 1 ATOM 4404 C C . ALA 266 266 ? A -18.097 -8.160 16.719 1.000 1 A 97.000 1 ATOM 4405 O O . ALA 266 266 ? A -17.041 -8.784 16.606 1.000 1 A 97.000 1 ATOM 4406 C CB . ALA 266 266 ? A -18.413 -5.767 15.956 1.000 1 A 97.000 1 ATOM 4407 H H . ALA 266 266 ? A -20.636 -6.755 15.393 1.000 1 A 97.000 1 ATOM 4408 H HA . ALA 266 266 ? A -17.947 -7.441 14.705 1.000 1 A 97.000 1 ATOM 4409 H HB1 . ALA 266 266 ? A -17.361 -5.483 15.910 1.000 1 A 97.000 1 ATOM 4410 H HB2 . ALA 266 266 ? A -18.990 -5.137 15.280 1.000 1 A 97.000 1 ATOM 4411 H HB3 . ALA 266 266 ? A -18.760 -5.593 16.974 1.000 1 A 97.000 1 ATOM 4412 N N . MET 267 267 ? A -18.903 -8.310 17.776 1.000 1 A 97.470 1 ATOM 4413 C CA . MET 267 267 ? A -18.641 -9.218 18.900 1.000 1 A 97.470 1 ATOM 4414 C C . MET 267 267 ? A -18.418 -10.656 18.411 1.000 1 A 97.470 1 ATOM 4415 O O . MET 267 267 ? A -17.396 -11.269 18.725 1.000 1 A 97.470 1 ATOM 4416 C CB . MET 267 267 ? A -19.821 -9.134 19.882 1.000 1 A 97.470 1 ATOM 4417 C CG . MET 267 267 ? A -19.620 -9.946 21.161 1.000 1 A 97.470 1 ATOM 4418 S SD . MET 267 267 ? A -21.097 -9.965 22.200 1.000 1 A 97.470 1 ATOM 4419 C CE . MET 267 267 ? A -20.474 -10.854 23.646 1.000 1 A 97.470 1 ATOM 4420 H H . MET 267 267 ? A -19.723 -7.723 17.828 1.000 1 A 97.470 1 ATOM 4421 H HA . MET 267 267 ? A -17.738 -8.890 19.413 1.000 1 A 97.470 1 ATOM 4422 H HB2 . MET 267 267 ? A -20.729 -9.490 19.396 1.000 1 A 97.470 1 ATOM 4423 H HB3 . MET 267 267 ? A -19.972 -8.091 20.160 1.000 1 A 97.470 1 ATOM 4424 H HG2 . MET 267 267 ? A -18.812 -9.491 21.735 1.000 1 A 97.470 1 ATOM 4425 H HG3 . MET 267 267 ? A -19.355 -10.974 20.915 1.000 1 A 97.470 1 ATOM 4426 H HE1 . MET 267 267 ? A -19.640 -10.302 24.081 1.000 1 A 97.470 1 ATOM 4427 H HE2 . MET 267 267 ? A -21.271 -10.925 24.386 1.000 1 A 97.470 1 ATOM 4428 H HE3 . MET 267 267 ? A -20.146 -11.853 23.360 1.000 1 A 97.470 1 ATOM 4429 N N . LEU 268 268 ? A -19.311 -11.169 17.557 1.000 1 A 96.810 1 ATOM 4430 C CA . LEU 268 268 ? A -19.170 -12.502 16.960 1.000 1 A 96.810 1 ATOM 4431 C C . LEU 268 268 ? A -17.912 -12.620 16.092 1.000 1 A 96.810 1 ATOM 4432 O O . LEU 268 268 ? A -17.218 -13.636 16.156 1.000 1 A 96.810 1 ATOM 4433 C CB . LEU 268 268 ? A -20.420 -12.837 16.127 1.000 1 A 96.810 1 ATOM 4434 C CG . LEU 268 268 ? A -21.729 -12.949 16.928 1.000 1 A 96.810 1 ATOM 4435 C CD1 . LEU 268 268 ? A -22.881 -13.256 15.971 1.000 1 A 96.810 1 ATOM 4436 C CD2 . LEU 268 268 ? A -21.662 -14.049 17.980 1.000 1 A 96.810 1 ATOM 4437 H H . LEU 268 268 ? A -20.140 -10.627 17.358 1.000 1 A 96.810 1 ATOM 4438 H HA . LEU 268 268 ? A -19.061 -13.232 17.762 1.000 1 A 96.810 1 ATOM 4439 H HB2 . LEU 268 268 ? A -20.248 -13.787 15.621 1.000 1 A 96.810 1 ATOM 4440 H HB3 . LEU 268 268 ? A -20.546 -12.068 15.365 1.000 1 A 96.810 1 ATOM 4441 H HG . LEU 268 268 ? A -21.940 -12.008 17.437 1.000 1 A 96.810 1 ATOM 4442 H HD11 . LEU 268 268 ? A -23.811 -13.296 16.538 1.000 1 A 96.810 1 ATOM 4443 H HD12 . LEU 268 268 ? A -22.967 -12.459 15.232 1.000 1 A 96.810 1 ATOM 4444 H HD13 . LEU 268 268 ? A -22.722 -14.215 15.478 1.000 1 A 96.810 1 ATOM 4445 H HD21 . LEU 268 268 ? A -20.917 -13.792 18.733 1.000 1 A 96.810 1 ATOM 4446 H HD22 . LEU 268 268 ? A -22.623 -14.108 18.491 1.000 1 A 96.810 1 ATOM 4447 H HD23 . LEU 268 268 ? A -21.429 -15.015 17.531 1.000 1 A 96.810 1 ATOM 4448 N N . ALA 269 269 ? A -17.587 -11.598 15.295 1.000 1 A 94.630 1 ATOM 4449 C CA . ALA 269 269 ? A -16.364 -11.580 14.494 1.000 1 A 94.630 1 ATOM 4450 C C . ALA 269 269 ? A -15.104 -11.629 15.377 1.000 1 A 94.630 1 ATOM 4451 O O . ALA 269 269 ? A -14.187 -12.398 15.087 1.000 1 A 94.630 1 ATOM 4452 C CB . ALA 269 269 ? A -16.379 -10.352 13.576 1.000 1 A 94.630 1 ATOM 4453 H H . ALA 269 269 ? A -18.188 -10.786 15.278 1.000 1 A 94.630 1 ATOM 4454 H HA . ALA 269 269 ? A -16.350 -12.470 13.865 1.000 1 A 94.630 1 ATOM 4455 H HB1 . ALA 269 269 ? A -16.366 -9.436 14.167 1.000 1 A 94.630 1 ATOM 4456 H HB2 . ALA 269 269 ? A -15.503 -10.367 12.928 1.000 1 A 94.630 1 ATOM 4457 H HB3 . ALA 269 269 ? A -17.280 -10.361 12.962 1.000 1 A 94.630 1 ATOM 4458 N N . CYS 270 270 ? A -15.078 -10.895 16.493 1.000 1 A 95.730 1 ATOM 4459 C CA . CYS 270 270 ? A -13.965 -10.930 17.444 1.000 1 A 95.730 1 ATOM 4460 C C . CYS 270 270 ? A -13.757 -12.333 18.032 1.000 1 A 95.730 1 ATOM 4461 O O . CYS 270 270 ? A -12.616 -12.788 18.123 1.000 1 A 95.730 1 ATOM 4462 C CB . CYS 270 270 ? A -14.191 -9.891 18.549 1.000 1 A 95.730 1 ATOM 4463 S SG . CYS 270 270 ? A -14.192 -8.223 17.839 1.000 1 A 95.730 1 ATOM 4464 H H . CYS 270 270 ? A -15.855 -10.279 16.686 1.000 1 A 95.730 1 ATOM 4465 H HA . CYS 270 270 ? A -13.047 -10.668 16.918 1.000 1 A 95.730 1 ATOM 4466 H HB2 . CYS 270 270 ? A -15.132 -10.077 19.067 1.000 1 A 95.730 1 ATOM 4467 H HB3 . CYS 270 270 ? A -13.377 -9.960 19.272 1.000 1 A 95.730 1 ATOM 4468 H HG . CYS 270 270 ? A -15.420 -8.269 17.315 1.000 1 A 95.730 1 ATOM 4469 N N . VAL 271 271 ? A -14.839 -13.066 18.332 1.000 1 A 96.160 1 ATOM 4470 C CA . VAL 271 271 ? A -14.751 -14.478 18.745 1.000 1 A 96.160 1 ATOM 4471 C C . VAL 271 271 ? A -14.195 -15.356 17.622 1.000 1 A 96.160 1 ATOM 4472 O O . VAL 271 271 ? A -13.309 -16.170 17.879 1.000 1 A 96.160 1 ATOM 4473 C CB . VAL 271 271 ? A -16.107 -15.024 19.236 1.000 1 A 96.160 1 ATOM 4474 C CG1 . VAL 271 271 ? A -16.014 -16.504 19.636 1.000 1 A 96.160 1 ATOM 4475 C CG2 . VAL 271 271 ? A -16.604 -14.250 20.459 1.000 1 A 96.160 1 ATOM 4476 H H . VAL 271 271 ? A -15.745 -12.622 18.286 1.000 1 A 96.160 1 ATOM 4477 H HA . VAL 271 271 ? A -14.048 -14.545 19.576 1.000 1 A 96.160 1 ATOM 4478 H HB . VAL 271 271 ? A -16.846 -14.930 18.441 1.000 1 A 96.160 1 ATOM 4479 H HG11 . VAL 271 271 ? A -15.762 -17.125 18.776 1.000 1 A 96.160 1 ATOM 4480 H HG12 . VAL 271 271 ? A -16.977 -16.839 20.021 1.000 1 A 96.160 1 ATOM 4481 H HG13 . VAL 271 271 ? A -15.257 -16.635 20.409 1.000 1 A 96.160 1 ATOM 4482 H HG21 . VAL 271 271 ? A -16.868 -13.229 20.183 1.000 1 A 96.160 1 ATOM 4483 H HG22 . VAL 271 271 ? A -15.836 -14.218 21.231 1.000 1 A 96.160 1 ATOM 4484 H HG23 . VAL 271 271 ? A -17.494 -14.734 20.863 1.000 1 A 96.160 1 ATOM 4485 N N . ARG 272 272 ? A -14.649 -15.185 16.368 1.000 1 A 93.210 1 ATOM 4486 C CA . ARG 272 272 ? A -14.138 -15.967 15.217 1.000 1 A 93.210 1 ATOM 4487 C C . ARG 272 272 ? A -12.631 -15.821 15.034 1.000 1 A 93.210 1 ATOM 4488 O O . ARG 272 272 ? A -11.974 -16.805 14.697 1.000 1 A 93.210 1 ATOM 4489 C CB . ARG 272 272 ? A -14.809 -15.560 13.894 1.000 1 A 93.210 1 ATOM 4490 C CG . ARG 272 272 ? A -16.281 -15.952 13.839 1.000 1 A 93.210 1 ATOM 4491 C CD . ARG 272 272 ? A -16.921 -15.564 12.510 1.000 1 A 93.210 1 ATOM 4492 N NE . ARG 272 272 ? A -18.374 -15.809 12.554 1.000 1 A 93.210 1 ATOM 4493 C CZ . ARG 272 272 ? A -19.232 -15.521 11.595 1.000 1 A 93.210 1 ATOM 4494 N NH1 . ARG 272 272 ? A -18.841 -15.023 10.454 1.000 1 A 93.210 1 ATOM 4495 N NH2 . ARG 272 272 ? A -20.507 -15.735 11.770 1.000 1 A 93.210 1 ATOM 4496 H H . ARG 272 272 ? A -15.358 -14.481 16.219 1.000 1 A 93.210 1 ATOM 4497 H HA . ARG 272 272 ? A -14.311 -17.026 15.407 1.000 1 A 93.210 1 ATOM 4498 H HB2 . ARG 272 272 ? A -14.296 -16.061 13.073 1.000 1 A 93.210 1 ATOM 4499 H HB3 . ARG 272 272 ? A -14.710 -14.486 13.741 1.000 1 A 93.210 1 ATOM 4500 H HG2 . ARG 272 272 ? A -16.806 -15.412 14.626 1.000 1 A 93.210 1 ATOM 4501 H HG3 . ARG 272 272 ? A -16.383 -17.026 13.995 1.000 1 A 93.210 1 ATOM 4502 H HD2 . ARG 272 272 ? A -16.736 -14.505 12.330 1.000 1 A 93.210 1 ATOM 4503 H HD3 . ARG 272 272 ? A -16.460 -16.140 11.707 1.000 1 A 93.210 1 ATOM 4504 H HE . ARG 272 272 ? A -18.754 -16.133 13.432 1.000 1 A 93.210 1 ATOM 4505 H HH11 . ARG 272 272 ? A -19.501 -14.852 9.708 1.000 1 A 93.210 1 ATOM 4506 H HH12 . ARG 272 272 ? A -17.853 -14.896 10.289 1.000 1 A 93.210 1 ATOM 4507 H HH21 . ARG 272 272 ? A -21.170 -15.462 11.058 1.000 1 A 93.210 1 ATOM 4508 H HH22 . ARG 272 272 ? A -20.849 -16.065 12.660 1.000 1 A 93.210 1 ATOM 4509 N N . PHE 273 273 ? A -12.107 -14.616 15.246 1.000 1 A 91.060 1 ATOM 4510 C CA . PHE 273 273 ? A -10.689 -14.304 15.071 1.000 1 A 91.060 1 ATOM 4511 C C . PHE 273 273 ? A -9.852 -14.428 16.352 1.000 1 A 91.060 1 ATOM 4512 O O . PHE 273 273 ? A -8.644 -14.220 16.284 1.000 1 A 91.060 1 ATOM 4513 C CB . PHE 273 273 ? A -10.549 -12.925 14.412 1.000 1 A 91.060 1 ATOM 4514 C CG . PHE 273 273 ? A -11.133 -12.850 13.014 1.000 1 A 91.060 1 ATOM 4515 C CD1 . PHE 273 273 ? A -10.615 -13.668 11.991 1.000 1 A 91.060 1 ATOM 4516 C CD2 . PHE 273 273 ? A -12.193 -11.969 12.731 1.000 1 A 91.060 1 ATOM 4517 C CE1 . PHE 273 273 ? A -11.180 -13.633 10.705 1.000 1 A 91.060 1 ATOM 4518 C CE2 . PHE 273 273 ? A -12.758 -11.934 11.446 1.000 1 A 91.060 1 ATOM 4519 C CZ . PHE 273 273 ? A -12.261 -12.776 10.438 1.000 1 A 91.060 1 ATOM 4520 H H . PHE 273 273 ? A -12.740 -13.858 15.456 1.000 1 A 91.060 1 ATOM 4521 H HA . PHE 273 273 ? A -10.259 -15.034 14.385 1.000 1 A 91.060 1 ATOM 4522 H HB2 . PHE 273 273 ? A -9.491 -12.675 14.337 1.000 1 A 91.060 1 ATOM 4523 H HB3 . PHE 273 273 ? A -11.026 -12.182 15.051 1.000 1 A 91.060 1 ATOM 4524 H HD1 . PHE 273 273 ? A -9.790 -14.334 12.197 1.000 1 A 91.060 1 ATOM 4525 H HD2 . PHE 273 273 ? A -12.571 -11.312 13.501 1.000 1 A 91.060 1 ATOM 4526 H HE1 . PHE 273 273 ? A -10.804 -14.274 9.921 1.000 1 A 91.060 1 ATOM 4527 H HE2 . PHE 273 273 ? A -13.571 -11.257 11.230 1.000 1 A 91.060 1 ATOM 4528 H HZ . PHE 273 273 ? A -12.711 -12.765 9.457 1.000 1 A 91.060 1 ATOM 4529 N N . TYR 274 274 ? A -10.453 -14.805 17.488 1.000 1 A 93.580 1 ATOM 4530 C CA . TYR 274 274 ? A -9.783 -14.860 18.794 1.000 1 A 93.580 1 ATOM 4531 C C . TYR 274 274 ? A -9.135 -13.509 19.183 1.000 1 A 93.580 1 ATOM 4532 O O . TYR 274 274 ? A -8.014 -13.455 19.678 1.000 1 A 93.580 1 ATOM 4533 C CB . TYR 274 274 ? A -8.826 -16.071 18.839 1.000 1 A 93.580 1 ATOM 4534 C CG . TYR 274 274 ? A -8.440 -16.536 20.234 1.000 1 A 93.580 1 ATOM 4535 C CD1 . TYR 274 274 ? A -7.308 -16.010 20.889 1.000 1 A 93.580 1 ATOM 4536 C CD2 . TYR 274 274 ? A -9.223 -17.506 20.882 1.000 1 A 93.580 1 ATOM 4537 C CE1 . TYR 274 274 ? A -6.999 -16.399 22.204 1.000 1 A 93.580 1 ATOM 4538 C CE2 . TYR 274 274 ? A -8.897 -17.933 22.182 1.000 1 A 93.580 1 ATOM 4539 C CZ . TYR 274 274 ? A -7.796 -17.365 22.853 1.000 1 A 93.580 1 ATOM 4540 O OH . TYR 274 274 ? A -7.501 -17.753 24.121 1.000 1 A 93.580 1 ATOM 4541 H H . TYR 274 274 ? A -11.449 -14.970 17.472 1.000 1 A 93.580 1 ATOM 4542 H HA . TYR 274 274 ? A -10.563 -15.041 19.534 1.000 1 A 93.580 1 ATOM 4543 H HB2 . TYR 274 274 ? A -9.303 -16.909 18.331 1.000 1 A 93.580 1 ATOM 4544 H HB3 . TYR 274 274 ? A -7.920 -15.834 18.282 1.000 1 A 93.580 1 ATOM 4545 H HD1 . TYR 274 274 ? A -6.689 -15.277 20.393 1.000 1 A 93.580 1 ATOM 4546 H HD2 . TYR 274 274 ? A -10.091 -17.907 20.380 1.000 1 A 93.580 1 ATOM 4547 H HE1 . TYR 274 274 ? A -6.157 -15.953 22.712 1.000 1 A 93.580 1 ATOM 4548 H HE2 . TYR 274 274 ? A -9.505 -18.670 22.687 1.000 1 A 93.580 1 ATOM 4549 H HH . TYR 274 274 ? A -6.790 -17.223 24.489 1.000 1 A 93.580 1 ATOM 4550 N N . ASN 275 275 ? A -9.826 -12.394 18.930 1.000 1 A 94.150 1 ATOM 4551 C CA . ASN 275 275 ? A -9.342 -11.045 19.243 1.000 1 A 94.150 1 ATOM 4552 C C . ASN 275 275 ? A -10.000 -10.548 20.537 1.000 1 A 94.150 1 ATOM 4553 O O . ASN 275 275 ? A -11.125 -10.045 20.521 1.000 1 A 94.150 1 ATOM 4554 C CB . ASN 275 275 ? A -9.582 -10.137 18.027 1.000 1 A 94.150 1 ATOM 4555 C CG . ASN 275 275 ? A -8.660 -10.466 16.863 1.000 1 A 94.150 1 ATOM 4556 O OD1 . ASN 275 275 ? A -7.516 -10.865 16.993 1.000 1 A 94.150 1 ATOM 4557 N ND2 . ASN 275 275 ? A -9.085 -10.248 15.648 1.000 1 A 94.150 1 ATOM 4558 H H . ASN 275 275 ? A -10.764 -12.490 18.567 1.000 1 A 94.150 1 ATOM 4559 H HA . ASN 275 275 ? A -8.268 -11.064 19.426 1.000 1 A 94.150 1 ATOM 4560 H HB2 . ASN 275 275 ? A -9.392 -9.103 18.316 1.000 1 A 94.150 1 ATOM 4561 H HB3 . ASN 275 275 ? A -10.623 -10.218 17.713 1.000 1 A 94.150 1 ATOM 4562 H HD21 . ASN 275 275 ? A -10.011 -9.891 15.460 1.000 1 A 94.150 1 ATOM 4563 H HD22 . ASN 275 275 ? A -8.472 -10.537 14.898 1.000 1 A 94.150 1 ATOM 4564 N N . MET 276 276 ? A -9.309 -10.761 21.658 1.000 1 A 94.170 1 ATOM 4565 C CA . MET 276 276 ? A -9.832 -10.557 23.014 1.000 1 A 94.170 1 ATOM 4566 C C . MET 276 276 ? A -10.041 -9.083 23.345 1.000 1 A 94.170 1 ATOM 4567 O O . MET 276 276 ? A -11.090 -8.716 23.873 1.000 1 A 94.170 1 ATOM 4568 C CB . MET 276 276 ? A -8.858 -11.152 24.044 1.000 1 A 94.170 1 ATOM 4569 C CG . MET 276 276 ? A -8.904 -12.680 24.103 1.000 1 A 94.170 1 ATOM 4570 S SD . MET 276 276 ? A -10.471 -13.365 24.694 1.000 1 A 94.170 1 ATOM 4571 C CE . MET 276 276 ? A -10.465 -12.917 26.447 1.000 1 A 94.170 1 ATOM 4572 H H . MET 276 276 ? A -8.339 -11.024 21.560 1.000 1 A 94.170 1 ATOM 4573 H HA . MET 276 276 ? A -10.801 -11.047 23.109 1.000 1 A 94.170 1 ATOM 4574 H HB2 . MET 276 276 ? A -9.100 -10.761 25.032 1.000 1 A 94.170 1 ATOM 4575 H HB3 . MET 276 276 ? A -7.843 -10.833 23.805 1.000 1 A 94.170 1 ATOM 4576 H HG2 . MET 276 276 ? A -8.709 -13.073 23.105 1.000 1 A 94.170 1 ATOM 4577 H HG3 . MET 276 276 ? A -8.107 -13.026 24.762 1.000 1 A 94.170 1 ATOM 4578 H HE1 . MET 276 276 ? A -9.651 -13.423 26.966 1.000 1 A 94.170 1 ATOM 4579 H HE2 . MET 276 276 ? A -10.335 -11.838 26.535 1.000 1 A 94.170 1 ATOM 4580 H HE3 . MET 276 276 ? A -11.417 -13.196 26.898 1.000 1 A 94.170 1 ATOM 4581 N N . ASP 277 277 ? A -9.069 -8.232 23.019 1.000 1 A 95.410 1 ATOM 4582 C CA . ASP 277 277 ? A -9.143 -6.816 23.375 1.000 1 A 95.410 1 ATOM 4583 C C . ASP 277 277 ? A -10.287 -6.142 22.601 1.000 1 A 95.410 1 ATOM 4584 O O . ASP 277 277 ? A -11.081 -5.385 23.161 1.000 1 A 95.410 1 ATOM 4585 C CB . ASP 277 277 ? A -7.788 -6.129 23.120 1.000 1 A 95.410 1 ATOM 4586 C CG . ASP 277 277 ? A -6.630 -6.685 23.958 1.000 1 A 95.410 1 ATOM 4587 O OD1 . ASP 277 277 ? A -6.881 -7.125 25.101 1.000 1 A 95.410 1 ATOM 4588 O OD2 . ASP 277 277 ? A -5.478 -6.635 23.462 1.000 1 A 95.410 1 ATOM 4589 H H . ASP 277 277 ? A -8.255 -8.559 22.518 1.000 1 A 95.410 1 ATOM 4590 H HA . ASP 277 277 ? A -9.368 -6.730 24.438 1.000 1 A 95.410 1 ATOM 4591 H HB2 . ASP 277 277 ? A -7.891 -5.072 23.366 1.000 1 A 95.410 1 ATOM 4592 H HB3 . ASP 277 277 ? A -7.531 -6.180 22.062 1.000 1 A 95.410 1 ATOM 4593 N N . ASN 278 278 ? A -10.440 -6.482 21.318 1.000 1 A 96.080 1 ATOM 4594 C CA . ASN 278 278 ? A -11.569 -6.027 20.509 1.000 1 A 96.080 1 ATOM 4595 C C . ASN 278 278 ? A -12.920 -6.565 21.004 1.000 1 A 96.080 1 ATOM 4596 O O . ASN 278 278 ? A -13.910 -5.837 20.937 1.000 1 A 96.080 1 ATOM 4597 C CB . ASN 278 278 ? A -11.375 -6.465 19.057 1.000 1 A 96.080 1 ATOM 4598 C CG . ASN 278 278 ? A -10.273 -5.763 18.301 1.000 1 A 96.080 1 ATOM 4599 O OD1 . ASN 278 278 ? A -9.677 -4.774 18.703 1.000 1 A 96.080 1 ATOM 4600 N ND2 . ASN 278 278 ? A -10.029 -6.252 17.109 1.000 1 A 96.080 1 ATOM 4601 H H . ASN 278 278 ? A -9.728 -7.071 20.909 1.000 1 A 96.080 1 ATOM 4602 H HA . ASN 278 278 ? A -11.619 -4.939 20.550 1.000 1 A 96.080 1 ATOM 4603 H HB2 . ASN 278 278 ? A -12.299 -6.258 18.516 1.000 1 A 96.080 1 ATOM 4604 H HB3 . ASN 278 278 ? A -11.199 -7.540 19.032 1.000 1 A 96.080 1 ATOM 4605 H HD21 . ASN 278 278 ? A -9.269 -5.874 16.561 1.000 1 A 96.080 1 ATOM 4606 H HD22 . ASN 278 278 ? A -10.543 -7.064 16.799 1.000 1 A 96.080 1 ATOM 4607 N N . LEU 279 279 ? A -12.984 -7.814 21.482 1.000 1 A 96.740 1 ATOM 4608 C CA . LEU 279 279 ? A -14.210 -8.392 22.039 1.000 1 A 96.740 1 ATOM 4609 C C . LEU 279 279 ? A -14.706 -7.558 23.225 1.000 1 A 96.740 1 ATOM 4610 O O . LEU 279 279 ? A -15.860 -7.132 23.234 1.000 1 A 96.740 1 ATOM 4611 C CB . LEU 279 279 ? A -13.955 -9.859 22.445 1.000 1 A 96.740 1 ATOM 4612 C CG . LEU 279 279 ? A -15.114 -10.527 23.209 1.000 1 A 96.740 1 ATOM 4613 C CD1 . LEU 279 279 ? A -16.364 -10.623 22.337 1.000 1 A 96.740 1 ATOM 4614 C CD2 . LEU 279 279 ? A -14.703 -11.933 23.642 1.000 1 A 96.740 1 ATOM 4615 H H . LEU 279 279 ? A -12.140 -8.369 21.503 1.000 1 A 96.740 1 ATOM 4616 H HA . LEU 279 279 ? A -14.984 -8.364 21.273 1.000 1 A 96.740 1 ATOM 4617 H HB2 . LEU 279 279 ? A -13.078 -9.900 23.090 1.000 1 A 96.740 1 ATOM 4618 H HB3 . LEU 279 279 ? A -13.733 -10.442 21.551 1.000 1 A 96.740 1 ATOM 4619 H HG . LEU 279 279 ? A -15.350 -9.956 24.107 1.000 1 A 96.740 1 ATOM 4620 H HD11 . LEU 279 279 ? A -17.160 -11.126 22.888 1.000 1 A 96.740 1 ATOM 4621 H HD12 . LEU 279 279 ? A -16.702 -9.618 22.088 1.000 1 A 96.740 1 ATOM 4622 H HD13 . LEU 279 279 ? A -16.150 -11.175 21.422 1.000 1 A 96.740 1 ATOM 4623 H HD21 . LEU 279 279 ? A -14.467 -12.542 22.770 1.000 1 A 96.740 1 ATOM 4624 H HD22 . LEU 279 279 ? A -13.828 -11.871 24.289 1.000 1 A 96.740 1 ATOM 4625 H HD23 . LEU 279 279 ? A -15.516 -12.393 24.204 1.000 1 A 96.740 1 ATOM 4626 N N . PHE 280 280 ? A -13.823 -7.270 24.184 1.000 1 A 96.030 1 ATOM 4627 C CA . PHE 280 280 ? A -14.164 -6.422 25.327 1.000 1 A 96.030 1 ATOM 4628 C C . PHE 280 280 ? A -14.496 -4.994 24.909 1.000 1 A 96.030 1 ATOM 4629 O O . PHE 280 280 ? A -15.420 -4.406 25.461 1.000 1 A 96.030 1 ATOM 4630 C CB . PHE 280 280 ? A -13.029 -6.440 26.351 1.000 1 A 96.030 1 ATOM 4631 C CG . PHE 280 280 ? A -12.907 -7.755 27.088 1.000 1 A 96.030 1 ATOM 4632 C CD1 . PHE 280 280 ? A -13.985 -8.233 27.858 1.000 1 A 96.030 1 ATOM 4633 C CD2 . PHE 280 280 ? A -11.708 -8.487 27.035 1.000 1 A 96.030 1 ATOM 4634 C CE1 . PHE 280 280 ? A -13.870 -9.445 28.556 1.000 1 A 96.030 1 ATOM 4635 C CE2 . PHE 280 280 ? A -11.585 -9.683 27.762 1.000 1 A 96.030 1 ATOM 4636 C CZ . PHE 280 280 ? A -12.668 -10.170 28.513 1.000 1 A 96.030 1 ATOM 4637 H H . PHE 280 280 ? A -12.889 -7.647 24.119 1.000 1 A 96.030 1 ATOM 4638 H HA . PHE 280 280 ? A -15.064 -6.816 25.799 1.000 1 A 96.030 1 ATOM 4639 H HB2 . PHE 280 280 ? A -12.089 -6.205 25.851 1.000 1 A 96.030 1 ATOM 4640 H HB3 . PHE 280 280 ? A -13.212 -5.662 27.092 1.000 1 A 96.030 1 ATOM 4641 H HD1 . PHE 280 280 ? A -14.907 -7.675 27.917 1.000 1 A 96.030 1 ATOM 4642 H HD2 . PHE 280 280 ? A -10.869 -8.117 26.464 1.000 1 A 96.030 1 ATOM 4643 H HE1 . PHE 280 280 ? A -14.703 -9.809 29.140 1.000 1 A 96.030 1 ATOM 4644 H HE2 . PHE 280 280 ? A -10.639 -10.203 27.775 1.000 1 A 96.030 1 ATOM 4645 H HZ . PHE 280 280 ? A -12.570 -11.084 29.080 1.000 1 A 96.030 1 ATOM 4646 N N . PHE 281 281 ? A -13.826 -4.460 23.886 1.000 1 A 97.030 1 ATOM 4647 C CA . PHE 281 281 ? A -14.182 -3.154 23.340 1.000 1 A 97.030 1 ATOM 4648 C C . PHE 281 281 ? A -15.602 -3.134 22.753 1.000 1 A 97.030 1 ATOM 4649 O O . PHE 281 281 ? A -16.328 -2.161 22.937 1.000 1 A 97.030 1 ATOM 4650 C CB . PHE 281 281 ? A -13.151 -2.743 22.285 1.000 1 A 97.030 1 ATOM 4651 C CG . PHE 281 281 ? A -13.333 -1.324 21.793 1.000 1 A 97.030 1 ATOM 4652 C CD1 . PHE 281 281 ? A -13.577 -1.066 20.433 1.000 1 A 97.030 1 ATOM 4653 C CD2 . PHE 281 281 ? A -13.286 -0.258 22.709 1.000 1 A 97.030 1 ATOM 4654 C CE1 . PHE 281 281 ? A -13.765 0.255 19.993 1.000 1 A 97.030 1 ATOM 4655 C CE2 . PHE 281 281 ? A -13.479 1.062 22.273 1.000 1 A 97.030 1 ATOM 4656 C CZ . PHE 281 281 ? A -13.717 1.319 20.913 1.000 1 A 97.030 1 ATOM 4657 H H . PHE 281 281 ? A -13.027 -4.951 23.512 1.000 1 A 97.030 1 ATOM 4658 H HA . PHE 281 281 ? A -14.162 -2.433 24.157 1.000 1 A 97.030 1 ATOM 4659 H HB2 . PHE 281 281 ? A -13.212 -3.426 21.437 1.000 1 A 97.030 1 ATOM 4660 H HB3 . PHE 281 281 ? A -12.149 -2.829 22.703 1.000 1 A 97.030 1 ATOM 4661 H HD1 . PHE 281 281 ? A -13.637 -1.885 19.731 1.000 1 A 97.030 1 ATOM 4662 H HD2 . PHE 281 281 ? A -13.135 -0.459 23.760 1.000 1 A 97.030 1 ATOM 4663 H HE1 . PHE 281 281 ? A -13.969 0.450 18.950 1.000 1 A 97.030 1 ATOM 4664 H HE2 . PHE 281 281 ? A -13.467 1.869 22.990 1.000 1 A 97.030 1 ATOM 4665 H HZ . PHE 281 281 ? A -13.879 2.334 20.584 1.000 1 A 97.030 1 ATOM 4666 N N . CYS 282 282 ? A -16.036 -4.209 22.087 1.000 1 A 97.370 1 ATOM 4667 C CA . CYS 282 282 ? A -17.410 -4.324 21.591 1.000 1 A 97.370 1 ATOM 4668 C C . CYS 282 282 ? A -18.428 -4.358 22.741 1.000 1 A 97.370 1 ATOM 4669 O O . CYS 282 282 ? A -19.476 -3.724 22.643 1.000 1 A 97.370 1 ATOM 4670 C CB . CYS 282 282 ? A -17.558 -5.565 20.697 1.000 1 A 97.370 1 ATOM 4671 S SG . CYS 282 282 ? A -16.531 -5.424 19.205 1.000 1 A 97.370 1 ATOM 4672 H H . CYS 282 282 ? A -15.404 -4.987 21.957 1.000 1 A 97.370 1 ATOM 4673 H HA . CYS 282 282 ? A -17.642 -3.440 20.996 1.000 1 A 97.370 1 ATOM 4674 H HB2 . CYS 282 282 ? A -17.281 -6.460 21.255 1.000 1 A 97.370 1 ATOM 4675 H HB3 . CYS 282 282 ? A -18.602 -5.659 20.396 1.000 1 A 97.370 1 ATOM 4676 H HG . CYS 282 282 ? A -15.358 -5.482 19.841 1.000 1 A 97.370 1 ATOM 4677 N N . ILE 283 283 ? A -18.109 -5.045 23.841 1.000 1 A 96.560 1 ATOM 4678 C CA . ILE 283 283 ? A -18.938 -5.068 25.056 1.000 1 A 96.560 1 ATOM 4679 C C . ILE 283 283 ? A -19.004 -3.671 25.691 1.000 1 A 96.560 1 ATOM 4680 O O . ILE 283 283 ? A -20.086 -3.197 26.037 1.000 1 A 96.560 1 ATOM 4681 C CB . ILE 283 283 ? A -18.396 -6.123 26.045 1.000 1 A 96.560 1 ATOM 4682 C CG1 . ILE 283 283 ? A -18.524 -7.550 25.462 1.000 1 A 96.560 1 ATOM 4683 C CG2 . ILE 283 283 ? A -19.150 -6.047 27.378 1.000 1 A 96.560 1 ATOM 4684 C CD1 . ILE 283 283 ? A -17.732 -8.616 26.235 1.000 1 A 96.560 1 ATOM 4685 H H . ILE 283 283 ? A -17.237 -5.555 23.851 1.000 1 A 96.560 1 ATOM 4686 H HA . ILE 283 283 ? A -19.958 -5.346 24.789 1.000 1 A 96.560 1 ATOM 4687 H HB . ILE 283 283 ? A -17.343 -5.918 26.240 1.000 1 A 96.560 1 ATOM 4688 H HG12 . ILE 283 283 ? A -19.575 -7.838 25.438 1.000 1 A 96.560 1 ATOM 4689 H HG13 . ILE 283 283 ? A -18.161 -7.565 24.434 1.000 1 A 96.560 1 ATOM 4690 H HG21 . ILE 283 283 ? A -18.978 -5.088 27.867 1.000 1 A 96.560 1 ATOM 4691 H HG22 . ILE 283 283 ? A -20.219 -6.179 27.211 1.000 1 A 96.560 1 ATOM 4692 H HG23 . ILE 283 283 ? A -18.784 -6.826 28.046 1.000 1 A 96.560 1 ATOM 4693 H HD11 . ILE 283 283 ? A -17.815 -9.569 25.712 1.000 1 A 96.560 1 ATOM 4694 H HD12 . ILE 283 283 ? A -16.679 -8.336 26.284 1.000 1 A 96.560 1 ATOM 4695 H HD13 . ILE 283 283 ? A -18.123 -8.745 27.244 1.000 1 A 96.560 1 ATOM 4696 N N . ASP 284 284 ? A -17.874 -2.963 25.767 1.000 1 A 95.920 1 ATOM 4697 C CA . ASP 284 284 ? A -17.823 -1.580 26.250 1.000 1 A 95.920 1 ATOM 4698 C C . ASP 284 284 ? A -18.660 -0.634 25.361 1.000 1 A 95.920 1 ATOM 4699 O O . ASP 284 284 ? A -19.231 0.335 25.861 1.000 1 A 95.920 1 ATOM 4700 C CB . ASP 284 284 ? A -16.357 -1.108 26.366 1.000 1 A 95.920 1 ATOM 4701 C CG . ASP 284 284 ? A -15.559 -1.767 27.510 1.000 1 A 95.920 1 ATOM 4702 O OD1 . ASP 284 284 ? A -16.178 -2.220 28.497 1.000 1 A 95.920 1 ATOM 4703 O OD2 . ASP 284 284 ? A -14.305 -1.780 27.489 1.000 1 A 95.920 1 ATOM 4704 H H . ASP 284 284 ? A -17.005 -3.417 25.525 1.000 1 A 95.920 1 ATOM 4705 H HA . ASP 284 284 ? A -18.266 -1.549 27.246 1.000 1 A 95.920 1 ATOM 4706 H HB2 . ASP 284 284 ? A -16.378 -0.034 26.554 1.000 1 A 95.920 1 ATOM 4707 H HB3 . ASP 284 284 ? A -15.842 -1.272 25.420 1.000 1 A 95.920 1 ATOM 4708 N N . LEU 285 285 ? A -18.816 -0.941 24.067 1.000 1 A 96.080 1 ATOM 4709 C CA . LEU 285 285 ? A -19.719 -0.238 23.143 1.000 1 A 96.080 1 ATOM 4710 C C . LEU 285 285 ? A -21.195 -0.654 23.245 1.000 1 A 96.080 1 ATOM 4711 O O . LEU 285 285 ? A -22.041 -0.036 22.598 1.000 1 A 96.080 1 ATOM 4712 C CB . LEU 285 285 ? A -19.202 -0.395 21.699 1.000 1 A 96.080 1 ATOM 4713 C CG . LEU 285 285 ? A -17.909 0.379 21.417 1.000 1 A 96.080 1 ATOM 4714 C CD1 . LEU 285 285 ? A -17.355 -0.003 20.042 1.000 1 A 96.080 1 ATOM 4715 C CD2 . LEU 285 285 ? A -18.148 1.888 21.424 1.000 1 A 96.080 1 ATOM 4716 H H . LEU 285 285 ? A -18.284 -1.722 23.711 1.000 1 A 96.080 1 ATOM 4717 H HA . LEU 285 285 ? A -19.720 0.816 23.420 1.000 1 A 96.080 1 ATOM 4718 H HB2 . LEU 285 285 ? A -19.033 -1.453 21.502 1.000 1 A 96.080 1 ATOM 4719 H HB3 . LEU 285 285 ? A -19.965 -0.047 21.002 1.000 1 A 96.080 1 ATOM 4720 H HG . LEU 285 285 ? A -17.160 0.148 22.174 1.000 1 A 96.080 1 ATOM 4721 H HD11 . LEU 285 285 ? A -18.117 0.141 19.276 1.000 1 A 96.080 1 ATOM 4722 H HD12 . LEU 285 285 ? A -17.045 -1.048 20.065 1.000 1 A 96.080 1 ATOM 4723 H HD13 . LEU 285 285 ? A -16.483 0.610 19.814 1.000 1 A 96.080 1 ATOM 4724 H HD21 . LEU 285 285 ? A -17.180 2.383 21.499 1.000 1 A 96.080 1 ATOM 4725 H HD22 . LEU 285 285 ? A -18.727 2.192 22.296 1.000 1 A 96.080 1 ATOM 4726 H HD23 . LEU 285 285 ? A -18.683 2.194 20.525 1.000 1 A 96.080 1 ATOM 4727 N N . GLY 286 286 ? A -21.517 -1.655 24.065 1.000 1 A 95.460 1 ATOM 4728 C CA . GLY 286 286 ? A -22.881 -2.124 24.302 1.000 1 A 95.460 1 ATOM 4729 C C . GLY 286 286 ? A -23.308 -3.335 23.475 1.000 1 A 95.460 1 ATOM 4730 O O . GLY 286 286 ? A -24.507 -3.521 23.294 1.000 1 A 95.460 1 ATOM 4731 H H . GLY 286 286 ? A -20.775 -2.104 24.583 1.000 1 A 95.460 1 ATOM 4732 H HA2 . GLY 286 286 ? A -22.956 -2.420 25.348 1.000 1 A 95.460 1 ATOM 4733 H HA3 . GLY 286 286 ? A -23.593 -1.318 24.121 1.000 1 A 95.460 1 ATOM 4734 N N . ALA 287 287 ? A -22.374 -4.149 22.973 1.000 1 A 96.780 1 ATOM 4735 C CA . ALA 287 287 ? A -22.723 -5.469 22.446 1.000 1 A 96.780 1 ATOM 4736 C C . ALA 287 287 ? A -23.300 -6.375 23.544 1.000 1 A 96.780 1 ATOM 4737 O O . ALA 287 287 ? A -22.742 -6.454 24.639 1.000 1 A 96.780 1 ATOM 4738 C CB . ALA 287 287 ? A -21.503 -6.132 21.803 1.000 1 A 96.780 1 ATOM 4739 H H . ALA 287 287 ? A -21.398 -3.935 23.122 1.000 1 A 96.780 1 ATOM 4740 H HA . ALA 287 287 ? A -23.495 -5.340 21.687 1.000 1 A 96.780 1 ATOM 4741 H HB1 . ALA 287 287 ? A -20.743 -6.323 22.561 1.000 1 A 96.780 1 ATOM 4742 H HB2 . ALA 287 287 ? A -21.094 -5.490 21.023 1.000 1 A 96.780 1 ATOM 4743 H HB3 . ALA 287 287 ? A -21.809 -7.079 21.359 1.000 1 A 96.780 1 ATOM 4744 N N . ASP 288 288 ? A -24.383 -7.081 23.223 1.000 1 A 95.930 1 ATOM 4745 C CA . ASP 288 288 ? A -25.157 -7.916 24.147 1.000 1 A 95.930 1 ATOM 4746 C C . ASP 288 288 ? A -25.438 -9.341 23.629 1.000 1 A 95.930 1 ATOM 4747 O O . ASP 288 288 ? A -26.141 -10.110 24.283 1.000 1 A 95.930 1 ATOM 4748 C CB . ASP 288 288 ? A -26.437 -7.172 24.573 1.000 1 A 95.930 1 ATOM 4749 C CG . ASP 288 288 ? A -27.462 -6.934 23.453 1.000 1 A 95.930 1 ATOM 4750 O OD1 . ASP 288 288 ? A -27.171 -7.256 22.276 1.000 1 A 95.930 1 ATOM 4751 O OD2 . ASP 288 288 ? A -28.544 -6.392 23.770 1.000 1 A 95.930 1 ATOM 4752 H H . ASP 288 288 ? A -24.793 -6.935 22.311 1.000 1 A 95.930 1 ATOM 4753 H HA . ASP 288 288 ? A -24.562 -8.052 25.050 1.000 1 A 95.930 1 ATOM 4754 H HB2 . ASP 288 288 ? A -26.919 -7.741 25.368 1.000 1 A 95.930 1 ATOM 4755 H HB3 . ASP 288 288 ? A -26.153 -6.207 24.993 1.000 1 A 95.930 1 ATOM 4756 N N . ALA 289 289 ? A -24.832 -9.746 22.506 1.000 1 A 96.570 1 ATOM 4757 C CA . ALA 289 289 ? A -24.932 -11.102 21.943 1.000 1 A 96.570 1 ATOM 4758 C C . ALA 289 289 ? A -24.081 -12.150 22.703 1.000 1 A 96.570 1 ATOM 4759 O O . ALA 289 289 ? A -23.292 -12.891 22.106 1.000 1 A 96.570 1 ATOM 4760 C CB . ALA 289 289 ? A -24.627 -11.037 20.442 1.000 1 A 96.570 1 ATOM 4761 H H . ALA 289 289 ? A -24.291 -9.055 22.008 1.000 1 A 96.570 1 ATOM 4762 H HA . ALA 289 289 ? A -25.966 -11.431 22.044 1.000 1 A 96.570 1 ATOM 4763 H HB1 . ALA 289 289 ? A -24.706 -12.036 20.013 1.000 1 A 96.570 1 ATOM 4764 H HB2 . ALA 289 289 ? A -23.625 -10.643 20.274 1.000 1 A 96.570 1 ATOM 4765 H HB3 . ALA 289 289 ? A -25.374 -10.401 19.967 1.000 1 A 96.570 1 ATOM 4766 N N . PHE 290 290 ? A -24.195 -12.187 24.035 1.000 1 A 96.600 1 ATOM 4767 C CA . PHE 290 290 ? A -23.407 -13.056 24.918 1.000 1 A 96.600 1 ATOM 4768 C C . PHE 290 290 ? A -23.648 -14.542 24.650 1.000 1 A 96.600 1 ATOM 4769 O O . PHE 290 290 ? A -22.685 -15.304 24.554 1.000 1 A 96.600 1 ATOM 4770 C CB . PHE 290 290 ? A -23.710 -12.731 26.388 1.000 1 A 96.600 1 ATOM 4771 C CG . PHE 290 290 ? A -23.136 -11.408 26.846 1.000 1 A 96.600 1 ATOM 4772 C CD1 . PHE 290 290 ? A -21.779 -11.330 27.210 1.000 1 A 96.600 1 ATOM 4773 C CD2 . PHE 290 290 ? A -23.943 -10.257 26.896 1.000 1 A 96.600 1 ATOM 4774 C CE1 . PHE 290 290 ? A -21.219 -10.096 27.584 1.000 1 A 96.600 1 ATOM 4775 C CE2 . PHE 290 290 ? A -23.387 -9.028 27.293 1.000 1 A 96.600 1 ATOM 4776 C CZ . PHE 290 290 ? A -22.025 -8.946 27.628 1.000 1 A 96.600 1 ATOM 4777 H H . PHE 290 290 ? A -24.868 -11.557 24.450 1.000 1 A 96.600 1 ATOM 4778 H HA . PHE 290 290 ? A -22.348 -12.874 24.737 1.000 1 A 96.600 1 ATOM 4779 H HB2 . PHE 290 290 ? A -23.281 -13.513 27.015 1.000 1 A 96.600 1 ATOM 4780 H HB3 . PHE 290 290 ? A -24.788 -12.741 26.552 1.000 1 A 96.600 1 ATOM 4781 H HD1 . PHE 290 290 ? A -21.171 -12.222 27.210 1.000 1 A 96.600 1 ATOM 4782 H HD2 . PHE 290 290 ? A -24.990 -10.314 26.636 1.000 1 A 96.600 1 ATOM 4783 H HE1 . PHE 290 290 ? A -20.172 -10.035 27.842 1.000 1 A 96.600 1 ATOM 4784 H HE2 . PHE 290 290 ? A -24.006 -8.144 27.333 1.000 1 A 96.600 1 ATOM 4785 H HZ . PHE 290 290 ? A -21.604 -7.996 27.923 1.000 1 A 96.600 1 ATOM 4786 N N . GLU 291 291 ? A -24.906 -14.948 24.482 1.000 1 A 96.430 1 ATOM 4787 C CA . GLU 291 291 ? A -25.274 -16.349 24.261 1.000 1 A 96.430 1 ATOM 4788 C C . GLU 291 291 ? A -24.728 -16.868 22.923 1.000 1 A 96.430 1 ATOM 4789 O O . GLU 291 291 ? A -24.084 -17.919 22.868 1.000 1 A 96.430 1 ATOM 4790 C CB . GLU 291 291 ? A -26.804 -16.505 24.330 1.000 1 A 96.430 1 ATOM 4791 C CG . GLU 291 291 ? A -27.388 -16.228 25.727 1.000 1 A 96.430 1 ATOM 4792 C CD . GLU 291 291 ? A -26.808 -17.140 26.824 1.000 1 A 96.430 1 ATOM 4793 O OE1 . GLU 291 291 ? A -26.692 -16.673 27.977 1.000 1 A 96.430 1 ATOM 4794 O OE2 . GLU 291 291 ? A -26.477 -18.311 26.520 1.000 1 A 96.430 1 ATOM 4795 H H . GLU 291 291 ? A -25.645 -14.261 24.523 1.000 1 A 96.430 1 ATOM 4796 H HA . GLU 291 291 ? A -24.828 -16.966 25.041 1.000 1 A 96.430 1 ATOM 4797 H HB2 . GLU 291 291 ? A -27.068 -17.520 24.034 1.000 1 A 96.430 1 ATOM 4798 H HB3 . GLU 291 291 ? A -27.266 -15.823 23.616 1.000 1 A 96.430 1 ATOM 4799 H HG2 . GLU 291 291 ? A -28.467 -16.373 25.682 1.000 1 A 96.430 1 ATOM 4800 H HG3 . GLU 291 291 ? A -27.208 -15.183 25.982 1.000 1 A 96.430 1 ATOM 4801 N N . GLU 292 292 ? A -24.894 -16.106 21.839 1.000 1 A 97.770 1 ATOM 4802 C CA . GLU 292 292 ? A -24.386 -16.469 20.515 1.000 1 A 97.770 1 ATOM 4803 C C . GLU 292 292 ? A -22.854 -16.474 20.472 1.000 1 A 97.770 1 ATOM 4804 O O . GLU 292 292 ? A -22.243 -17.376 19.889 1.000 1 A 97.770 1 ATOM 4805 C CB . GLU 292 292 ? A -24.919 -15.510 19.437 1.000 1 A 97.770 1 ATOM 4806 C CG . GLU 292 292 ? A -26.445 -15.515 19.266 1.000 1 A 97.770 1 ATOM 4807 C CD . GLU 292 292 ? A -27.194 -14.513 20.161 1.000 1 A 97.770 1 ATOM 4808 O OE1 . GLU 292 292 ? A -28.356 -14.220 19.802 1.000 1 A 97.770 1 ATOM 4809 O OE2 . GLU 292 292 ? A -26.609 -14.046 21.165 1.000 1 A 97.770 1 ATOM 4810 H H . GLU 292 292 ? A -25.439 -15.259 21.916 1.000 1 A 97.770 1 ATOM 4811 H HA . GLU 292 292 ? A -24.722 -17.479 20.280 1.000 1 A 97.770 1 ATOM 4812 H HB2 . GLU 292 292 ? A -24.486 -15.824 18.487 1.000 1 A 97.770 1 ATOM 4813 H HB3 . GLU 292 292 ? A -24.571 -14.495 19.631 1.000 1 A 97.770 1 ATOM 4814 H HG2 . GLU 292 292 ? A -26.823 -16.523 19.434 1.000 1 A 97.770 1 ATOM 4815 H HG3 . GLU 292 292 ? A -26.653 -15.264 18.226 1.000 1 A 97.770 1 ATOM 4816 N N . ALA 293 293 ? A -22.215 -15.484 21.102 1.000 1 A 97.430 1 ATOM 4817 C CA . ALA 293 293 ? A -20.762 -15.391 21.179 1.000 1 A 97.430 1 ATOM 4818 C C . ALA 293 293 ? A -20.162 -16.537 22.005 1.000 1 A 97.430 1 ATOM 4819 O O . ALA 293 293 ? A -19.146 -17.117 21.609 1.000 1 A 97.430 1 ATOM 4820 C CB . ALA 293 293 ? A -20.409 -14.015 21.750 1.000 1 A 97.430 1 ATOM 4821 H H . ALA 293 293 ? A -22.767 -14.769 21.554 1.000 1 A 97.430 1 ATOM 4822 H HA . ALA 293 293 ? A -20.349 -15.468 20.174 1.000 1 A 97.430 1 ATOM 4823 H HB1 . ALA 293 293 ? A -20.867 -13.903 22.732 1.000 1 A 97.430 1 ATOM 4824 H HB2 . ALA 293 293 ? A -19.329 -13.903 21.842 1.000 1 A 97.430 1 ATOM 4825 H HB3 . ALA 293 293 ? A -20.793 -13.231 21.098 1.000 1 A 97.430 1 ATOM 4826 N N . LYS 294 294 ? A -20.811 -16.915 23.111 1.000 1 A 97.200 1 ATOM 4827 C CA . LYS 294 294 ? A -20.417 -18.051 23.947 1.000 1 A 97.200 1 ATOM 4828 C C . LYS 294 294 ? A -20.560 -19.373 23.201 1.000 1 A 97.200 1 ATOM 4829 O O . LYS 294 294 ? A -19.595 -20.136 23.151 1.000 1 A 97.200 1 ATOM 4830 C CB . LYS 294 294 ? A -21.258 -18.028 25.225 1.000 1 A 97.200 1 ATOM 4831 C CG . LYS 294 294 ? A -20.937 -19.219 26.129 1.000 1 A 97.200 1 ATOM 4832 C CD . LYS 294 294 ? A -21.805 -19.148 27.377 1.000 1 A 97.200 1 ATOM 4833 C CE . LYS 294 294 ? A -21.618 -20.429 28.180 1.000 1 A 97.200 1 ATOM 4834 N NZ . LYS 294 294 ? A -22.321 -20.294 29.469 1.000 1 A 97.200 1 ATOM 4835 H H . LYS 294 294 ? A -21.625 -16.387 23.389 1.000 1 A 97.200 1 ATOM 4836 H HA . LYS 294 294 ? A -19.367 -17.948 24.219 1.000 1 A 97.200 1 ATOM 4837 H HB2 . LYS 294 294 ? A -22.316 -18.053 24.964 1.000 1 A 97.200 1 ATOM 4838 H HB3 . LYS 294 294 ? A -21.058 -17.104 25.767 1.000 1 A 97.200 1 ATOM 4839 H HG2 . LYS 294 294 ? A -19.885 -19.194 26.412 1.000 1 A 97.200 1 ATOM 4840 H HG3 . LYS 294 294 ? A -21.151 -20.154 25.610 1.000 1 A 97.200 1 ATOM 4841 H HD2 . LYS 294 294 ? A -21.511 -18.280 27.967 1.000 1 A 97.200 1 ATOM 4842 H HD3 . LYS 294 294 ? A -22.853 -19.048 27.093 1.000 1 A 97.200 1 ATOM 4843 H HE2 . LYS 294 294 ? A -20.553 -20.601 28.339 1.000 1 A 97.200 1 ATOM 4844 H HE3 . LYS 294 294 ? A -22.001 -21.269 27.601 1.000 1 A 97.200 1 ATOM 4845 H HZ1 . LYS 294 294 ? A -21.826 -19.602 30.014 1.000 1 A 97.200 1 ATOM 4846 H HZ2 . LYS 294 294 ? A -23.264 -19.969 29.311 1.000 1 A 97.200 1 ATOM 4847 H HZ3 . LYS 294 294 ? A -22.323 -21.175 29.963 1.000 1 A 97.200 1 ATOM 4848 N N . ALA 295 295 ? A -21.707 -19.620 22.568 1.000 1 A 97.340 1 ATOM 4849 C CA . ALA 295 295 ? A -21.933 -20.832 21.780 1.000 1 A 97.340 1 ATOM 4850 C C . ALA 295 295 ? A -20.892 -20.977 20.654 1.000 1 A 97.340 1 ATOM 4851 O O . ALA 295 295 ? A -20.347 -22.060 20.423 1.000 1 A 97.340 1 ATOM 4852 C CB . ALA 295 295 ? A -23.359 -20.777 21.220 1.000 1 A 97.340 1 ATOM 4853 H H . ALA 295 295 ? A -22.468 -18.965 22.674 1.000 1 A 97.340 1 ATOM 4854 H HA . ALA 295 295 ? A -21.845 -21.699 22.435 1.000 1 A 97.340 1 ATOM 4855 H HB1 . ALA 295 295 ? A -23.480 -19.903 20.581 1.000 1 A 97.340 1 ATOM 4856 H HB2 . ALA 295 295 ? A -23.563 -21.680 20.644 1.000 1 A 97.340 1 ATOM 4857 H HB3 . ALA 295 295 ? A -24.072 -20.714 22.042 1.000 1 A 97.340 1 ATOM 4858 N N . LEU 296 296 ? A -20.547 -19.869 19.989 1.000 1 A 97.650 1 ATOM 4859 C CA . LEU 296 296 ? A -19.497 -19.840 18.973 1.000 1 A 97.650 1 ATOM 4860 C C . LEU 296 296 ? A -18.101 -20.121 19.555 1.000 1 A 97.650 1 ATOM 4861 O O . LEU 296 296 ? A -17.314 -20.847 18.942 1.000 1 A 97.650 1 ATOM 4862 C CB . LEU 296 296 ? A -19.562 -18.474 18.280 1.000 1 A 97.650 1 ATOM 4863 C CG . LEU 296 296 ? A -18.491 -18.267 17.202 1.000 1 A 97.650 1 ATOM 4864 C CD1 . LEU 296 296 ? A -18.596 -19.268 16.045 1.000 1 A 97.650 1 ATOM 4865 C CD2 . LEU 296 296 ? A -18.642 -16.861 16.637 1.000 1 A 97.650 1 ATOM 4866 H H . LEU 296 296 ? A -21.054 -19.019 20.186 1.000 1 A 97.650 1 ATOM 4867 H HA . LEU 296 296 ? A -19.713 -20.622 18.244 1.000 1 A 97.650 1 ATOM 4868 H HB2 . LEU 296 296 ? A -20.548 -18.356 17.831 1.000 1 A 97.650 1 ATOM 4869 H HB3 . LEU 296 296 ? A -19.447 -17.695 19.034 1.000 1 A 97.650 1 ATOM 4870 H HG . LEU 296 296 ? A -17.497 -18.344 17.642 1.000 1 A 97.650 1 ATOM 4871 H HD11 . LEU 296 296 ? A -18.397 -20.276 16.411 1.000 1 A 97.650 1 ATOM 4872 H HD12 . LEU 296 296 ? A -17.860 -19.021 15.280 1.000 1 A 97.650 1 ATOM 4873 H HD13 . LEU 296 296 ? A -19.600 -19.245 15.623 1.000 1 A 97.650 1 ATOM 4874 H HD21 . LEU 296 296 ? A -17.801 -16.659 15.974 1.000 1 A 97.650 1 ATOM 4875 H HD22 . LEU 296 296 ? A -19.591 -16.763 16.109 1.000 1 A 97.650 1 ATOM 4876 H HD23 . LEU 296 296 ? A -18.620 -16.136 17.450 1.000 1 A 97.650 1 ATOM 4877 N N . ALA 297 297 ? A -17.783 -19.568 20.727 1.000 1 A 97.320 1 ATOM 4878 C CA . ALA 297 297 ? A -16.525 -19.831 21.417 1.000 1 A 97.320 1 ATOM 4879 C C . ALA 297 297 ? A -16.394 -21.314 21.798 1.000 1 A 97.320 1 ATOM 4880 O O . ALA 297 297 ? A -15.347 -21.919 21.566 1.000 1 A 97.320 1 ATOM 4881 C CB . ALA 297 297 ? A -16.429 -18.919 22.645 1.000 1 A 97.320 1 ATOM 4882 H H . ALA 297 297 ? A -18.454 -18.961 21.176 1.000 1 A 97.320 1 ATOM 4883 H HA . ALA 297 297 ? A -15.701 -19.590 20.746 1.000 1 A 97.320 1 ATOM 4884 H HB1 . ALA 297 297 ? A -15.482 -19.092 23.158 1.000 1 A 97.320 1 ATOM 4885 H HB2 . ALA 297 297 ? A -16.488 -17.876 22.335 1.000 1 A 97.320 1 ATOM 4886 H HB3 . ALA 297 297 ? A -17.244 -19.125 23.339 1.000 1 A 97.320 1 ATOM 4887 N N . GLU 298 298 ? A -17.462 -21.928 22.308 1.000 1 A 97.240 1 ATOM 4888 C CA . GLU 298 298 ? A -17.512 -23.357 22.639 1.000 1 A 97.240 1 ATOM 4889 C C . GLU 298 298 ? A -17.344 -24.234 21.398 1.000 1 A 97.240 1 ATOM 4890 O O . GLU 298 298 ? A -16.512 -25.141 21.398 1.000 1 A 97.240 1 ATOM 4891 C CB . GLU 298 298 ? A -18.833 -23.678 23.347 1.000 1 A 97.240 1 ATOM 4892 C CG . GLU 298 298 ? A -18.833 -23.088 24.762 1.000 1 A 97.240 1 ATOM 4893 C CD . GLU 298 298 ? A -20.171 -23.223 25.492 1.000 1 A 97.240 1 ATOM 4894 O OE1 . GLU 298 298 ? A -20.219 -22.681 26.622 1.000 1 A 97.240 1 ATOM 4895 O OE2 . GLU 298 298 ? A -21.105 -23.849 24.947 1.000 1 A 97.240 1 ATOM 4896 H H . GLU 298 298 ? A -18.286 -21.374 22.495 1.000 1 A 97.240 1 ATOM 4897 H HA . GLU 298 298 ? A -16.692 -23.601 23.315 1.000 1 A 97.240 1 ATOM 4898 H HB2 . GLU 298 298 ? A -19.662 -23.269 22.770 1.000 1 A 97.240 1 ATOM 4899 H HB3 . GLU 298 298 ? A -18.948 -24.759 23.417 1.000 1 A 97.240 1 ATOM 4900 H HG2 . GLU 298 298 ? A -18.578 -22.030 24.712 1.000 1 A 97.240 1 ATOM 4901 H HG3 . GLU 298 298 ? A -18.055 -23.583 25.342 1.000 1 A 97.240 1 ATOM 4902 N N . GLN 299 299 ? A -18.031 -23.906 20.298 1.000 1 A 97.250 1 ATOM 4903 C CA . GLN 299 299 ? A -17.872 -24.596 19.013 1.000 1 A 97.250 1 ATOM 4904 C C . GLN 299 299 ? A -16.415 -24.577 18.516 1.000 1 A 97.250 1 ATOM 4905 O O . GLN 299 299 ? A -15.955 -25.517 17.865 1.000 1 A 97.250 1 ATOM 4906 C CB . GLN 299 299 ? A -18.798 -23.926 17.984 1.000 1 A 97.250 1 ATOM 4907 C CG . GLN 299 299 ? A -18.844 -24.698 16.656 1.000 1 A 97.250 1 ATOM 4908 C CD . GLN 299 299 ? A -19.606 -23.974 15.554 1.000 1 A 97.250 1 ATOM 4909 O OE1 . GLN 299 299 ? A -20.014 -22.831 15.647 1.000 1 A 97.250 1 ATOM 4910 N NE2 . GLN 299 299 ? A -19.781 -24.603 14.412 1.000 1 A 97.250 1 ATOM 4911 H H . GLN 299 299 ? A -18.726 -23.176 20.373 1.000 1 A 97.250 1 ATOM 4912 H HA . GLN 299 299 ? A -18.174 -25.635 19.140 1.000 1 A 97.250 1 ATOM 4913 H HB2 . GLN 299 299 ? A -18.449 -22.909 17.799 1.000 1 A 97.250 1 ATOM 4914 H HB3 . GLN 299 299 ? A -19.809 -23.875 18.387 1.000 1 A 97.250 1 ATOM 4915 H HG2 . GLN 299 299 ? A -17.835 -24.869 16.282 1.000 1 A 97.250 1 ATOM 4916 H HG3 . GLN 299 299 ? A -19.311 -25.667 16.830 1.000 1 A 97.250 1 ATOM 4917 H HE21 . GLN 299 299 ? A -19.513 -25.572 14.320 1.000 1 A 97.250 1 ATOM 4918 H HE22 . GLN 299 299 ? A -20.362 -24.118 13.743 1.000 1 A 97.250 1 ATOM 4919 N N . ARG 300 300 ? A -15.677 -23.500 18.806 1.000 1 A 95.360 1 ATOM 4920 C CA . ARG 300 300 ? A -14.267 -23.318 18.429 1.000 1 A 95.360 1 ATOM 4921 C C . ARG 300 300 ? A -13.277 -23.826 19.486 1.000 1 A 95.360 1 ATOM 4922 O O . ARG 300 300 ? A -12.073 -23.743 19.254 1.000 1 A 95.360 1 ATOM 4923 C CB . ARG 300 300 ? A -14.034 -21.835 18.089 1.000 1 A 95.360 1 ATOM 4924 C CG . ARG 300 300 ? A -14.778 -21.357 16.829 1.000 1 A 95.360 1 ATOM 4925 C CD . ARG 300 300 ? A -14.109 -21.858 15.542 1.000 1 A 95.360 1 ATOM 4926 N NE . ARG 300 300 ? A -14.866 -21.434 14.345 1.000 1 A 95.360 1 ATOM 4927 C CZ . ARG 300 300 ? A -14.369 -21.108 13.164 1.000 1 A 95.360 1 ATOM 4928 N NH1 . ARG 300 300 ? A -13.087 -21.098 12.931 1.000 1 A 95.360 1 ATOM 4929 N NH2 . ARG 300 300 ? A -15.161 -20.773 12.183 1.000 1 A 95.360 1 ATOM 4930 H H . ARG 300 300 ? A -16.133 -22.764 19.327 1.000 1 A 95.360 1 ATOM 4931 H HA . ARG 300 300 ? A -14.059 -23.923 17.547 1.000 1 A 95.360 1 ATOM 4932 H HB2 . ARG 300 300 ? A -14.359 -21.229 18.934 1.000 1 A 95.360 1 ATOM 4933 H HB3 . ARG 300 300 ? A -12.968 -21.658 17.948 1.000 1 A 95.360 1 ATOM 4934 H HG2 . ARG 300 300 ? A -15.815 -21.689 16.855 1.000 1 A 95.360 1 ATOM 4935 H HG3 . ARG 300 300 ? A -14.770 -20.267 16.824 1.000 1 A 95.360 1 ATOM 4936 H HD2 . ARG 300 300 ? A -13.092 -21.469 15.519 1.000 1 A 95.360 1 ATOM 4937 H HD3 . ARG 300 300 ? A -14.067 -22.947 15.562 1.000 1 A 95.360 1 ATOM 4938 H HE . ARG 300 300 ? A -15.868 -21.388 14.459 1.000 1 A 95.360 1 ATOM 4939 H HH11 . ARG 300 300 ? A -12.470 -21.262 13.714 1.000 1 A 95.360 1 ATOM 4940 H HH12 . ARG 300 300 ? A -12.727 -20.721 12.066 1.000 1 A 95.360 1 ATOM 4941 H HH21 . ARG 300 300 ? A -14.778 -20.489 11.293 1.000 1 A 95.360 1 ATOM 4942 H HH22 . ARG 300 300 ? A -16.161 -20.776 12.323 1.000 1 A 95.360 1 ATOM 4943 N N . ASN 301 301 ? A -13.756 -24.382 20.604 1.000 1 A 96.130 1 ATOM 4944 C CA . ASN 301 301 ? A -12.965 -24.774 21.780 1.000 1 A 96.130 1 ATOM 4945 C C . ASN 301 301 ? A -12.169 -23.613 22.414 1.000 1 A 96.130 1 ATOM 4946 O O . ASN 301 301 ? A -11.096 -23.806 22.986 1.000 1 A 96.130 1 ATOM 4947 C CB . ASN 301 301 ? A -12.105 -26.015 21.481 1.000 1 A 96.130 1 ATOM 4948 C CG . ASN 301 301 ? A -12.922 -27.193 20.994 1.000 1 A 96.130 1 ATOM 4949 O OD1 . ASN 301 301 ? A -13.767 -27.726 21.686 1.000 1 A 96.130 1 ATOM 4950 N ND2 . ASN 301 301 ? A -12.693 -27.646 19.784 1.000 1 A 96.130 1 ATOM 4951 H H . ASN 301 301 ? A -14.759 -24.467 20.688 1.000 1 A 96.130 1 ATOM 4952 H HA . ASN 301 301 ? A -13.687 -25.073 22.541 1.000 1 A 96.130 1 ATOM 4953 H HB2 . ASN 301 301 ? A -11.336 -25.763 20.750 1.000 1 A 96.130 1 ATOM 4954 H HB3 . ASN 301 301 ? A -11.604 -26.329 22.397 1.000 1 A 96.130 1 ATOM 4955 H HD21 . ASN 301 301 ? A -13.327 -28.370 19.474 1.000 1 A 96.130 1 ATOM 4956 H HD22 . ASN 301 301 ? A -12.056 -27.152 19.176 1.000 1 A 96.130 1 ATOM 4957 N N . TYR 302 302 ? A -12.685 -22.387 22.328 1.000 1 A 96.890 1 ATOM 4958 C CA . TYR 302 302 ? A -12.117 -21.196 22.959 1.000 1 A 96.890 1 ATOM 4959 C C . TYR 302 302 ? A -12.635 -21.052 24.394 1.000 1 A 96.890 1 ATOM 4960 O O . TYR 302 302 ? A -13.378 -20.128 24.720 1.000 1 A 96.890 1 ATOM 4961 C CB . TYR 302 302 ? A -12.381 -19.962 22.082 1.000 1 A 96.890 1 ATOM 4962 C CG . TYR 302 302 ? A -11.791 -19.985 20.680 1.000 1 A 96.890 1 ATOM 4963 C CD1 . TYR 302 302 ? A -10.700 -20.820 20.350 1.000 1 A 96.890 1 ATOM 4964 C CD2 . TYR 302 302 ? A -12.319 -19.119 19.699 1.000 1 A 96.890 1 ATOM 4965 C CE1 . TYR 302 302 ? A -10.151 -20.798 19.057 1.000 1 A 96.890 1 ATOM 4966 C CE2 . TYR 302 302 ? A -11.767 -19.091 18.404 1.000 1 A 96.890 1 ATOM 4967 C CZ . TYR 302 302 ? A -10.685 -19.934 18.081 1.000 1 A 96.890 1 ATOM 4968 O OH . TYR 302 302 ? A -10.160 -19.935 16.828 1.000 1 A 96.890 1 ATOM 4969 H H . TYR 302 302 ? A -13.582 -22.285 21.874 1.000 1 A 96.890 1 ATOM 4970 H HA . TYR 302 302 ? A -11.037 -21.314 23.046 1.000 1 A 96.890 1 ATOM 4971 H HB2 . TYR 302 302 ? A -13.459 -19.823 21.997 1.000 1 A 96.890 1 ATOM 4972 H HB3 . TYR 302 302 ? A -11.976 -19.090 22.595 1.000 1 A 96.890 1 ATOM 4973 H HD1 . TYR 302 302 ? A -10.277 -21.499 21.076 1.000 1 A 96.890 1 ATOM 4974 H HD2 . TYR 302 302 ? A -13.140 -18.460 19.941 1.000 1 A 96.890 1 ATOM 4975 H HE1 . TYR 302 302 ? A -9.329 -21.456 18.816 1.000 1 A 96.890 1 ATOM 4976 H HE2 . TYR 302 302 ? A -12.157 -18.418 17.655 1.000 1 A 96.890 1 ATOM 4977 H HH . TYR 302 302 ? A -9.366 -20.473 16.801 1.000 1 A 96.890 1 ATOM 4978 N N . TYR 303 303 ? A -12.230 -21.980 25.267 1.000 1 A 94.100 1 ATOM 4979 C CA . TYR 303 303 ? A -12.726 -22.067 26.648 1.000 1 A 94.100 1 ATOM 4980 C C . TYR 303 303 ? A -12.527 -20.781 27.458 1.000 1 A 94.100 1 ATOM 4981 O O . TYR 303 303 ? A -13.397 -20.425 28.245 1.000 1 A 94.100 1 ATOM 4982 C CB . TYR 303 303 ? A -12.039 -23.233 27.370 1.000 1 A 94.100 1 ATOM 4983 C CG . TYR 303 303 ? A -12.256 -24.580 26.713 1.000 1 A 94.100 1 ATOM 4984 C CD1 . TYR 303 303 ? A -13.549 -25.139 26.675 1.000 1 A 94.100 1 ATOM 4985 C CD2 . TYR 303 303 ? A -11.175 -25.262 26.123 1.000 1 A 94.100 1 ATOM 4986 C CE1 . TYR 303 303 ? A -13.764 -26.377 26.039 1.000 1 A 94.100 1 ATOM 4987 C CE2 . TYR 303 303 ? A -11.385 -26.508 25.503 1.000 1 A 94.100 1 ATOM 4988 C CZ . TYR 303 303 ? A -12.679 -27.064 25.454 1.000 1 A 94.100 1 ATOM 4989 O OH . TYR 303 303 ? A -12.869 -28.249 24.821 1.000 1 A 94.100 1 ATOM 4990 H H . TYR 303 303 ? A -11.684 -22.752 24.910 1.000 1 A 94.100 1 ATOM 4991 H HA . TYR 303 303 ? A -13.798 -22.263 26.618 1.000 1 A 94.100 1 ATOM 4992 H HB2 . TYR 303 303 ? A -12.426 -23.286 28.387 1.000 1 A 94.100 1 ATOM 4993 H HB3 . TYR 303 303 ? A -10.970 -23.029 27.438 1.000 1 A 94.100 1 ATOM 4994 H HD1 . TYR 303 303 ? A -14.380 -24.616 27.122 1.000 1 A 94.100 1 ATOM 4995 H HD2 . TYR 303 303 ? A -10.184 -24.832 26.137 1.000 1 A 94.100 1 ATOM 4996 H HE1 . TYR 303 303 ? A -14.758 -26.797 25.996 1.000 1 A 94.100 1 ATOM 4997 H HE2 . TYR 303 303 ? A -10.567 -27.038 25.039 1.000 1 A 94.100 1 ATOM 4998 H HH . TYR 303 303 ? A -13.799 -28.431 24.671 1.000 1 A 94.100 1 ATOM 4999 N N . LEU 304 304 ? A -11.420 -20.061 27.239 1.000 1 A 94.090 1 ATOM 5000 C CA . LEU 304 304 ? A -11.161 -18.785 27.911 1.000 1 A 94.090 1 ATOM 5001 C C . LEU 304 304 ? A -12.227 -17.734 27.558 1.000 1 A 94.090 1 ATOM 5002 O O . LEU 304 304 ? A -12.752 -17.076 28.449 1.000 1 A 94.090 1 ATOM 5003 C CB . LEU 304 304 ? A -9.739 -18.312 27.552 1.000 1 A 94.090 1 ATOM 5004 C CG . LEU 304 304 ? A -9.307 -17.018 28.268 1.000 1 A 94.090 1 ATOM 5005 C CD1 . LEU 304 304 ? A -9.242 -17.195 29.786 1.000 1 A 94.090 1 ATOM 5006 C CD2 . LEU 304 304 ? A -7.925 -16.594 27.771 1.000 1 A 94.090 1 ATOM 5007 H H . LEU 304 304 ? A -10.742 -20.408 26.576 1.000 1 A 94.090 1 ATOM 5008 H HA . LEU 304 304 ? A -11.221 -18.952 28.987 1.000 1 A 94.090 1 ATOM 5009 H HB2 . LEU 304 304 ? A -9.689 -18.144 26.476 1.000 1 A 94.090 1 ATOM 5010 H HB3 . LEU 304 304 ? A -9.031 -19.101 27.804 1.000 1 A 94.090 1 ATOM 5011 H HG . LEU 304 304 ? A -10.006 -16.218 28.025 1.000 1 A 94.090 1 ATOM 5012 H HD11 . LEU 304 304 ? A -8.597 -18.032 30.052 1.000 1 A 94.090 1 ATOM 5013 H HD12 . LEU 304 304 ? A -8.859 -16.281 30.241 1.000 1 A 94.090 1 ATOM 5014 H HD13 . LEU 304 304 ? A -10.244 -17.352 30.186 1.000 1 A 94.090 1 ATOM 5015 H HD21 . LEU 304 304 ? A -7.639 -15.662 28.258 1.000 1 A 94.090 1 ATOM 5016 H HD22 . LEU 304 304 ? A -7.963 -16.422 26.695 1.000 1 A 94.090 1 ATOM 5017 H HD23 . LEU 304 304 ? A -7.188 -17.365 27.999 1.000 1 A 94.090 1 ATOM 5018 N N . ILE 305 305 ? A -12.591 -17.625 26.275 1.000 1 A 95.430 1 ATOM 5019 C CA . ILE 305 305 ? A -13.637 -16.705 25.805 1.000 1 A 95.430 1 ATOM 5020 C C . ILE 305 305 ? A -14.997 -17.107 26.378 1.000 1 A 95.430 1 ATOM 5021 O O . ILE 305 305 ? A -15.686 -16.262 26.939 1.000 1 A 95.430 1 ATOM 5022 C CB . ILE 305 305 ? A -13.674 -16.641 24.258 1.000 1 A 95.430 1 ATOM 5023 C CG1 . ILE 305 305 ? A -12.375 -16.010 23.729 1.000 1 A 95.430 1 ATOM 5024 C CG2 . ILE 305 305 ? A -14.877 -15.812 23.776 1.000 1 A 95.430 1 ATOM 5025 C CD1 . ILE 305 305 ? A -12.236 -15.920 22.204 1.000 1 A 95.430 1 ATOM 5026 H H . ILE 305 305 ? A -12.190 -18.265 25.606 1.000 1 A 95.430 1 ATOM 5027 H HA . ILE 305 305 ? A -13.421 -15.705 26.182 1.000 1 A 95.430 1 ATOM 5028 H HB . ILE 305 305 ? A -13.763 -17.650 23.856 1.000 1 A 95.430 1 ATOM 5029 H HG12 . ILE 305 305 ? A -11.515 -16.560 24.110 1.000 1 A 95.430 1 ATOM 5030 H HG13 . ILE 305 305 ? A -12.356 -14.994 24.123 1.000 1 A 95.430 1 ATOM 5031 H HG21 . ILE 305 305 ? A -14.900 -15.763 22.687 1.000 1 A 95.430 1 ATOM 5032 H HG22 . ILE 305 305 ? A -14.829 -14.803 24.185 1.000 1 A 95.430 1 ATOM 5033 H HG23 . ILE 305 305 ? A -15.813 -16.275 24.089 1.000 1 A 95.430 1 ATOM 5034 H HD11 . ILE 305 305 ? A -12.926 -15.178 21.801 1.000 1 A 95.430 1 ATOM 5035 H HD12 . ILE 305 305 ? A -12.433 -16.891 21.750 1.000 1 A 95.430 1 ATOM 5036 H HD13 . ILE 305 305 ? A -11.221 -15.610 21.956 1.000 1 A 95.430 1 ATOM 5037 N N . SER 306 306 ? A -15.371 -18.390 26.281 1.000 1 A 95.310 1 ATOM 5038 C CA . SER 306 306 ? A -16.650 -18.883 26.826 1.000 1 A 95.310 1 ATOM 5039 C C . SER 306 306 ? A -16.765 -18.621 28.334 1.000 1 A 95.310 1 ATOM 5040 O O . SER 306 306 ? A -17.819 -18.191 28.812 1.000 1 A 95.310 1 ATOM 5041 C CB . SER 306 306 ? A -16.833 -20.377 26.512 1.000 1 A 95.310 1 ATOM 5042 O OG . SER 306 306 ? A -17.875 -20.931 27.296 1.000 1 A 95.310 1 ATOM 5043 H H . SER 306 306 ? A -14.750 -19.039 25.819 1.000 1 A 95.310 1 ATOM 5044 H HA . SER 306 306 ? A -17.467 -18.341 26.349 1.000 1 A 95.310 1 ATOM 5045 H HB2 . SER 306 306 ? A -17.060 -20.493 25.452 1.000 1 A 95.310 1 ATOM 5046 H HB3 . SER 306 306 ? A -15.909 -20.910 26.736 1.000 1 A 95.310 1 ATOM 5047 H HG . SER 306 306 ? A -18.492 -21.461 26.786 1.000 1 A 95.310 1 ATOM 5048 N N . HIS 307 307 ? A -15.669 -18.806 29.079 1.000 1 A 94.160 1 ATOM 5049 C CA . HIS 307 307 ? A -15.626 -18.500 30.505 1.000 1 A 94.160 1 ATOM 5050 C C . HIS 307 307 ? A -15.870 -17.014 30.772 1.000 1 A 94.160 1 ATOM 5051 O O . HIS 307 307 ? A -16.773 -16.697 31.540 1.000 1 A 94.160 1 ATOM 5052 C CB . HIS 307 307 ? A -14.293 -18.955 31.106 1.000 1 A 94.160 1 ATOM 5053 C CG . HIS 307 307 ? A -14.230 -18.703 32.590 1.000 1 A 94.160 1 ATOM 5054 N ND1 . HIS 307 307 ? A -14.837 -19.464 33.562 1.000 1 A 94.160 1 ATOM 5055 C CD2 . HIS 307 307 ? A -13.630 -17.645 33.222 1.000 1 A 94.160 1 ATOM 5056 C CE1 . HIS 307 307 ? A -14.602 -18.885 34.750 1.000 1 A 94.160 1 ATOM 5057 N NE2 . HIS 307 307 ? A -13.853 -17.785 34.595 1.000 1 A 94.160 1 ATOM 5058 H H . HIS 307 307 ? A -14.838 -19.180 28.645 1.000 1 A 94.160 1 ATOM 5059 H HA . HIS 307 307 ? A -16.429 -19.049 30.996 1.000 1 A 94.160 1 ATOM 5060 H HB2 . HIS 307 307 ? A -13.470 -18.428 30.622 1.000 1 A 94.160 1 ATOM 5061 H HB3 . HIS 307 307 ? A -14.166 -20.022 30.927 1.000 1 A 94.160 1 ATOM 5062 H HD1 . HIS 307 307 ? A -15.439 -20.259 33.403 1.000 1 A 94.160 1 ATOM 5063 H HD2 . HIS 307 307 ? A -13.096 -16.837 32.743 1.000 1 A 94.160 1 ATOM 5064 H HE1 . HIS 307 307 ? A -14.982 -19.232 35.700 1.000 1 A 94.160 1 ATOM 5065 N N . HIS 308 308 ? A -15.125 -16.118 30.112 1.000 1 A 93.290 1 ATOM 5066 C CA . HIS 308 308 ? A -15.321 -14.676 30.268 1.000 1 A 93.290 1 ATOM 5067 C C . HIS 308 308 ? A -16.752 -14.263 29.928 1.000 1 A 93.290 1 ATOM 5068 O O . HIS 308 308 ? A -17.403 -13.631 30.744 1.000 1 A 93.290 1 ATOM 5069 C CB . HIS 308 308 ? A -14.305 -13.898 29.422 1.000 1 A 93.290 1 ATOM 5070 C CG . HIS 308 308 ? A -12.940 -13.856 30.053 1.000 1 A 93.290 1 ATOM 5071 N ND1 . HIS 308 308 ? A -12.628 -13.262 31.253 1.000 1 A 93.290 1 ATOM 5072 C CD2 . HIS 308 308 ? A -11.777 -14.355 29.539 1.000 1 A 93.290 1 ATOM 5073 C CE1 . HIS 308 308 ? A -11.309 -13.406 31.458 1.000 1 A 93.290 1 ATOM 5074 N NE2 . HIS 308 308 ? A -10.742 -14.073 30.438 1.000 1 A 93.290 1 ATOM 5075 H H . HIS 308 308 ? A -14.406 -16.441 29.480 1.000 1 A 93.290 1 ATOM 5076 H HA . HIS 308 308 ? A -15.170 -14.413 31.316 1.000 1 A 93.290 1 ATOM 5077 H HB2 . HIS 308 308 ? A -14.243 -14.331 28.423 1.000 1 A 93.290 1 ATOM 5078 H HB3 . HIS 308 308 ? A -14.650 -12.869 29.320 1.000 1 A 93.290 1 ATOM 5079 H HD1 . HIS 308 308 ? A -13.268 -12.759 31.852 1.000 1 A 93.290 1 ATOM 5080 H HD2 . HIS 308 308 ? A -11.677 -14.856 28.587 1.000 1 A 93.290 1 ATOM 5081 H HE1 . HIS 308 308 ? A -10.775 -13.018 32.313 1.000 1 A 93.290 1 ATOM 5082 N N . LEU 309 309 ? A -17.294 -14.704 28.791 1.000 1 A 94.520 1 ATOM 5083 C CA . LEU 309 309 ? A -18.660 -14.372 28.368 1.000 1 A 94.520 1 ATOM 5084 C C . LEU 309 309 ? A -19.761 -14.928 29.285 1.000 1 A 94.520 1 ATOM 5085 O O . LEU 309 309 ? A -20.897 -14.484 29.192 1.000 1 A 94.520 1 ATOM 5086 C CB . LEU 309 309 ? A -18.872 -14.881 26.934 1.000 1 A 94.520 1 ATOM 5087 C CG . LEU 309 309 ? A -18.028 -14.164 25.867 1.000 1 A 94.520 1 ATOM 5088 C CD1 . LEU 309 309 ? A -18.286 -14.838 24.522 1.000 1 A 94.520 1 ATOM 5089 C CD2 . LEU 309 309 ? A -18.384 -12.684 25.743 1.000 1 A 94.520 1 ATOM 5090 H H . LEU 309 309 ? A -16.724 -15.266 28.174 1.000 1 A 94.520 1 ATOM 5091 H HA . LEU 309 309 ? A -18.782 -13.289 28.391 1.000 1 A 94.520 1 ATOM 5092 H HB2 . LEU 309 309 ? A -18.651 -15.948 26.910 1.000 1 A 94.520 1 ATOM 5093 H HB3 . LEU 309 309 ? A -19.923 -14.758 26.674 1.000 1 A 94.520 1 ATOM 5094 H HG . LEU 309 309 ? A -16.966 -14.244 26.098 1.000 1 A 94.520 1 ATOM 5095 H HD11 . LEU 309 309 ? A -17.688 -14.362 23.745 1.000 1 A 94.520 1 ATOM 5096 H HD12 . LEU 309 309 ? A -18.028 -15.895 24.585 1.000 1 A 94.520 1 ATOM 5097 H HD13 . LEU 309 309 ? A -19.346 -14.751 24.281 1.000 1 A 94.520 1 ATOM 5098 H HD21 . LEU 309 309 ? A -19.459 -12.575 25.601 1.000 1 A 94.520 1 ATOM 5099 H HD22 . LEU 309 309 ? A -18.087 -12.149 26.645 1.000 1 A 94.520 1 ATOM 5100 H HD23 . LEU 309 309 ? A -17.859 -12.241 24.896 1.000 1 A 94.520 1 ATOM 5101 N N . SER 310 310 ? A -19.445 -15.886 30.162 1.000 1 A 93.460 1 ATOM 5102 C CA . SER 310 310 ? A -20.387 -16.401 31.165 1.000 1 A 93.460 1 ATOM 5103 C C . SER 310 310 ? A -20.439 -15.547 32.437 1.000 1 A 93.460 1 ATOM 5104 O O . SER 310 310 ? A -21.254 -15.822 33.318 1.000 1 A 93.460 1 ATOM 5105 C CB . SER 310 310 ? A -20.028 -17.841 31.541 1.000 1 A 93.460 1 ATOM 5106 O OG . SER 310 310 ? A -20.052 -18.694 30.406 1.000 1 A 93.460 1 ATOM 5107 H H . SER 310 310 ? A -18.480 -16.179 30.216 1.000 1 A 93.460 1 ATOM 5108 H HA . SER 310 310 ? A -21.392 -16.399 30.744 1.000 1 A 93.460 1 ATOM 5109 H HB2 . SER 310 310 ? A -20.749 -18.206 32.272 1.000 1 A 93.460 1 ATOM 5110 H HB3 . SER 310 310 ? A -19.036 -17.864 31.993 1.000 1 A 93.460 1 ATOM 5111 H HG . SER 310 310 ? A -19.328 -18.422 29.838 1.000 1 A 93.460 1 ATOM 5112 N N . LEU 311 311 ? A -19.553 -14.557 32.573 1.000 1 A 90.090 1 ATOM 5113 C CA . LEU 311 311 ? A -19.536 -13.643 33.707 1.000 1 A 90.090 1 ATOM 5114 C C . LEU 311 311 ? A -20.580 -12.544 33.474 1.000 1 A 90.090 1 ATOM 5115 O O . LEU 311 311 ? A -20.390 -11.657 32.646 1.000 1 A 90.090 1 ATOM 5116 C CB . LEU 311 311 ? A -18.117 -13.072 33.910 1.000 1 A 90.090 1 ATOM 5117 C CG . LEU 311 311 ? A -16.996 -14.111 34.090 1.000 1 A 90.090 1 ATOM 5118 C CD1 . LEU 311 311 ? A -15.637 -13.415 34.173 1.000 1 A 90.090 1 ATOM 5119 C CD2 . LEU 311 311 ? A -17.181 -14.951 35.357 1.000 1 A 90.090 1 ATOM 5120 H H . LEU 311 311 ? A -18.929 -14.347 31.807 1.000 1 A 90.090 1 ATOM 5121 H HA . LEU 311 311 ? A -19.818 -14.185 34.610 1.000 1 A 90.090 1 ATOM 5122 H HB2 . LEU 311 311 ? A -17.871 -12.443 33.054 1.000 1 A 90.090 1 ATOM 5123 H HB3 . LEU 311 311 ? A -18.135 -12.434 34.794 1.000 1 A 90.090 1 ATOM 5124 H HG . LEU 311 311 ? A -16.974 -14.781 33.230 1.000 1 A 90.090 1 ATOM 5125 H HD11 . LEU 311 311 ? A -15.610 -12.742 35.030 1.000 1 A 90.090 1 ATOM 5126 H HD12 . LEU 311 311 ? A -15.480 -12.834 33.264 1.000 1 A 90.090 1 ATOM 5127 H HD13 . LEU 311 311 ? A -14.845 -14.159 34.265 1.000 1 A 90.090 1 ATOM 5128 H HD21 . LEU 311 311 ? A -17.223 -14.300 36.230 1.000 1 A 90.090 1 ATOM 5129 H HD22 . LEU 311 311 ? A -18.103 -15.528 35.281 1.000 1 A 90.090 1 ATOM 5130 H HD23 . LEU 311 311 ? A -16.345 -15.644 35.456 1.000 1 A 90.090 1 ATOM 5131 N N . ASP 312 312 ? A -21.675 -12.581 34.230 1.000 1 A 84.200 1 ATOM 5132 C CA . ASP 312 312 ? A -22.730 -11.556 34.212 1.000 1 A 84.200 1 ATOM 5133 C C . ASP 312 312 ? A -22.301 -10.301 35.002 1.000 1 A 84.200 1 ATOM 5134 O O . ASP 312 312 ? A -22.870 -9.946 36.034 1.000 1 A 84.200 1 ATOM 5135 C CB . ASP 312 312 ? A -24.048 -12.181 34.701 1.000 1 A 84.200 1 ATOM 5136 C CG . ASP 312 312 ? A -25.269 -11.280 34.472 1.000 1 A 84.200 1 ATOM 5137 O OD1 . ASP 312 312 ? A -25.198 -10.405 33.580 1.000 1 A 84.200 1 ATOM 5138 O OD2 . ASP 312 312 ? A -26.284 -11.512 35.170 1.000 1 A 84.200 1 ATOM 5139 H H . ASP 312 312 ? A -21.827 -13.391 34.815 1.000 1 A 84.200 1 ATOM 5140 H HA . ASP 312 312 ? A -22.886 -11.246 33.179 1.000 1 A 84.200 1 ATOM 5141 H HB2 . ASP 312 312 ? A -23.962 -12.423 35.761 1.000 1 A 84.200 1 ATOM 5142 H HB3 . ASP 312 312 ? A -24.214 -13.112 34.160 1.000 1 A 84.200 1 ATOM 5143 N N . ILE 313 313 ? A -21.188 -9.690 34.581 1.000 1 A 90.160 1 ATOM 5144 C CA . ILE 313 313 ? A -20.549 -8.548 35.263 1.000 1 A 90.160 1 ATOM 5145 C C . ILE 313 313 ? A -20.289 -7.357 34.333 1.000 1 A 90.160 1 ATOM 5146 O O . ILE 313 313 ? A -19.850 -6.296 34.785 1.000 1 A 90.160 1 ATOM 5147 C CB . ILE 313 313 ? A -19.250 -8.979 35.985 1.000 1 A 90.160 1 ATOM 5148 C CG1 . ILE 313 313 ? A -18.146 -9.395 34.984 1.000 1 A 90.160 1 ATOM 5149 C CG2 . ILE 313 313 ? A -19.550 -10.075 37.025 1.000 1 A 90.160 1 ATOM 5150 C CD1 . ILE 313 313 ? A -16.816 -9.788 35.639 1.000 1 A 90.160 1 ATOM 5151 H H . ILE 313 313 ? A -20.732 -10.099 33.778 1.000 1 A 90.160 1 ATOM 5152 H HA . ILE 313 313 ? A -21.234 -8.174 36.024 1.000 1 A 90.160 1 ATOM 5153 H HB . ILE 313 313 ? A -18.881 -8.113 36.536 1.000 1 A 90.160 1 ATOM 5154 H HG12 . ILE 313 313 ? A -18.498 -10.221 34.366 1.000 1 A 90.160 1 ATOM 5155 H HG13 . ILE 313 313 ? A -17.937 -8.556 34.320 1.000 1 A 90.160 1 ATOM 5156 H HG21 . ILE 313 313 ? A -19.779 -11.015 36.523 1.000 1 A 90.160 1 ATOM 5157 H HG22 . ILE 313 313 ? A -20.408 -9.781 37.630 1.000 1 A 90.160 1 ATOM 5158 H HG23 . ILE 313 313 ? A -18.691 -10.216 37.681 1.000 1 A 90.160 1 ATOM 5159 H HD11 . ILE 313 313 ? A -16.068 -9.951 34.863 1.000 1 A 90.160 1 ATOM 5160 H HD12 . ILE 313 313 ? A -16.929 -10.708 36.212 1.000 1 A 90.160 1 ATOM 5161 H HD13 . ILE 313 313 ? A -16.473 -8.988 36.296 1.000 1 A 90.160 1 ATOM 5162 N N . TYR 314 314 ? A -20.532 -7.517 33.033 1.000 1 A 91.530 1 ATOM 5163 C CA . TYR 314 314 ? A -20.183 -6.513 32.037 1.000 1 A 91.530 1 ATOM 5164 C C . TYR 314 314 ? A -21.292 -5.487 31.827 1.000 1 A 91.530 1 ATOM 5165 O O . TYR 314 314 ? A -22.481 -5.781 31.886 1.000 1 A 91.530 1 ATOM 5166 C CB . TYR 314 314 ? A -19.769 -7.175 30.728 1.000 1 A 91.530 1 ATOM 5167 C CG . TYR 314 314 ? A -18.637 -8.173 30.869 1.000 1 A 91.530 1 ATOM 5168 C CD1 . TYR 314 314 ? A -17.416 -7.785 31.454 1.000 1 A 91.530 1 ATOM 5169 C CD2 . TYR 314 314 ? A -18.820 -9.504 30.457 1.000 1 A 91.530 1 ATOM 5170 C CE1 . TYR 314 314 ? A -16.394 -8.730 31.649 1.000 1 A 91.530 1 ATOM 5171 C CE2 . TYR 314 314 ? A -17.774 -10.431 30.593 1.000 1 A 91.530 1 ATOM 5172 C CZ . TYR 314 314 ? A -16.561 -10.055 31.206 1.000 1 A 91.530 1 ATOM 5173 O OH . TYR 314 314 ? A -15.538 -10.932 31.386 1.000 1 A 91.530 1 ATOM 5174 H H . TYR 314 314 ? A -20.953 -8.380 32.719 1.000 1 A 91.530 1 ATOM 5175 H HA . TYR 314 314 ? A -19.312 -5.970 32.403 1.000 1 A 91.530 1 ATOM 5176 H HB2 . TYR 314 314 ? A -20.638 -7.661 30.284 1.000 1 A 91.530 1 ATOM 5177 H HB3 . TYR 314 314 ? A -19.442 -6.378 30.060 1.000 1 A 91.530 1 ATOM 5178 H HD1 . TYR 314 314 ? A -17.270 -6.771 31.794 1.000 1 A 91.530 1 ATOM 5179 H HD2 . TYR 314 314 ? A -19.772 -9.827 30.063 1.000 1 A 91.530 1 ATOM 5180 H HE1 . TYR 314 314 ? A -15.485 -8.449 32.161 1.000 1 A 91.530 1 ATOM 5181 H HE2 . TYR 314 314 ? A -17.928 -11.448 30.261 1.000 1 A 91.530 1 ATOM 5182 H HH . TYR 314 314 ? A -14.857 -10.490 31.898 1.000 1 A 91.530 1 ATOM 5183 N N . SER 315 315 ? A -20.894 -4.244 31.567 1.000 1 A 89.610 1 ATOM 5184 C CA . SER 315 315 ? A -21.819 -3.154 31.259 1.000 1 A 89.610 1 ATOM 5185 C C . SER 315 315 ? A -21.158 -2.144 30.334 1.000 1 A 89.610 1 ATOM 5186 O O . SER 315 315 ? A -19.985 -1.808 30.523 1.000 1 A 89.610 1 ATOM 5187 C CB . SER 315 315 ? A -22.301 -2.459 32.542 1.000 1 A 89.610 1 ATOM 5188 O OG . SER 315 315 ? A -21.211 -2.019 33.342 1.000 1 A 89.610 1 ATOM 5189 H H . SER 315 315 ? A -19.906 -4.073 31.439 1.000 1 A 89.610 1 ATOM 5190 H HA . SER 315 315 ? A -22.689 -3.565 30.747 1.000 1 A 89.610 1 ATOM 5191 H HB2 . SER 315 315 ? A -22.902 -3.161 33.119 1.000 1 A 89.610 1 ATOM 5192 H HB3 . SER 315 315 ? A -22.927 -1.607 32.277 1.000 1 A 89.610 1 ATOM 5193 H HG . SER 315 315 ? A -20.838 -2.825 33.707 1.000 1 A 89.610 1 ATOM 5194 N N . ALA 316 316 ? A -21.937 -1.598 29.399 1.000 1 A 92.320 1 ATOM 5195 C CA . ALA 316 316 ? A -21.468 -0.594 28.451 1.000 1 A 92.320 1 ATOM 5196 C C . ALA 316 316 ? A -20.783 0.600 29.146 1.000 1 A 92.320 1 ATOM 5197 O O . ALA 316 316 ? A -21.128 1.004 30.266 1.000 1 A 92.320 1 ATOM 5198 C CB . ALA 316 316 ? A -22.650 -0.134 27.589 1.000 1 A 92.320 1 ATOM 5199 H H . ALA 316 316 ? A -22.870 -1.962 29.269 1.000 1 A 92.320 1 ATOM 5200 H HA . ALA 316 316 ? A -20.738 -1.068 27.795 1.000 1 A 92.320 1 ATOM 5201 H HB1 . ALA 316 316 ? A -22.290 0.533 26.805 1.000 1 A 92.320 1 ATOM 5202 H HB2 . ALA 316 316 ? A -23.126 -0.996 27.123 1.000 1 A 92.320 1 ATOM 5203 H HB3 . ALA 316 316 ? A -23.380 0.393 28.204 1.000 1 A 92.320 1 ATOM 5204 N N . ASP 317 317 ? A -19.804 1.184 28.469 1.000 1 A 92.270 1 ATOM 5205 C CA . ASP 317 317 ? A -19.161 2.425 28.866 1.000 1 A 92.270 1 ATOM 5206 C C . ASP 317 317 ? A -19.893 3.607 28.220 1.000 1 A 92.270 1 ATOM 5207 O O . ASP 317 317 ? A -19.703 3.941 27.050 1.000 1 A 92.270 1 ATOM 5208 C CB . ASP 317 317 ? A -17.670 2.378 28.516 1.000 1 A 92.270 1 ATOM 5209 C CG . ASP 317 317 ? A -16.910 3.586 29.067 1.000 1 A 92.270 1 ATOM 5210 O OD1 . ASP 317 317 ? A -17.546 4.610 29.431 1.000 1 A 92.270 1 ATOM 5211 O OD2 . ASP 317 317 ? A -15.669 3.501 29.131 1.000 1 A 92.270 1 ATOM 5212 H H . ASP 317 317 ? A -19.577 0.827 27.552 1.000 1 A 92.270 1 ATOM 5213 H HA . ASP 317 317 ? A -19.226 2.536 29.948 1.000 1 A 92.270 1 ATOM 5214 H HB2 . ASP 317 317 ? A -17.238 1.472 28.941 1.000 1 A 92.270 1 ATOM 5215 H HB3 . ASP 317 317 ? A -17.546 2.338 27.434 1.000 1 A 92.270 1 ATOM 5216 N N . SER 318 318 ? A -20.728 4.287 29.008 1.000 1 A 89.570 1 ATOM 5217 C CA . SER 318 318 ? A -21.501 5.441 28.542 1.000 1 A 89.570 1 ATOM 5218 C C . SER 318 318 ? A -20.637 6.577 27.980 1.000 1 A 89.570 1 ATOM 5219 O O . SER 318 318 ? A -21.140 7.388 27.204 1.000 1 A 89.570 1 ATOM 5220 C CB . SER 318 318 ? A -22.374 5.976 29.681 1.000 1 A 89.570 1 ATOM 5221 O OG . SER 318 318 ? A -21.598 6.298 30.824 1.000 1 A 89.570 1 ATOM 5222 H H . SER 318 318 ? A -20.858 3.972 29.959 1.000 1 A 89.570 1 ATOM 5223 H HA . SER 318 318 ? A -22.155 5.109 27.736 1.000 1 A 89.570 1 ATOM 5224 H HB2 . SER 318 318 ? A -22.910 6.862 29.341 1.000 1 A 89.570 1 ATOM 5225 H HB3 . SER 318 318 ? A -23.106 5.215 29.955 1.000 1 A 89.570 1 ATOM 5226 H HG . SER 318 318 ? A -20.826 6.799 30.552 1.000 1 A 89.570 1 ATOM 5227 N N . SER 319 319 ? A -19.349 6.661 28.345 1.000 1 A 90.360 1 ATOM 5228 C CA . SER 319 319 ? A -18.444 7.685 27.805 1.000 1 A 90.360 1 ATOM 5229 C C . SER 319 319 ? A -18.183 7.503 26.305 1.000 1 A 90.360 1 ATOM 5230 O O . SER 319 319 ? A -18.008 8.492 25.585 1.000 1 A 90.360 1 ATOM 5231 C CB . SER 319 319 ? A -17.126 7.713 28.587 1.000 1 A 90.360 1 ATOM 5232 O OG . SER 319 319 ? A -16.297 6.615 28.281 1.000 1 A 90.360 1 ATOM 5233 H H . SER 319 319 ? A -18.937 5.898 28.864 1.000 1 A 90.360 1 ATOM 5234 H HA . SER 319 319 ? A -18.919 8.658 27.931 1.000 1 A 90.360 1 ATOM 5235 H HB2 . SER 319 319 ? A -17.331 7.731 29.657 1.000 1 A 90.360 1 ATOM 5236 H HB3 . SER 319 319 ? A -16.593 8.626 28.323 1.000 1 A 90.360 1 ATOM 5237 H HG . SER 319 319 ? A -16.618 5.833 28.737 1.000 1 A 90.360 1 ATOM 5238 N N . LEU 320 320 ? A -18.257 6.264 25.809 1.000 1 A 91.070 1 ATOM 5239 C CA . LEU 320 320 ? A -18.100 5.930 24.396 1.000 1 A 91.070 1 ATOM 5240 C C . LEU 320 320 ? A -19.328 6.297 23.554 1.000 1 A 91.070 1 ATOM 5241 O O . LEU 320 320 ? A -19.212 6.400 22.340 1.000 1 A 91.070 1 ATOM 5242 C CB . LEU 320 320 ? A -17.778 4.433 24.255 1.000 1 A 91.070 1 ATOM 5243 C CG . LEU 320 320 ? A -16.442 3.977 24.869 1.000 1 A 91.070 1 ATOM 5244 C CD1 . LEU 320 320 ? A -16.274 2.480 24.623 1.000 1 A 91.070 1 ATOM 5245 C CD2 . LEU 320 320 ? A -15.250 4.703 24.237 1.000 1 A 91.070 1 ATOM 5246 H H . LEU 320 320 ? A -18.439 5.502 26.447 1.000 1 A 91.070 1 ATOM 5247 H HA . LEU 320 320 ? A -17.267 6.505 23.991 1.000 1 A 91.070 1 ATOM 5248 H HB2 . LEU 320 320 ? A -18.587 3.852 24.699 1.000 1 A 91.070 1 ATOM 5249 H HB3 . LEU 320 320 ? A -17.754 4.191 23.193 1.000 1 A 91.070 1 ATOM 5250 H HG . LEU 320 320 ? A -16.445 4.160 25.944 1.000 1 A 91.070 1 ATOM 5251 H HD11 . LEU 320 320 ? A -15.370 2.121 25.115 1.000 1 A 91.070 1 ATOM 5252 H HD12 . LEU 320 320 ? A -16.196 2.267 23.557 1.000 1 A 91.070 1 ATOM 5253 H HD13 . LEU 320 320 ? A -17.126 1.939 25.034 1.000 1 A 91.070 1 ATOM 5254 H HD21 . LEU 320 320 ? A -15.243 5.747 24.551 1.000 1 A 91.070 1 ATOM 5255 H HD22 . LEU 320 320 ? A -15.312 4.639 23.150 1.000 1 A 91.070 1 ATOM 5256 H HD23 . LEU 320 320 ? A -14.323 4.239 24.573 1.000 1 A 91.070 1 ATOM 5257 N N . LEU 321 321 ? A -20.489 6.558 24.158 1.000 1 A 88.020 1 ATOM 5258 C CA . LEU 321 321 ? A -21.724 6.910 23.438 1.000 1 A 88.020 1 ATOM 5259 C C . LEU 321 321 ? A -21.919 8.430 23.277 1.000 1 A 88.020 1 ATOM 5260 O O . LEU 321 321 ? A -22.989 8.902 22.893 1.000 1 A 88.020 1 ATOM 5261 C CB . LEU 321 321 ? A -22.920 6.223 24.121 1.000 1 A 88.020 1 ATOM 5262 C CG . LEU 321 321 ? A -22.814 4.687 24.213 1.000 1 A 88.020 1 ATOM 5263 C CD1 . LEU 321 321 ? A -24.061 4.145 24.912 1.000 1 A 88.020 1 ATOM 5264 C CD2 . LEU 321 321 ? A -22.694 4.020 22.841 1.000 1 A 88.020 1 ATOM 5265 H H . LEU 321 321 ? A -20.532 6.455 25.161 1.000 1 A 88.020 1 ATOM 5266 H HA . LEU 321 321 ? A -21.661 6.523 22.421 1.000 1 A 88.020 1 ATOM 5267 H HB2 . LEU 321 321 ? A -23.024 6.628 25.127 1.000 1 A 88.020 1 ATOM 5268 H HB3 . LEU 321 321 ? A -23.825 6.471 23.565 1.000 1 A 88.020 1 ATOM 5269 H HG . LEU 321 321 ? A -21.947 4.417 24.815 1.000 1 A 88.020 1 ATOM 5270 H HD11 . LEU 321 321 ? A -24.952 4.377 24.329 1.000 1 A 88.020 1 ATOM 5271 H HD12 . LEU 321 321 ? A -24.148 4.581 25.908 1.000 1 A 88.020 1 ATOM 5272 H HD13 . LEU 321 321 ? A -23.975 3.063 25.012 1.000 1 A 88.020 1 ATOM 5273 H HD21 . LEU 321 321 ? A -21.750 4.293 22.370 1.000 1 A 88.020 1 ATOM 5274 H HD22 . LEU 321 321 ? A -22.698 2.937 22.960 1.000 1 A 88.020 1 ATOM 5275 H HD23 . LEU 321 321 ? A -23.526 4.312 22.200 1.000 1 A 88.020 1 ATOM 5276 N N . THR 322 322 ? A -20.891 9.219 23.598 1.000 1 A 87.020 1 ATOM 5277 C CA . THR 322 322 ? A -20.957 10.688 23.593 1.000 1 A 87.020 1 ATOM 5278 C C . THR 322 322 ? A -20.828 11.303 22.198 1.000 1 A 87.020 1 ATOM 5279 O O . THR 322 322 ? A -21.389 12.372 21.945 1.000 1 A 87.020 1 ATOM 5280 C CB . THR 322 322 ? A -19.883 11.283 24.512 1.000 1 A 87.020 1 ATOM 5281 O OG1 . THR 322 322 ? A -18.596 10.820 24.165 1.000 1 A 87.020 1 ATOM 5282 C CG2 . THR 322 322 ? A -20.136 10.952 25.983 1.000 1 A 87.020 1 ATOM 5283 H H . THR 322 322 ? A -20.042 8.774 23.915 1.000 1 A 87.020 1 ATOM 5284 H HA . THR 322 322 ? A -21.931 10.993 23.977 1.000 1 A 87.020 1 ATOM 5285 H HB . THR 322 322 ? A -19.897 12.368 24.403 1.000 1 A 87.020 1 ATOM 5286 H HG1 . THR 322 322 ? A -18.397 10.037 24.684 1.000 1 A 87.020 1 ATOM 5287 H HG21 . THR 322 322 ? A -21.073 11.409 26.302 1.000 1 A 87.020 1 ATOM 5288 H HG22 . THR 322 322 ? A -20.208 9.874 26.129 1.000 1 A 87.020 1 ATOM 5289 H HG23 . THR 322 322 ? A -19.322 11.345 26.592 1.000 1 A 87.020 1 ATOM 5290 N N . LEU 323 323 ? A -20.111 10.646 21.282 1.000 1 A 88.700 1 ATOM 5291 C CA . LEU 323 323 ? A -19.950 11.102 19.901 1.000 1 A 88.700 1 ATOM 5292 C C . LEU 323 323 ? A -21.104 10.602 19.026 1.000 1 A 88.700 1 ATOM 5293 O O . LEU 323 323 ? A -21.528 9.458 19.129 1.000 1 A 88.700 1 ATOM 5294 C CB . LEU 323 323 ? A -18.580 10.670 19.344 1.000 1 A 88.700 1 ATOM 5295 C CG . LEU 323 323 ? A -17.365 11.296 20.055 1.000 1 A 88.700 1 ATOM 5296 C CD1 . LEU 323 323 ? A -16.070 10.761 19.441 1.000 1 A 88.700 1 ATOM 5297 C CD2 . LEU 323 323 ? A -17.341 12.824 19.923 1.000 1 A 88.700 1 ATOM 5298 H H . LEU 323 323 ? A -19.729 9.745 21.533 1.000 1 A 88.700 1 ATOM 5299 H HA . LEU 323 323 ? A -19.995 12.191 19.890 1.000 1 A 88.700 1 ATOM 5300 H HB2 . LEU 323 323 ? A -18.510 9.585 19.410 1.000 1 A 88.700 1 ATOM 5301 H HB3 . LEU 323 323 ? A -18.536 10.933 18.287 1.000 1 A 88.700 1 ATOM 5302 H HG . LEU 323 323 ? A -17.380 11.034 21.113 1.000 1 A 88.700 1 ATOM 5303 H HD11 . LEU 323 323 ? A -15.209 11.192 19.950 1.000 1 A 88.700 1 ATOM 5304 H HD12 . LEU 323 323 ? A -16.038 9.680 19.575 1.000 1 A 88.700 1 ATOM 5305 H HD13 . LEU 323 323 ? A -16.030 10.991 18.376 1.000 1 A 88.700 1 ATOM 5306 H HD21 . LEU 323 323 ? A -18.181 13.253 20.469 1.000 1 A 88.700 1 ATOM 5307 H HD22 . LEU 323 323 ? A -16.423 13.209 20.365 1.000 1 A 88.700 1 ATOM 5308 H HD23 . LEU 323 323 ? A -17.394 13.106 18.871 1.000 1 A 88.700 1 ATOM 5309 N N . LYS 324 324 ? A -21.595 11.476 18.139 1.000 1 A 87.690 1 ATOM 5310 C CA . LYS 324 324 ? A -22.695 11.181 17.198 1.000 1 A 87.690 1 ATOM 5311 C C . LYS 324 324 ? A -22.280 11.220 15.729 1.000 1 A 87.690 1 ATOM 5312 O O . LYS 324 324 ? A -23.115 11.038 14.853 1.000 1 A 87.690 1 ATOM 5313 C CB . LYS 324 324 ? A -23.868 12.142 17.438 1.000 1 A 87.690 1 ATOM 5314 C CG . LYS 324 324 ? A -24.492 11.969 18.825 1.000 1 A 87.690 1 ATOM 5315 C CD . LYS 324 324 ? A -25.773 12.803 18.922 1.000 1 A 87.690 1 ATOM 5316 C CE . LYS 324 324 ? A -26.414 12.572 20.290 1.000 1 A 87.690 1 ATOM 5317 N NZ . LYS 324 324 ? A -27.719 13.266 20.400 1.000 1 A 87.690 1 ATOM 5318 H H . LYS 324 324 ? A -21.199 12.405 18.133 1.000 1 A 87.690 1 ATOM 5319 H HA . LYS 324 324 ? A -23.046 10.162 17.362 1.000 1 A 87.690 1 ATOM 5320 H HB2 . LYS 324 324 ? A -24.638 11.941 16.692 1.000 1 A 87.690 1 ATOM 5321 H HB3 . LYS 324 324 ? A -23.530 13.170 17.310 1.000 1 A 87.690 1 ATOM 5322 H HG2 . LYS 324 324 ? A -24.735 10.918 18.980 1.000 1 A 87.690 1 ATOM 5323 H HG3 . LYS 324 324 ? A -23.788 12.289 19.593 1.000 1 A 87.690 1 ATOM 5324 H HD2 . LYS 324 324 ? A -25.530 13.857 18.793 1.000 1 A 87.690 1 ATOM 5325 H HD3 . LYS 324 324 ? A -26.460 12.489 18.136 1.000 1 A 87.690 1 ATOM 5326 H HE2 . LYS 324 324 ? A -25.725 12.917 21.061 1.000 1 A 87.690 1 ATOM 5327 H HE3 . LYS 324 324 ? A -26.546 11.499 20.429 1.000 1 A 87.690 1 ATOM 5328 H HZ1 . LYS 324 324 ? A -27.600 14.262 20.280 1.000 1 A 87.690 1 ATOM 5329 H HZ2 . LYS 324 324 ? A -28.350 12.919 19.692 1.000 1 A 87.690 1 ATOM 5330 H HZ3 . LYS 324 324 ? A -28.127 13.087 21.306 1.000 1 A 87.690 1 ATOM 5331 N N . GLU 325 325 ? A -21.017 11.518 15.455 1.000 1 A 89.570 1 ATOM 5332 C CA . GLU 325 325 ? A -20.501 11.678 14.100 1.000 1 A 89.570 1 ATOM 5333 C C . GLU 325 325 ? A -19.135 11.015 13.968 1.000 1 A 89.570 1 ATOM 5334 O O . GLU 325 325 ? A -18.326 11.036 14.900 1.000 1 A 89.570 1 ATOM 5335 C CB . GLU 325 325 ? A -20.449 13.164 13.706 1.000 1 A 89.570 1 ATOM 5336 C CG . GLU 325 325 ? A -19.422 13.971 14.517 1.000 1 A 89.570 1 ATOM 5337 C CD . GLU 325 325 ? A -19.433 15.469 14.205 1.000 1 A 89.570 1 ATOM 5338 O OE1 . GLU 325 325 ? A -18.653 16.174 14.884 1.000 1 A 89.570 1 ATOM 5339 O OE2 . GLU 325 325 ? A -20.228 15.938 13.368 1.000 1 A 89.570 1 ATOM 5340 H H . GLU 325 325 ? A -20.347 11.543 16.211 1.000 1 A 89.570 1 ATOM 5341 H HA . GLU 325 325 ? A -21.175 11.179 13.404 1.000 1 A 89.570 1 ATOM 5342 H HB2 . GLU 325 325 ? A -21.441 13.592 13.849 1.000 1 A 89.570 1 ATOM 5343 H HB3 . GLU 325 325 ? A -20.195 13.232 12.649 1.000 1 A 89.570 1 ATOM 5344 H HG2 . GLU 325 325 ? A -18.422 13.592 14.310 1.000 1 A 89.570 1 ATOM 5345 H HG3 . GLU 325 325 ? A -19.621 13.838 15.580 1.000 1 A 89.570 1 ATOM 5346 N N . ALA 326 326 ? A -18.869 10.467 12.785 1.000 1 A 91.540 1 ATOM 5347 C CA . ALA 326 326 ? A -17.638 9.760 12.460 1.000 1 A 91.540 1 ATOM 5348 C C . ALA 326 326 ? A -16.474 10.723 12.118 1.000 1 A 91.540 1 ATOM 5349 O O . ALA 326 326 ? A -15.848 10.616 11.060 1.000 1 A 91.540 1 ATOM 5350 C CB . ALA 326 326 ? A -17.967 8.718 11.383 1.000 1 A 91.540 1 ATOM 5351 H H . ALA 326 326 ? A -19.585 10.487 12.073 1.000 1 A 91.540 1 ATOM 5352 H HA . ALA 326 326 ? A -17.334 9.208 13.350 1.000 1 A 91.540 1 ATOM 5353 H HB1 . ALA 326 326 ? A -18.819 8.113 11.693 1.000 1 A 91.540 1 ATOM 5354 H HB2 . ALA 326 326 ? A -17.118 8.049 11.245 1.000 1 A 91.540 1 ATOM 5355 H HB3 . ALA 326 326 ? A -18.200 9.208 10.437 1.000 1 A 91.540 1 ATOM 5356 N N . ASP 327 327 ? A -16.189 11.690 13.001 1.000 1 A 94.650 1 ATOM 5357 C CA . ASP 327 327 ? A -15.051 12.613 12.864 1.000 1 A 94.650 1 ATOM 5358 C C . ASP 327 327 ? A -13.751 11.944 13.360 1.000 1 A 94.650 1 ATOM 5359 O O . ASP 327 327 ? A -13.635 11.614 14.548 1.000 1 A 94.650 1 ATOM 5360 C CB . ASP 327 327 ? A -15.313 13.942 13.595 1.000 1 A 94.650 1 ATOM 5361 C CG . ASP 327 327 ? A -14.161 14.962 13.463 1.000 1 A 94.650 1 ATOM 5362 O OD1 . ASP 327 327 ? A -12.980 14.596 13.683 1.000 1 A 94.650 1 ATOM 5363 O OD2 . ASP 327 327 ? A -14.442 16.148 13.198 1.000 1 A 94.650 1 ATOM 5364 H H . ASP 327 327 ? A -16.740 11.723 13.846 1.000 1 A 94.650 1 ATOM 5365 H HA . ASP 327 327 ? A -14.962 12.863 11.807 1.000 1 A 94.650 1 ATOM 5366 H HB2 . ASP 327 327 ? A -16.225 14.383 13.193 1.000 1 A 94.650 1 ATOM 5367 H HB3 . ASP 327 327 ? A -15.482 13.737 14.652 1.000 1 A 94.650 1 ATOM 5368 N N . PRO 328 328 ? A -12.731 11.778 12.496 1.000 1 A 96.150 1 ATOM 5369 C CA . PRO 328 328 ? A -11.522 11.045 12.850 1.000 1 A 96.150 1 ATOM 5370 C C . PRO 328 328 ? A -10.692 11.719 13.957 1.000 1 A 96.150 1 ATOM 5371 O O . PRO 328 328 ? A -10.052 11.026 14.746 1.000 1 A 96.150 1 ATOM 5372 C CB . PRO 328 328 ? A -10.745 10.911 11.536 1.000 1 A 96.150 1 ATOM 5373 C CG . PRO 328 328 ? A -11.197 12.119 10.718 1.000 1 A 96.150 1 ATOM 5374 C CD . PRO 328 328 ? A -12.659 12.261 11.124 1.000 1 A 96.150 1 ATOM 5375 H HA . PRO 328 328 ? A -11.808 10.052 13.196 1.000 1 A 96.150 1 ATOM 5376 H HB2 . PRO 328 328 ? A -11.061 10.002 11.024 1.000 1 A 96.150 1 ATOM 5377 H HB3 . PRO 328 328 ? A -9.666 10.899 11.692 1.000 1 A 96.150 1 ATOM 5378 H HG2 . PRO 328 328 ? A -10.641 13.004 11.028 1.000 1 A 96.150 1 ATOM 5379 H HG3 . PRO 328 328 ? A -11.089 11.949 9.647 1.000 1 A 96.150 1 ATOM 5380 H HD2 . PRO 328 328 ? A -13.287 11.637 10.488 1.000 1 A 96.150 1 ATOM 5381 H HD3 . PRO 328 328 ? A -12.964 13.305 11.051 1.000 1 A 96.150 1 ATOM 5382 N N . ASN 329 329 ? A -10.705 13.050 14.075 1.000 1 A 96.510 1 ATOM 5383 C CA . ASN 329 329 ? A -9.989 13.737 15.152 1.000 1 A 96.510 1 ATOM 5384 C C . ASN 329 329 ? A -10.679 13.500 16.495 1.000 1 A 96.510 1 ATOM 5385 O O . ASN 329 329 ? A -10.011 13.192 17.482 1.000 1 A 96.510 1 ATOM 5386 C CB . ASN 329 329 ? A -9.889 15.242 14.870 1.000 1 A 96.510 1 ATOM 5387 C CG . ASN 329 329 ? A -9.068 15.551 13.641 1.000 1 A 96.510 1 ATOM 5388 O OD1 . ASN 329 329 ? A -7.876 15.297 13.577 1.000 1 A 96.510 1 ATOM 5389 N ND2 . ASN 329 329 ? A -9.685 16.102 12.624 1.000 1 A 96.510 1 ATOM 5390 H H . ASN 329 329 ? A -11.401 13.570 13.559 1.000 1 A 96.510 1 ATOM 5391 H HA . ASN 329 329 ? A -8.980 13.331 15.228 1.000 1 A 96.510 1 ATOM 5392 H HB2 . ASN 329 329 ? A -9.405 15.731 15.715 1.000 1 A 96.510 1 ATOM 5393 H HB3 . ASN 329 329 ? A -10.888 15.666 14.764 1.000 1 A 96.510 1 ATOM 5394 H HD21 . ASN 329 329 ? A -10.686 16.233 12.672 1.000 1 A 96.510 1 ATOM 5395 H HD22 . ASN 329 329 ? A -9.135 16.318 11.805 1.000 1 A 96.510 1 ATOM 5396 N N . LYS 330 330 ? A -12.013 13.613 16.536 1.000 1 A 95.860 1 ATOM 5397 C CA . LYS 330 330 ? A -12.787 13.408 17.771 1.000 1 A 95.860 1 ATOM 5398 C C . LYS 330 330 ? A -12.659 11.975 18.275 1.000 1 A 95.860 1 ATOM 5399 O O . LYS 330 330 ? A -12.377 11.774 19.454 1.000 1 A 95.860 1 ATOM 5400 C CB . LYS 330 330 ? A -14.259 13.780 17.558 1.000 1 A 95.860 1 ATOM 5401 C CG . LYS 330 330 ? A -14.424 15.275 17.261 1.000 1 A 95.860 1 ATOM 5402 C CD . LYS 330 330 ? A -15.902 15.664 17.167 1.000 1 A 95.860 1 ATOM 5403 C CE . LYS 330 330 ? A -15.995 17.152 16.825 1.000 1 A 95.860 1 ATOM 5404 N NZ . LYS 330 330 ? A -17.400 17.589 16.701 1.000 1 A 95.860 1 ATOM 5405 H H . LYS 330 330 ? A -12.495 13.824 15.674 1.000 1 A 95.860 1 ATOM 5406 H HA . LYS 330 330 ? A -12.377 14.041 18.559 1.000 1 A 95.860 1 ATOM 5407 H HB2 . LYS 330 330 ? A -14.809 13.541 18.468 1.000 1 A 95.860 1 ATOM 5408 H HB3 . LYS 330 330 ? A -14.674 13.189 16.742 1.000 1 A 95.860 1 ATOM 5409 H HG2 . LYS 330 330 ? A -13.955 15.852 18.058 1.000 1 A 95.860 1 ATOM 5410 H HG3 . LYS 330 330 ? A -13.933 15.516 16.318 1.000 1 A 95.860 1 ATOM 5411 H HD2 . LYS 330 330 ? A -16.387 15.081 16.383 1.000 1 A 95.860 1 ATOM 5412 H HD3 . LYS 330 330 ? A -16.395 15.465 18.119 1.000 1 A 95.860 1 ATOM 5413 H HE2 . LYS 330 330 ? A -15.487 17.308 15.873 1.000 1 A 95.860 1 ATOM 5414 H HE3 . LYS 330 330 ? A -15.479 17.730 17.593 1.000 1 A 95.860 1 ATOM 5415 H HZ1 . LYS 330 330 ? A -17.952 17.385 17.522 1.000 1 A 95.860 1 ATOM 5416 H HZ2 . LYS 330 330 ? A -17.483 18.556 16.421 1.000 1 A 95.860 1 ATOM 5417 H HZ3 . LYS 330 330 ? A -17.825 17.067 15.948 1.000 1 A 95.860 1 ATOM 5418 N N . ILE 331 331 ? A -12.773 11.000 17.372 1.000 1 A 96.220 1 ATOM 5419 C CA . ILE 331 331 ? A -12.575 9.577 17.681 1.000 1 A 96.220 1 ATOM 5420 C C . ILE 331 331 ? A -11.162 9.334 18.219 1.000 1 A 96.220 1 ATOM 5421 O O . ILE 331 331 ? A -10.999 8.713 19.268 1.000 1 A 96.220 1 ATOM 5422 C CB . ILE 331 331 ? A -12.834 8.723 16.424 1.000 1 A 96.220 1 ATOM 5423 C CG1 . ILE 331 331 ? A -14.311 8.813 15.991 1.000 1 A 96.220 1 ATOM 5424 C CG2 . ILE 331 331 ? A -12.412 7.257 16.659 1.000 1 A 96.220 1 ATOM 5425 C CD1 . ILE 331 331 ? A -14.547 8.249 14.588 1.000 1 A 96.220 1 ATOM 5426 H H . ILE 331 331 ? A -13.034 11.255 16.430 1.000 1 A 96.220 1 ATOM 5427 H HA . ILE 331 331 ? A -13.279 9.277 18.457 1.000 1 A 96.220 1 ATOM 5428 H HB . ILE 331 331 ? A -12.228 9.133 15.616 1.000 1 A 96.220 1 ATOM 5429 H HG12 . ILE 331 331 ? A -14.647 9.850 15.991 1.000 1 A 96.220 1 ATOM 5430 H HG13 . ILE 331 331 ? A -14.939 8.282 16.707 1.000 1 A 96.220 1 ATOM 5431 H HG21 . ILE 331 331 ? A -12.670 6.627 15.807 1.000 1 A 96.220 1 ATOM 5432 H HG22 . ILE 331 331 ? A -11.333 7.179 16.795 1.000 1 A 96.220 1 ATOM 5433 H HG23 . ILE 331 331 ? A -12.903 6.870 17.551 1.000 1 A 96.220 1 ATOM 5434 H HD11 . ILE 331 331 ? A -15.573 8.460 14.285 1.000 1 A 96.220 1 ATOM 5435 H HD12 . ILE 331 331 ? A -14.401 7.169 14.572 1.000 1 A 96.220 1 ATOM 5436 H HD13 . ILE 331 331 ? A -13.872 8.728 13.880 1.000 1 A 96.220 1 ATOM 5437 N N . TYR 332 332 ? A -10.133 9.850 17.534 1.000 1 A 95.900 1 ATOM 5438 C CA . TYR 332 332 ? A -8.750 9.686 17.978 1.000 1 A 95.900 1 ATOM 5439 C C . TYR 332 332 ? A -8.535 10.266 19.379 1.000 1 A 95.900 1 ATOM 5440 O O . TYR 332 332 ? A -7.935 9.610 20.225 1.000 1 A 95.900 1 ATOM 5441 C CB . TYR 332 332 ? A -7.789 10.322 16.965 1.000 1 A 95.900 1 ATOM 5442 C CG . TYR 332 332 ? A -6.331 10.175 17.357 1.000 1 A 95.900 1 ATOM 5443 C CD1 . TYR 332 332 ? A -5.663 11.230 18.007 1.000 1 A 95.900 1 ATOM 5444 C CD2 . TYR 332 332 ? A -5.659 8.962 17.110 1.000 1 A 95.900 1 ATOM 5445 C CE1 . TYR 332 332 ? A -4.323 11.073 18.410 1.000 1 A 95.900 1 ATOM 5446 C CE2 . TYR 332 332 ? A -4.321 8.797 17.519 1.000 1 A 95.900 1 ATOM 5447 C CZ . TYR 332 332 ? A -3.655 9.853 18.179 1.000 1 A 95.900 1 ATOM 5448 O OH . TYR 332 332 ? A -2.374 9.690 18.608 1.000 1 A 95.900 1 ATOM 5449 H H . TYR 332 332 ? A -10.310 10.339 16.668 1.000 1 A 95.900 1 ATOM 5450 H HA . TYR 332 332 ? A -8.530 8.620 18.036 1.000 1 A 95.900 1 ATOM 5451 H HB2 . TYR 332 332 ? A -7.937 9.850 15.994 1.000 1 A 95.900 1 ATOM 5452 H HB3 . TYR 332 332 ? A -8.027 11.380 16.854 1.000 1 A 95.900 1 ATOM 5453 H HD1 . TYR 332 332 ? A -6.185 12.157 18.196 1.000 1 A 95.900 1 ATOM 5454 H HD2 . TYR 332 332 ? A -6.184 8.147 16.634 1.000 1 A 95.900 1 ATOM 5455 H HE1 . TYR 332 332 ? A -3.805 11.888 18.893 1.000 1 A 95.900 1 ATOM 5456 H HE2 . TYR 332 332 ? A -3.823 7.854 17.350 1.000 1 A 95.900 1 ATOM 5457 H HH . TYR 332 332 ? A -2.067 8.806 18.396 1.000 1 A 95.900 1 ATOM 5458 N N . HIS 333 333 ? A -9.047 11.468 19.655 1.000 1 A 94.510 1 ATOM 5459 C CA . HIS 333 333 ? A -8.926 12.092 20.973 1.000 1 A 94.510 1 ATOM 5460 C C . HIS 333 333 ? A -9.644 11.315 22.078 1.000 1 A 94.510 1 ATOM 5461 O O . HIS 333 333 ? A -9.080 11.186 23.164 1.000 1 A 94.510 1 ATOM 5462 C CB . HIS 333 333 ? A -9.426 13.540 20.909 1.000 1 A 94.510 1 ATOM 5463 C CG . HIS 333 333 ? A -8.387 14.470 20.343 1.000 1 A 94.510 1 ATOM 5464 N ND1 . HIS 333 333 ? A -7.163 14.732 20.913 1.000 1 A 94.510 1 ATOM 5465 C CD2 . HIS 333 333 ? A -8.474 15.226 19.206 1.000 1 A 94.510 1 ATOM 5466 C CE1 . HIS 333 333 ? A -6.525 15.620 20.134 1.000 1 A 94.510 1 ATOM 5467 N NE2 . HIS 333 333 ? A -7.280 15.945 19.077 1.000 1 A 94.510 1 ATOM 5468 H H . HIS 333 333 ? A -9.542 11.964 18.928 1.000 1 A 94.510 1 ATOM 5469 H HA . HIS 333 333 ? A -7.873 12.101 21.251 1.000 1 A 94.510 1 ATOM 5470 H HB2 . HIS 333 333 ? A -9.659 13.881 21.917 1.000 1 A 94.510 1 ATOM 5471 H HB3 . HIS 333 333 ? A -10.341 13.595 20.319 1.000 1 A 94.510 1 ATOM 5472 H HD1 . HIS 333 333 ? A -6.850 14.380 21.806 1.000 1 A 94.510 1 ATOM 5473 H HD2 . HIS 333 333 ? A -9.321 15.279 18.538 1.000 1 A 94.510 1 ATOM 5474 H HE1 . HIS 333 333 ? A -5.555 16.047 20.339 1.000 1 A 94.510 1 ATOM 5475 N N . LEU 334 334 ? A -10.836 10.781 21.800 1.000 1 A 94.320 1 ATOM 5476 C CA . LEU 334 334 ? A -11.588 9.953 22.742 1.000 1 A 94.320 1 ATOM 5477 C C . LEU 334 334 ? A -10.825 8.665 23.086 1.000 1 A 94.320 1 ATOM 5478 O O . LEU 334 334 ? A -10.707 8.305 24.254 1.000 1 A 94.320 1 ATOM 5479 C CB . LEU 334 334 ? A -12.968 9.658 22.122 1.000 1 A 94.320 1 ATOM 5480 C CG . LEU 334 334 ? A -13.889 8.781 22.993 1.000 1 A 94.320 1 ATOM 5481 C CD1 . LEU 334 334 ? A -14.277 9.477 24.299 1.000 1 A 94.320 1 ATOM 5482 C CD2 . LEU 334 334 ? A -15.166 8.461 22.223 1.000 1 A 94.320 1 ATOM 5483 H H . LEU 334 334 ? A -11.248 10.950 20.893 1.000 1 A 94.320 1 ATOM 5484 H HA . LEU 334 334 ? A -11.724 10.511 23.669 1.000 1 A 94.320 1 ATOM 5485 H HB2 . LEU 334 334 ? A -13.474 10.602 21.920 1.000 1 A 94.320 1 ATOM 5486 H HB3 . LEU 334 334 ? A -12.820 9.150 21.169 1.000 1 A 94.320 1 ATOM 5487 H HG . LEU 334 334 ? A -13.389 7.840 23.224 1.000 1 A 94.320 1 ATOM 5488 H HD11 . LEU 334 334 ? A -14.749 10.438 24.092 1.000 1 A 94.320 1 ATOM 5489 H HD12 . LEU 334 334 ? A -13.395 9.619 24.925 1.000 1 A 94.320 1 ATOM 5490 H HD13 . LEU 334 334 ? A -14.980 8.850 24.847 1.000 1 A 94.320 1 ATOM 5491 H HD21 . LEU 334 334 ? A -15.787 7.786 22.812 1.000 1 A 94.320 1 ATOM 5492 H HD22 . LEU 334 334 ? A -15.731 9.373 22.026 1.000 1 A 94.320 1 ATOM 5493 H HD23 . LEU 334 334 ? A -14.924 7.966 21.283 1.000 1 A 94.320 1 ATOM 5494 N N . LEU 335 335 ? A -10.272 7.992 22.073 1.000 1 A 94.360 1 ATOM 5495 C CA . LEU 335 335 ? A -9.725 6.643 22.223 1.000 1 A 94.360 1 ATOM 5496 C C . LEU 335 335 ? A -8.216 6.578 22.497 1.000 1 A 94.360 1 ATOM 5497 O O . LEU 335 335 ? A -7.721 5.528 22.897 1.000 1 A 94.360 1 ATOM 5498 C CB . LEU 335 335 ? A -10.130 5.798 21.009 1.000 1 A 94.360 1 ATOM 5499 C CG . LEU 335 335 ? A -11.646 5.554 20.878 1.000 1 A 94.360 1 ATOM 5500 C CD1 . LEU 335 335 ? A -11.910 4.707 19.637 1.000 1 A 94.360 1 ATOM 5501 C CD2 . LEU 335 335 ? A -12.240 4.819 22.080 1.000 1 A 94.360 1 ATOM 5502 H H . LEU 335 335 ? A -10.434 8.338 21.138 1.000 1 A 94.360 1 ATOM 5503 H HA . LEU 335 335 ? A -10.192 6.190 23.098 1.000 1 A 94.360 1 ATOM 5504 H HB2 . LEU 335 335 ? A -9.633 4.830 21.074 1.000 1 A 94.360 1 ATOM 5505 H HB3 . LEU 335 335 ? A -9.778 6.309 20.113 1.000 1 A 94.360 1 ATOM 5506 H HG . LEU 335 335 ? A -12.164 6.506 20.759 1.000 1 A 94.360 1 ATOM 5507 H HD11 . LEU 335 335 ? A -11.581 5.242 18.746 1.000 1 A 94.360 1 ATOM 5508 H HD12 . LEU 335 335 ? A -11.402 3.746 19.713 1.000 1 A 94.360 1 ATOM 5509 H HD13 . LEU 335 335 ? A -12.982 4.533 19.554 1.000 1 A 94.360 1 ATOM 5510 H HD21 . LEU 335 335 ? A -11.691 3.898 22.276 1.000 1 A 94.360 1 ATOM 5511 H HD22 . LEU 335 335 ? A -13.282 4.569 21.879 1.000 1 A 94.360 1 ATOM 5512 H HD23 . LEU 335 335 ? A -12.221 5.451 22.968 1.000 1 A 94.360 1 ATOM 5513 N N . LYS 336 336 ? A -7.464 7.676 22.332 1.000 1 A 88.840 1 ATOM 5514 C CA . LYS 336 336 ? A -5.991 7.689 22.468 1.000 1 A 88.840 1 ATOM 5515 C C . LYS 336 336 ? A -5.479 7.102 23.790 1.000 1 A 88.840 1 ATOM 5516 O O . LYS 336 336 ? A -4.429 6.470 23.797 1.000 1 A 88.840 1 ATOM 5517 C CB . LYS 336 336 ? A -5.484 9.130 22.294 1.000 1 A 88.840 1 ATOM 5518 C CG . LYS 336 336 ? A -3.955 9.228 22.357 1.000 1 A 88.840 1 ATOM 5519 C CD . LYS 336 336 ? A -3.499 10.671 22.153 1.000 1 A 88.840 1 ATOM 5520 C CE . LYS 336 336 ? A -1.970 10.693 22.161 1.000 1 A 88.840 1 ATOM 5521 N NZ . LYS 336 336 ? A -1.448 12.066 21.974 1.000 1 A 88.840 1 ATOM 5522 H H . LYS 336 336 ? A -7.921 8.486 21.938 1.000 1 A 88.840 1 ATOM 5523 H HA . LYS 336 336 ? A -5.574 7.064 21.679 1.000 1 A 88.840 1 ATOM 5524 H HB2 . LYS 336 336 ? A -5.924 9.763 23.064 1.000 1 A 88.840 1 ATOM 5525 H HB3 . LYS 336 336 ? A -5.793 9.500 21.316 1.000 1 A 88.840 1 ATOM 5526 H HG2 . LYS 336 336 ? A -3.595 8.896 23.331 1.000 1 A 88.840 1 ATOM 5527 H HG3 . LYS 336 336 ? A -3.525 8.596 21.581 1.000 1 A 88.840 1 ATOM 5528 H HD2 . LYS 336 336 ? A -3.877 11.039 21.199 1.000 1 A 88.840 1 ATOM 5529 H HD3 . LYS 336 336 ? A -3.890 11.288 22.962 1.000 1 A 88.840 1 ATOM 5530 H HE2 . LYS 336 336 ? A -1.617 10.042 21.361 1.000 1 A 88.840 1 ATOM 5531 H HE3 . LYS 336 336 ? A -1.625 10.275 23.107 1.000 1 A 88.840 1 ATOM 5532 H HZ1 . LYS 336 336 ? A -0.438 12.058 21.990 1.000 1 A 88.840 1 ATOM 5533 H HZ2 . LYS 336 336 ? A -1.758 12.431 21.084 1.000 1 A 88.840 1 ATOM 5534 H HZ3 . LYS 336 336 ? A -1.782 12.667 22.714 1.000 1 A 88.840 1 ATOM 5535 N N . ASN 337 337 ? A -6.195 7.343 24.887 1.000 1 A 86.930 1 ATOM 5536 C CA . ASN 337 337 ? A -5.843 6.866 26.230 1.000 1 A 86.930 1 ATOM 5537 C C . ASN 337 337 ? A -6.908 5.922 26.804 1.000 1 A 86.930 1 ATOM 5538 O O . ASN 337 337 ? A -6.973 5.740 28.021 1.000 1 A 86.930 1 ATOM 5539 C CB . ASN 337 337 ? A -5.618 8.074 27.153 1.000 1 A 86.930 1 ATOM 5540 C CG . ASN 337 337 ? A -4.468 8.970 26.746 1.000 1 A 86.930 1 ATOM 5541 O OD1 . ASN 337 337 ? A -3.455 8.575 26.195 1.000 1 A 86.930 1 ATOM 5542 N ND2 . ASN 337 337 ? A -4.576 10.245 27.037 1.000 1 A 86.930 1 ATOM 5543 H H . ASN 337 337 ? A -7.078 7.817 24.763 1.000 1 A 86.930 1 ATOM 5544 H HA . ASN 337 337 ? A -4.920 6.289 26.182 1.000 1 A 86.930 1 ATOM 5545 H HB2 . ASN 337 337 ? A -6.538 8.658 27.192 1.000 1 A 86.930 1 ATOM 5546 H HB3 . ASN 337 337 ? A -5.404 7.723 28.162 1.000 1 A 86.930 1 ATOM 5547 H HD21 . ASN 337 337 ? A -5.404 10.580 27.507 1.000 1 A 86.930 1 ATOM 5548 H HD22 . ASN 337 337 ? A -3.769 10.821 26.845 1.000 1 A 86.930 1 ATOM 5549 N N . TYR 338 338 ? A -7.775 5.384 25.947 1.000 1 A 90.080 1 ATOM 5550 C CA . TYR 338 338 ? A -8.854 4.520 26.385 1.000 1 A 90.080 1 ATOM 5551 C C . TYR 338 338 ? A -8.301 3.240 27.016 1.000 1 A 90.080 1 ATOM 5552 O O . TYR 338 338 ? A -7.327 2.660 26.533 1.000 1 A 90.080 1 ATOM 5553 C CB . TYR 338 338 ? A -9.789 4.234 25.213 1.000 1 A 90.080 1 ATOM 5554 C CG . TYR 338 338 ? A -10.961 3.382 25.617 1.000 1 A 90.080 1 ATOM 5555 C CD1 . TYR 338 338 ? A -10.986 2.008 25.306 1.000 1 A 90.080 1 ATOM 5556 C CD2 . TYR 338 338 ? A -11.985 3.963 26.385 1.000 1 A 90.080 1 ATOM 5557 C CE1 . TYR 338 338 ? A -12.041 1.215 25.790 1.000 1 A 90.080 1 ATOM 5558 C CE2 . TYR 338 338 ? A -13.033 3.169 26.869 1.000 1 A 90.080 1 ATOM 5559 C CZ . TYR 338 338 ? A -13.055 1.794 26.579 1.000 1 A 90.080 1 ATOM 5560 O OH . TYR 338 338 ? A -14.056 1.042 27.076 1.000 1 A 90.080 1 ATOM 5561 H H . TYR 338 338 ? A -7.630 5.482 24.952 1.000 1 A 90.080 1 ATOM 5562 H HA . TYR 338 338 ? A -9.426 5.049 27.147 1.000 1 A 90.080 1 ATOM 5563 H HB2 . TYR 338 338 ? A -10.183 5.188 24.862 1.000 1 A 90.080 1 ATOM 5564 H HB3 . TYR 338 338 ? A -9.240 3.753 24.404 1.000 1 A 90.080 1 ATOM 5565 H HD1 . TYR 338 338 ? A -10.198 1.555 24.723 1.000 1 A 90.080 1 ATOM 5566 H HD2 . TYR 338 338 ? A -11.971 5.018 26.618 1.000 1 A 90.080 1 ATOM 5567 H HE1 . TYR 338 338 ? A -12.078 0.153 25.597 1.000 1 A 90.080 1 ATOM 5568 H HE2 . TYR 338 338 ? A -13.817 3.601 27.472 1.000 1 A 90.080 1 ATOM 5569 H HH . TYR 338 338 ? A -14.634 1.549 27.652 1.000 1 A 90.080 1 ATOM 5570 N N . LYS 339 339 ? A -8.923 2.819 28.116 1.000 1 A 88.000 1 ATOM 5571 C CA . LYS 339 339 ? A -8.638 1.558 28.797 1.000 1 A 88.000 1 ATOM 5572 C C . LYS 339 339 ? A -9.921 0.749 28.813 1.000 1 A 88.000 1 ATOM 5573 O O . LYS 339 339 ? A -10.949 1.284 29.211 1.000 1 A 88.000 1 ATOM 5574 C CB . LYS 339 339 ? A -8.145 1.803 30.228 1.000 1 A 88.000 1 ATOM 5575 C CG . LYS 339 339 ? A -6.780 2.497 30.275 1.000 1 A 88.000 1 ATOM 5576 C CD . LYS 339 339 ? A -6.311 2.590 31.729 1.000 1 A 88.000 1 ATOM 5577 C CE . LYS 339 339 ? A -4.934 3.249 31.802 1.000 1 A 88.000 1 ATOM 5578 N NZ . LYS 339 339 ? A -4.443 3.268 33.200 1.000 1 A 88.000 1 ATOM 5579 H H . LYS 339 339 ? A -9.782 3.283 28.376 1.000 1 A 88.000 1 ATOM 5580 H HA . LYS 339 339 ? A -7.887 0.993 28.245 1.000 1 A 88.000 1 ATOM 5581 H HB2 . LYS 339 339 ? A -8.069 0.837 30.729 1.000 1 A 88.000 1 ATOM 5582 H HB3 . LYS 339 339 ? A -8.880 2.405 30.764 1.000 1 A 88.000 1 ATOM 5583 H HG2 . LYS 339 339 ? A -6.060 1.918 29.697 1.000 1 A 88.000 1 ATOM 5584 H HG3 . LYS 339 339 ? A -6.858 3.498 29.851 1.000 1 A 88.000 1 ATOM 5585 H HD2 . LYS 339 339 ? A -7.034 3.176 32.298 1.000 1 A 88.000 1 ATOM 5586 H HD3 . LYS 339 339 ? A -6.261 1.585 32.147 1.000 1 A 88.000 1 ATOM 5587 H HE2 . LYS 339 339 ? A -4.251 2.686 31.165 1.000 1 A 88.000 1 ATOM 5588 H HE3 . LYS 339 339 ? A -5.012 4.260 31.402 1.000 1 A 88.000 1 ATOM 5589 H HZ1 . LYS 339 339 ? A -5.089 3.780 33.784 1.000 1 A 88.000 1 ATOM 5590 H HZ2 . LYS 339 339 ? A -4.386 2.323 33.553 1.000 1 A 88.000 1 ATOM 5591 H HZ3 . LYS 339 339 ? A -3.529 3.694 33.254 1.000 1 A 88.000 1 ATOM 5592 N N . LEU 340 340 ? A -9.825 -0.515 28.412 1.000 1 A 86.150 1 ATOM 5593 C CA . LEU 340 340 ? A -10.949 -1.448 28.409 1.000 1 A 86.150 1 ATOM 5594 C C . LEU 340 340 ? A -11.550 -1.533 29.810 1.000 1 A 86.150 1 ATOM 5595 O O . LEU 340 340 ? A -10.859 -1.912 30.756 1.000 1 A 86.150 1 ATOM 5596 C CB . LEU 340 340 ? A -10.452 -2.828 27.949 1.000 1 A 86.150 1 ATOM 5597 C CG . LEU 340 340 ? A -10.041 -2.875 26.470 1.000 1 A 86.150 1 ATOM 5598 C CD1 . LEU 340 340 ? A -9.250 -4.147 26.189 1.000 1 A 86.150 1 ATOM 5599 C CD2 . LEU 340 340 ? A -11.254 -2.865 25.550 1.000 1 A 86.150 1 ATOM 5600 H H . LEU 340 340 ? A -8.929 -0.866 28.105 1.000 1 A 86.150 1 ATOM 5601 H HA . LEU 340 340 ? A -11.725 -1.089 27.733 1.000 1 A 86.150 1 ATOM 5602 H HB2 . LEU 340 340 ? A -11.244 -3.560 28.111 1.000 1 A 86.150 1 ATOM 5603 H HB3 . LEU 340 340 ? A -9.600 -3.112 28.565 1.000 1 A 86.150 1 ATOM 5604 H HG . LEU 340 340 ? A -9.407 -2.020 26.234 1.000 1 A 86.150 1 ATOM 5605 H HD11 . LEU 340 340 ? A -8.998 -4.195 25.130 1.000 1 A 86.150 1 ATOM 5606 H HD12 . LEU 340 340 ? A -9.840 -5.028 26.443 1.000 1 A 86.150 1 ATOM 5607 H HD13 . LEU 340 340 ? A -8.327 -4.160 26.768 1.000 1 A 86.150 1 ATOM 5608 H HD21 . LEU 340 340 ? A -11.910 -2.020 25.761 1.000 1 A 86.150 1 ATOM 5609 H HD22 . LEU 340 340 ? A -11.829 -3.781 25.690 1.000 1 A 86.150 1 ATOM 5610 H HD23 . LEU 340 340 ? A -10.913 -2.814 24.516 1.000 1 A 86.150 1 ATOM 5611 N N . LYS 341 341 ? A -12.824 -1.172 29.939 1.000 1 A 86.170 1 ATOM 5612 C CA . LYS 341 341 ? A -13.541 -1.235 31.215 1.000 1 A 86.170 1 ATOM 5613 C C . LYS 341 341 ? A -13.882 -2.689 31.524 1.000 1 A 86.170 1 ATOM 5614 O O . LYS 341 341 ? A -13.593 -3.157 32.621 1.000 1 A 86.170 1 ATOM 5615 C CB . LYS 341 341 ? A -14.776 -0.328 31.129 1.000 1 A 86.170 1 ATOM 5616 C CG . LYS 341 341 ? A -15.693 -0.418 32.359 1.000 1 A 86.170 1 ATOM 5617 C CD . LYS 341 341 ? A -17.021 0.289 32.067 1.000 1 A 86.170 1 ATOM 5618 C CE . LYS 341 341 ? A -18.069 -0.083 33.119 1.000 1 A 86.170 1 ATOM 5619 N NZ . LYS 341 341 ? A -19.438 0.112 32.583 1.000 1 A 86.170 1 ATOM 5620 H H . LYS 341 341 ? A -13.346 -0.987 29.095 1.000 1 A 86.170 1 ATOM 5621 H HA . LYS 341 341 ? A -12.894 -0.883 32.018 1.000 1 A 86.170 1 ATOM 5622 H HB2 . LYS 341 341 ? A -15.346 -0.609 30.244 1.000 1 A 86.170 1 ATOM 5623 H HB3 . LYS 341 341 ? A -14.454 0.705 30.997 1.000 1 A 86.170 1 ATOM 5624 H HG2 . LYS 341 341 ? A -15.206 0.033 33.224 1.000 1 A 86.170 1 ATOM 5625 H HG3 . LYS 341 341 ? A -15.910 -1.464 32.577 1.000 1 A 86.170 1 ATOM 5626 H HD2 . LYS 341 341 ? A -17.377 -0.047 31.093 1.000 1 A 86.170 1 ATOM 5627 H HD3 . LYS 341 341 ? A -16.876 1.369 32.030 1.000 1 A 86.170 1 ATOM 5628 H HE2 . LYS 341 341 ? A -17.943 -1.141 33.350 1.000 1 A 86.170 1 ATOM 5629 H HE3 . LYS 341 341 ? A -17.905 0.489 34.033 1.000 1 A 86.170 1 ATOM 5630 H HZ1 . LYS 341 341 ? A -19.535 -0.401 31.719 1.000 1 A 86.170 1 ATOM 5631 H HZ2 . LYS 341 341 ? A -19.668 1.071 32.367 1.000 1 A 86.170 1 ATOM 5632 H HZ3 . LYS 341 341 ? A -20.143 -0.308 33.173 1.000 1 A 86.170 1 ATOM 5633 N N . SER 342 342 ? A -14.425 -3.407 30.543 1.000 1 A 72.970 1 ATOM 5634 C CA . SER 342 342 ? A -14.854 -4.799 30.710 1.000 1 A 72.970 1 ATOM 5635 C C . SER 342 342 ? A -13.698 -5.774 30.937 1.000 1 A 72.970 1 ATOM 5636 O O . SER 342 342 ? A -13.882 -6.769 31.616 1.000 1 A 72.970 1 ATOM 5637 C CB . SER 342 342 ? A -15.688 -5.236 29.506 1.000 1 A 72.970 1 ATOM 5638 O OG . SER 342 342 ? A -16.884 -4.486 29.471 1.000 1 A 72.970 1 ATOM 5639 H H . SER 342 342 ? A -14.696 -2.927 29.696 1.000 1 A 72.970 1 ATOM 5640 H HA . SER 342 342 ? A -15.493 -4.865 31.591 1.000 1 A 72.970 1 ATOM 5641 H HB2 . SER 342 342 ? A -15.128 -5.088 28.583 1.000 1 A 72.970 1 ATOM 5642 H HB3 . SER 342 342 ? A -15.937 -6.293 29.606 1.000 1 A 72.970 1 ATOM 5643 H HG . SER 342 342 ? A -16.685 -3.630 29.084 1.000 1 A 72.970 1 ATOM 5644 N N . MET 343 343 ? A -12.490 -5.492 30.440 1.000 1 A 76.280 1 ATOM 5645 C CA . MET 343 343 ? A -11.322 -6.351 30.701 1.000 1 A 76.280 1 ATOM 5646 C C . MET 343 343 ? A -10.753 -6.181 32.125 1.000 1 A 76.280 1 ATOM 5647 O O . MET 343 343 ? A -10.018 -7.041 32.603 1.000 1 A 76.280 1 ATOM 5648 C CB . MET 343 343 ? A -10.248 -6.048 29.648 1.000 1 A 76.280 1 ATOM 5649 C CG . MET 343 343 ? A -9.144 -7.106 29.585 1.000 1 A 76.280 1 ATOM 5650 S SD . MET 343 343 ? A -7.791 -6.623 28.489 1.000 1 A 76.280 1 ATOM 5651 C CE . MET 343 343 ? A -6.808 -8.141 28.505 1.000 1 A 76.280 1 ATOM 5652 H H . MET 343 343 ? A -12.378 -4.657 29.883 1.000 1 A 76.280 1 ATOM 5653 H HA . MET 343 343 ? A -11.627 -7.393 30.594 1.000 1 A 76.280 1 ATOM 5654 H HB2 . MET 343 343 ? A -10.714 -5.995 28.664 1.000 1 A 76.280 1 ATOM 5655 H HB3 . MET 343 343 ? A -9.800 -5.081 29.874 1.000 1 A 76.280 1 ATOM 5656 H HG2 . MET 343 343 ? A -8.722 -7.269 30.577 1.000 1 A 76.280 1 ATOM 5657 H HG3 . MET 343 343 ? A -9.575 -8.043 29.233 1.000 1 A 76.280 1 ATOM 5658 H HE1 . MET 343 343 ? A -6.463 -8.348 29.518 1.000 1 A 76.280 1 ATOM 5659 H HE2 . MET 343 343 ? A -7.419 -8.969 28.144 1.000 1 A 76.280 1 ATOM 5660 H HE3 . MET 343 343 ? A -5.957 -8.016 27.836 1.000 1 A 76.280 1 ATOM 5661 N N . LEU 344 344 ? A -11.036 -5.051 32.786 1.000 1 A 73.250 1 ATOM 5662 C CA . LEU 344 344 ? A -10.576 -4.757 34.151 1.000 1 A 73.250 1 ATOM 5663 C C . LEU 344 344 ? A -11.517 -5.300 35.240 1.000 1 A 73.250 1 ATOM 5664 O O . LEU 344 344 ? A -11.132 -5.277 36.411 1.000 1 A 73.250 1 ATOM 5665 C CB . LEU 344 344 ? A -10.410 -3.233 34.310 1.000 1 A 73.250 1 ATOM 5666 C CG . LEU 344 344 ? A -9.246 -2.610 33.522 1.000 1 A 73.250 1 ATOM 5667 C CD1 . LEU 344 344 ? A -9.325 -1.082 33.615 1.000 1 A 73.250 1 ATOM 5668 C CD2 . LEU 344 344 ? A -7.879 -3.035 34.067 1.000 1 A 73.250 1 ATOM 5669 H H . LEU 344 344 ? A -11.692 -4.408 32.368 1.000 1 A 73.250 1 ATOM 5670 H HA . LEU 344 344 ? A -9.618 -5.249 34.320 1.000 1 A 73.250 1 ATOM 5671 H HB2 . LEU 344 344 ? A -10.264 -3.004 35.366 1.000 1 A 73.250 1 ATOM 5672 H HB3 . LEU 344 344 ? A -11.341 -2.756 34.002 1.000 1 A 73.250 1 ATOM 5673 H HG . LEU 344 344 ? A -9.300 -2.908 32.475 1.000 1 A 73.250 1 ATOM 5674 H HD11 . LEU 344 344 ? A -8.519 -0.639 33.030 1.000 1 A 73.250 1 ATOM 5675 H HD12 . LEU 344 344 ? A -10.275 -0.755 33.193 1.000 1 A 73.250 1 ATOM 5676 H HD13 . LEU 344 344 ? A -9.263 -0.766 34.656 1.000 1 A 73.250 1 ATOM 5677 H HD21 . LEU 344 344 ? A -7.759 -4.110 33.938 1.000 1 A 73.250 1 ATOM 5678 H HD22 . LEU 344 344 ? A -7.087 -2.534 33.511 1.000 1 A 73.250 1 ATOM 5679 H HD23 . LEU 344 344 ? A -7.809 -2.794 35.128 1.000 1 A 73.250 1 ATOM 5680 N N . ALA 345 345 ? A -12.728 -5.721 34.862 1.000 1 A 66.230 1 ATOM 5681 C CA . ALA 345 345 ? A -13.702 -6.393 35.721 1.000 1 A 66.230 1 ATOM 5682 C C . ALA 345 345 ? A -13.443 -7.904 35.724 1.000 1 A 66.230 1 ATOM 5683 O O . ALA 345 345 ? A -13.491 -8.489 36.830 1.000 1 A 66.230 1 ATOM 5684 C CB . ALA 345 345 ? A -15.113 -6.050 35.218 1.000 1 A 66.230 1 ATOM 5685 O OXT . ALA 345 345 ? A -13.208 -8.425 34.609 1.000 1 A 66.230 1 ATOM 5686 H H . ALA 345 345 ? A -12.899 -5.814 33.871 1.000 1 A 66.230 1 ATOM 5687 H HA . ALA 345 345 ? A -13.589 -6.052 36.750 1.000 1 A 66.230 1 ATOM 5688 H HB1 . ALA 345 345 ? A -15.239 -6.428 34.203 1.000 1 A 66.230 1 ATOM 5689 H HB2 . ALA 345 345 ? A -15.850 -6.529 35.862 1.000 1 A 66.230 1 ATOM 5690 H HB3 . ALA 345 345 ? A -15.262 -4.971 35.228 1.000 1 A 66.230 1 loop_ _atom_type.symbol C H N O S loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.description _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.type_other_details _ma_qa_metric.software_group_id 1 pLDDT 'Predicted accuracy according to the CA-only lDDT in [0,100]' pLDDT global . . 2 pLDDT 'Predicted accuracy according to the CA-only lDDT in [0,100]' pLDDT local . . loop_ _ma_qa_metric_global.ordinal_id _ma_qa_metric_global.model_id _ma_qa_metric_global.metric_id _ma_qa_metric_global.metric_value 1 1 1 90.225 loop_ _ma_qa_metric_local.ordinal_id _ma_qa_metric_local.model_id _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value 1 1 A 1 MET 2 55.530 2 1 A 2 PHE 2 69.750 3 1 A 3 PRO 2 74.020 4 1 A 4 SER 2 82.850 5 1 A 5 LEU 2 81.500 6 1 A 6 GLN 2 85.250 7 1 A 7 SER 2 82.190 8 1 A 8 PHE 2 82.860 9 1 A 9 ALA 2 84.440 10 1 A 10 LYS 2 86.630 11 1 A 11 LYS 2 83.020 12 1 A 12 VAL 2 84.040 13 1 A 13 LEU 2 83.640 14 1 A 14 ALA 2 83.280 15 1 A 15 ARG 2 83.640 16 1 A 16 GLN 2 80.700 17 1 A 17 GLN 2 75.240 18 1 A 18 VAL 2 75.860 19 1 A 19 SER 2 82.590 20 1 A 20 ILE 2 84.010 21 1 A 21 GLU 2 85.550 22 1 A 22 TYR 2 85.130 23 1 A 23 HIS 2 88.610 24 1 A 24 VAL 2 87.560 25 1 A 25 ILE 2 86.170 26 1 A 26 LEU 2 87.540 27 1 A 27 GLU 2 88.610 28 1 A 28 ARG 2 87.750 29 1 A 29 CYS 2 86.790 30 1 A 30 GLY 2 87.990 31 1 A 31 LEU 2 90.910 32 1 A 32 TRP 2 91.020 33 1 A 33 TRP 2 92.620 34 1 A 34 TYR 2 89.460 35 1 A 35 LYS 2 87.200 36 1 A 36 ALA 2 89.200 37 1 A 37 PRO 2 89.200 38 1 A 38 ILE 2 90.520 39 1 A 39 SER 2 88.990 40 1 A 40 LEU 2 89.130 41 1 A 41 ASP 2 88.070 42 1 A 42 CYS 2 80.900 43 1 A 43 LYS 2 84.210 44 1 A 44 HIS 2 85.530 45 1 A 45 MET 2 87.610 46 1 A 46 LEU 2 91.700 47 1 A 47 ILE 2 90.810 48 1 A 48 LYS 2 87.930 49 1 A 49 LEU 2 84.740 50 1 A 50 PRO 2 78.960 51 1 A 51 SER 2 77.580 52 1 A 52 PHE 2 78.700 53 1 A 53 ALA 2 72.390 54 1 A 54 ASP 2 77.900 55 1 A 55 GLY 2 86.910 56 1 A 56 LEU 2 91.590 57 1 A 57 ASP 2 92.390 58 1 A 58 LEU 2 93.090 59 1 A 59 ASN 2 93.510 60 1 A 60 THR 2 93.620 61 1 A 61 ALA 2 94.520 62 1 A 62 LEU 2 96.090 63 1 A 63 MET 2 94.990 64 1 A 64 LEU 2 94.230 65 1 A 65 ALA 2 95.210 66 1 A 66 THR 2 95.530 67 1 A 67 LYS 2 93.270 68 1 A 68 GLU 2 93.060 69 1 A 69 ASN 2 94.320 70 1 A 70 ASN 2 94.550 71 1 A 71 TYR 2 95.340 72 1 A 72 GLN 2 93.560 73 1 A 73 LEU 2 95.140 74 1 A 74 ILE 2 96.470 75 1 A 75 LYS 2 95.560 76 1 A 76 LEU 2 94.050 77 1 A 77 PHE 2 95.070 78 1 A 78 THR 2 95.040 79 1 A 79 GLU 2 93.100 80 1 A 80 TRP 2 91.590 81 1 A 81 GLY 2 91.180 82 1 A 82 ALA 2 93.880 83 1 A 83 ASP 2 93.780 84 1 A 84 ILE 2 95.530 85 1 A 85 ASN 2 93.800 86 1 A 86 TYR 2 93.380 87 1 A 87 GLY 2 94.390 88 1 A 88 LEU 2 93.380 89 1 A 89 ILE 2 92.400 90 1 A 90 CYS 2 92.690 91 1 A 91 ALA 2 92.090 92 1 A 92 ASN 2 84.530 93 1 A 93 THR 2 90.540 94 1 A 94 PRO 2 92.410 95 1 A 95 PRO 2 95.780 96 1 A 96 VAL 2 95.050 97 1 A 97 ARG 2 94.190 98 1 A 98 GLU 2 95.590 99 1 A 99 PHE 2 97.170 100 1 A 100 CYS 2 96.490 101 1 A 101 TRP 2 95.600 102 1 A 102 GLU 2 96.070 103 1 A 103 LEU 2 95.940 104 1 A 104 GLY 2 95.000 105 1 A 105 ALA 2 94.510 106 1 A 106 LYS 2 92.250 107 1 A 107 TYR 2 84.840 108 1 A 108 ARG 2 85.130 109 1 A 109 VAL 2 82.340 110 1 A 110 ASP 2 86.670 111 1 A 111 LYS 2 89.920 112 1 A 112 LYS 2 90.920 113 1 A 113 LYS 2 90.150 114 1 A 114 ILE 2 91.300 115 1 A 115 MET 2 92.650 116 1 A 116 HIS 2 91.280 117 1 A 117 MET 2 91.140 118 1 A 118 PHE 2 92.670 119 1 A 119 PHE 2 92.090 120 1 A 120 LYS 2 90.930 121 1 A 121 LEU 2 91.840 122 1 A 122 ILE 2 90.930 123 1 A 123 HIS 2 86.160 124 1 A 124 PRO 2 79.140 125 1 A 125 GLY 2 81.620 126 1 A 126 THR 2 91.120 127 1 A 127 THR 2 91.370 128 1 A 128 SER 2 92.790 129 1 A 129 SER 2 90.770 130 1 A 130 ASN 2 92.160 131 1 A 131 ILE 2 93.780 132 1 A 132 ILE 2 93.900 133 1 A 133 LEU 2 92.470 134 1 A 134 CYS 2 93.360 135 1 A 135 LEU 2 93.880 136 1 A 136 LYS 2 92.080 137 1 A 137 LEU 2 92.550 138 1 A 138 PHE 2 92.440 139 1 A 139 ASN 2 87.850 140 1 A 140 ASP 2 84.420 141 1 A 141 ASN 2 85.750 142 1 A 142 PRO 2 81.170 143 1 A 143 PHE 2 86.210 144 1 A 144 PRO 2 84.510 145 1 A 145 ALA 2 84.100 146 1 A 146 TYR 2 87.590 147 1 A 147 VAL 2 88.370 148 1 A 148 ILE 2 88.560 149 1 A 149 ILE 2 86.790 150 1 A 150 ARG 2 88.850 151 1 A 151 GLU 2 89.010 152 1 A 152 ILE 2 84.190 153 1 A 153 ARG 2 83.770 154 1 A 154 SER 2 82.460 155 1 A 155 SER 2 82.410 156 1 A 156 ILE 2 81.430 157 1 A 157 TYR 2 81.800 158 1 A 158 TRP 2 81.250 159 1 A 159 LYS 2 82.300 160 1 A 160 LEU 2 82.440 161 1 A 161 LYS 2 80.140 162 1 A 162 ARG 2 73.110 163 1 A 163 LEU 2 76.290 164 1 A 164 VAL 2 72.640 165 1 A 165 GLU 2 66.910 166 1 A 166 ASP 2 71.380 167 1 A 167 THR 2 69.980 168 1 A 168 ASP 2 76.220 169 1 A 169 ILE 2 78.180 170 1 A 170 LEU 2 78.270 171 1 A 171 SER 2 78.160 172 1 A 172 ASN 2 83.140 173 1 A 173 MET 2 86.100 174 1 A 174 SER 2 88.230 175 1 A 175 ASP 2 86.490 176 1 A 176 GLY 2 88.240 177 1 A 177 ASP 2 90.580 178 1 A 178 MET 2 89.430 179 1 A 179 LEU 2 90.900 180 1 A 180 THR 2 93.380 181 1 A 181 ILE 2 91.680 182 1 A 182 TYR 2 90.200 183 1 A 183 CYS 2 92.520 184 1 A 184 PHE 2 93.070 185 1 A 185 ILE 2 90.360 186 1 A 186 VAL 2 91.090 187 1 A 187 ALA 2 93.350 188 1 A 188 LEU 2 90.430 189 1 A 189 GLN 2 87.550 190 1 A 190 ASP 2 89.910 191 1 A 191 ASN 2 90.460 192 1 A 192 LEU 2 92.860 193 1 A 193 ARG 2 92.720 194 1 A 194 GLU 2 92.510 195 1 A 195 ALA 2 93.770 196 1 A 196 ILE 2 93.160 197 1 A 197 SER 2 92.400 198 1 A 198 TYR 2 93.760 199 1 A 199 VAL 2 93.300 200 1 A 200 TYR 2 90.620 201 1 A 201 GLN 2 91.780 202 1 A 202 HIS 2 93.780 203 1 A 203 PHE 2 93.960 204 1 A 204 LYS 2 90.290 205 1 A 205 TYR 2 92.240 206 1 A 206 LEU 2 92.740 207 1 A 207 ASN 2 91.460 208 1 A 208 THR 2 90.190 209 1 A 209 TRP 2 91.030 210 1 A 210 TRP 2 92.060 211 1 A 211 LEU 2 92.780 212 1 A 212 ILE 2 92.380 213 1 A 213 CYS 2 91.520 214 1 A 214 ALA 2 92.940 215 1 A 215 LEU 2 94.280 216 1 A 216 CYS 2 91.000 217 1 A 217 PHE 2 90.440 218 1 A 218 ASN 2 93.300 219 1 A 219 LYS 2 93.300 220 1 A 220 LEU 2 95.370 221 1 A 221 PHE 2 94.440 222 1 A 222 ASP 2 92.120 223 1 A 223 LEU 2 94.990 224 1 A 224 HIS 2 95.670 225 1 A 225 ASN 2 92.950 226 1 A 226 LEU 2 92.800 227 1 A 227 TYR 2 94.820 228 1 A 228 GLU 2 92.000 229 1 A 229 LYS 2 88.800 230 1 A 230 GLU 2 88.640 231 1 A 231 LYS 2 91.490 232 1 A 232 ILE 2 90.080 233 1 A 233 ARG 2 89.970 234 1 A 234 MET 2 93.590 235 1 A 235 ASP 2 94.560 236 1 A 236 VAL 2 95.390 237 1 A 237 ASP 2 95.070 238 1 A 238 GLU 2 92.810 239 1 A 239 MET 2 94.800 240 1 A 240 MET 2 95.640 241 1 A 241 ARG 2 92.950 242 1 A 242 MET 2 92.300 243 1 A 243 ALA 2 94.580 244 1 A 244 CYS 2 93.750 245 1 A 245 THR 2 90.560 246 1 A 246 LYS 2 88.950 247 1 A 247 ASP 2 91.960 248 1 A 248 ASN 2 92.500 249 1 A 249 ASN 2 94.230 250 1 A 250 PHE 2 96.100 251 1 A 251 LEU 2 96.960 252 1 A 252 THR 2 96.670 253 1 A 253 ILE 2 97.280 254 1 A 254 TYR 2 97.530 255 1 A 255 TYR 2 97.550 256 1 A 256 CYS 2 97.190 257 1 A 257 PHE 2 97.190 258 1 A 258 LEU 2 96.470 259 1 A 259 LEU 2 95.720 260 1 A 260 GLY 2 95.710 261 1 A 261 ALA 2 97.110 262 1 A 262 ASN 2 97.430 263 1 A 263 ILE 2 97.140 264 1 A 264 ASN 2 97.820 265 1 A 265 SER 2 95.790 266 1 A 266 ALA 2 97.000 267 1 A 267 MET 2 97.470 268 1 A 268 LEU 2 96.810 269 1 A 269 ALA 2 94.630 270 1 A 270 CYS 2 95.730 271 1 A 271 VAL 2 96.160 272 1 A 272 ARG 2 93.210 273 1 A 273 PHE 2 91.060 274 1 A 274 TYR 2 93.580 275 1 A 275 ASN 2 94.150 276 1 A 276 MET 2 94.170 277 1 A 277 ASP 2 95.410 278 1 A 278 ASN 2 96.080 279 1 A 279 LEU 2 96.740 280 1 A 280 PHE 2 96.030 281 1 A 281 PHE 2 97.030 282 1 A 282 CYS 2 97.370 283 1 A 283 ILE 2 96.560 284 1 A 284 ASP 2 95.920 285 1 A 285 LEU 2 96.080 286 1 A 286 GLY 2 95.460 287 1 A 287 ALA 2 96.780 288 1 A 288 ASP 2 95.930 289 1 A 289 ALA 2 96.570 290 1 A 290 PHE 2 96.600 291 1 A 291 GLU 2 96.430 292 1 A 292 GLU 2 97.770 293 1 A 293 ALA 2 97.430 294 1 A 294 LYS 2 97.200 295 1 A 295 ALA 2 97.340 296 1 A 296 LEU 2 97.650 297 1 A 297 ALA 2 97.320 298 1 A 298 GLU 2 97.240 299 1 A 299 GLN 2 97.250 300 1 A 300 ARG 2 95.360 301 1 A 301 ASN 2 96.130 302 1 A 302 TYR 2 96.890 303 1 A 303 TYR 2 94.100 304 1 A 304 LEU 2 94.090 305 1 A 305 ILE 2 95.430 306 1 A 306 SER 2 95.310 307 1 A 307 HIS 2 94.160 308 1 A 308 HIS 2 93.290 309 1 A 309 LEU 2 94.520 310 1 A 310 SER 2 93.460 311 1 A 311 LEU 2 90.090 312 1 A 312 ASP 2 84.200 313 1 A 313 ILE 2 90.160 314 1 A 314 TYR 2 91.530 315 1 A 315 SER 2 89.610 316 1 A 316 ALA 2 92.320 317 1 A 317 ASP 2 92.270 318 1 A 318 SER 2 89.570 319 1 A 319 SER 2 90.360 320 1 A 320 LEU 2 91.070 321 1 A 321 LEU 2 88.020 322 1 A 322 THR 2 87.020 323 1 A 323 LEU 2 88.700 324 1 A 324 LYS 2 87.690 325 1 A 325 GLU 2 89.570 326 1 A 326 ALA 2 91.540 327 1 A 327 ASP 2 94.650 328 1 A 328 PRO 2 96.150 329 1 A 329 ASN 2 96.510 330 1 A 330 LYS 2 95.860 331 1 A 331 ILE 2 96.220 332 1 A 332 TYR 2 95.900 333 1 A 333 HIS 2 94.510 334 1 A 334 LEU 2 94.320 335 1 A 335 LEU 2 94.360 336 1 A 336 LYS 2 88.840 337 1 A 337 ASN 2 86.930 338 1 A 338 TYR 2 90.080 339 1 A 339 LYS 2 88.000 340 1 A 340 LEU 2 86.150 341 1 A 341 LYS 2 86.170 342 1 A 342 SER 2 72.970 343 1 A 343 MET 2 76.280 344 1 A 344 LEU 2 73.250 345 1 A 345 ALA 2 66.230 _database_2.database_id ModelArchive _database_2.database_code ma-asfv-asfvg-156 _database_2.pdbx_DOI 10.5452/ma-asfv-asfvg-156 _pdbx_database_status.entry_id ma-asfv-asfvg-156 _pdbx_database_status.date_coordinates 2022-07-29:17:48 _pdbx_database_status.status_code REL loop_ _pdbx_contact_author.id _pdbx_contact_author.name_salutation _pdbx_contact_author.name_first _pdbx_contact_author.name_last _pdbx_contact_author.name_mi _pdbx_contact_author.email _pdbx_contact_author.address_1 _pdbx_contact_author.address_2 _pdbx_contact_author.address_3 7 Dr. Manuel Borca . manuel.borca@usda.gov ;Plum Island Animal Disease Center, Agricultural Research Service 11944 Greenport New York United States ; . . 8 Dr. Douglas Gladue . douglas.gladue@usda.gov ;Plum Island Animal Disease Center, Agricultural Research Service 11944 Greenport New York United States ; . . 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 2022-09-30 2 'Structure model' 1 1 2023-06-29 3 'Structure model' 1 2 2023-07-19 4 'Structure model' 1 3 2023-07-20 loop_ _pdbx_audit_revision_details.ordinal _pdbx_audit_revision_details.revision_ordinal _pdbx_audit_revision_details.data_content_type _pdbx_audit_revision_details.provider _pdbx_audit_revision_details.type _pdbx_audit_revision_details.description 1 1 'Structure model' repository 'Initial release' ? 2 3 'Structure model' repository Remediation 'Reference database remediation' 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' 'Database references' 2 2 'Structure model' 'Source and taxonomy' 3 3 'Structure model' Other 4 3 'Structure model' 'Database references' 5 4 'Structure model' Other loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 2 'Structure model' ma_target_ref_db_details 2 3 'Structure model' ma_data 3 3 'Structure model' ma_data_group 4 3 'Structure model' ma_data_ref_db 5 4 'Structure model' exptl loop_ _pdbx_audit_revision_item.ordinal _pdbx_audit_revision_item.revision_ordinal _pdbx_audit_revision_item.data_content_type _pdbx_audit_revision_item.item 1 2 'Structure model' '_ma_target_ref_db_details.db_accession' 2 2 'Structure model' '_ma_target_ref_db_details.db_code' 3 3 'Structure model' '_ma_data.id' 4 3 'Structure model' '_ma_data.name' 5 3 'Structure model' '_ma_data.content_type' 6 3 'Structure model' '_ma_data.content_type_other_details' 7 3 'Structure model' '_ma_data_group.ordinal_id' 8 3 'Structure model' '_ma_data_group.group_id' 9 3 'Structure model' '_ma_data_group.data_id' 10 3 'Structure model' '_ma_data_ref_db.data_id' 11 3 'Structure model' '_ma_data_ref_db.name' 12 3 'Structure model' '_ma_data_ref_db.location_url' 13 3 'Structure model' '_ma_data_ref_db.version' 14 3 'Structure model' '_ma_data_ref_db.release_date' 15 4 'Structure model' '_exptl.entry_id' 16 4 'Structure model' '_exptl.method'